Model name? MEAM_LAMMPS_KimJungLee_2015_NiAlCo__MO_876687166519_002 Stoichiometric species (literal list of strings)? ['Al', 'Co'] Prototype label? A13B4_oP102_31_17a11b_8a2b Temperature (K)? No temperature given Cauchy stress (literal list of floats, Voigt order xx,yy,zz,yz,xz,xy, eV/A^3)? No stress given Query result (literal list of dicts)? [{'instance-id': 2, 'a.si-value': 7.707900000000001e-10, 'parameter-names.source-value': ['b/a', 'c/a', 'y1', 'z1', 'y2', 'z2', 'y3', 'z3', 'y4', 'z4', 'y5', 'z5', 'y6', 'z6', 'y7', 'z7', 'y8', 'z8', 'y9', 'z9', 'y10', 'z10', 'y11', 'z11', 'y12', 'z12', 'y13', 'z13', 'y14', 'z14', 'y15', 'z15', 'y16', 'z16', 'y17', 'z17', 'y18', 'z18', 'y19', 'z19', 'y20', 'z20', 'y21', 'z21', 'y22', 'z22', 'y23', 'z23', 'y24', 'z24', 'y25', 'z25', 'x26', 'y26', 'z26', 'x27', 'y27', 'z27', 'x28', 'y28', 'z28', 'x29', 'y29', 'z29', 'x30', 'y30', 'z30', 'x31', 'y31', 'z31', 'x32', 'y32', 'z32', 'x33', 'y33', 'z33', 'x34', 'y34', 'z34', 'x35', 'y35', 'z35', 'x36', 'y36', 'z36', 'x37', 'y37', 'z37', 'x38', 'y38', 'z38'], 'parameter-values.source-value': [1.5809235, 2.0530624, 0.013707831, 0.79434122, 0.093771718, 0.96179663, 0.36316431, 0.16892197, 0.91831621, 0.59564777, 0.90352578, 0.42570816, 0.1367156, 0.66102668, 0.7974634, 0.14486084, 0.81757048, 0.85010862, 0.26912541, 0.42627282, 0.70558021, 0.68448543, 0.59887778, 0.40219472, 0.48352006, 0.033326957, 0.58480148, 0.2324602, 0.68130144, 0.97830134, 0.13527597, 0.218293, 0.36471468, 0.60846851, 0.40371931, 0.86595919, 0.42012804, 0.31930256, 0.72705098, 0.52155446, 0.88320486, 0.99931857, 0.082501366, 0.51047643, 0.20244499, 0.82911139, 0.77495739, 0.30674241, 0.61808964, 0.82803459, 0.29533408, 0.99865183, 0.18393653, 0.50758465, 0.73203648, 0.22235012, 0.21907105, 0.084891202, 0.1738597, 0.94053211, 0.26387641, 0.2549085, 0.24870255, 0.91404628, 0.18343934, 0.99505929, 0.09486863, 0.22996753, 0.21211848, 0.54017812, 0.1726572, 0.56012163, 0.56366928, 0.22259013, 0.28171898, 0.74421243, 0.25001079, 0.44435208, 0.41307955, 0.22251853, 0.28405253, 0.29275109, 0.24487789, 0.061978662, 0.41201568, 0.17787408, 0.87689813, 0.71721349, 0.17748906, 0.62127773, 0.11062824], 'meta.uuid': 'TE_373023624848_002-and-MO_876687166519_002-1710527935-tr'}] Runtime arguments (literal dictonary)? {} ==== Building ASE atoms object with: ==== representative atom symbols = ['Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Al', 'Co', 'Co', 'Co', 'Co', 'Co', 'Co', 'Co', 'Co', 'Co', 'Co'] representative atom coordinates = [[0. 0.01370783 0.79434122] [0. 0.09377172 0.96179663] [0. 0.36316431 0.16892197] [0. 0.91831621 0.59564777] [0. 0.90352578 0.42570816] [0. 0.1367156 0.66102668] [0. 0.7974634 0.14486084] [0. 0.81757048 0.85010862] [0. 0.26912541 0.42627282] [0. 0.70558021 0.68448543] [0. 0.59887778 0.40219472] [0. 0.48352006 0.03332696] [0. 0.58480148 0.2324602 ] [0. 0.68130144 0.97830134] [0. 0.13527597 0.218293 ] [0. 0.36471468 0.60846851] [0. 0.40371931 0.86595919] [0.18393653 0.50758465 0.73203648] [0.22235012 0.21907105 0.0848912 ] [0.1738597 0.94053211 0.26387641] [0.2549085 0.24870255 0.91404628] [0.18343934 0.99505929 0.09486863] [0.22996753 0.21211848 0.54017812] [0.1726572 0.56012163 0.56366928] [0.22259013 0.28171898 0.74421243] [0.25001079 0.44435208 0.41307955] [0.22251853 0.28405253 0.29275109] [0.24487789 0.06197866 0.41201568] [0. 0.42012804 0.31930256] [0. 0.72705098 0.52155446] [0. 0.88320486 0.99931857] [0. 0.08250137 0.51047643] [0. 0.20244499 0.82911139] [0. 0.77495739 0.30674241] [0. 0.61808964 0.82803459] [0. 0.29533408 0.99865183] [0.17787408 0.87689813 0.71721349] [0.17748906 0.62127773 0.11062824]] spacegroup = 31 cell = [[7.7079, 0, 0], [0, 12.1856, 0], [0, 0, 15.8248]] ========================================= E L A S T I C C O N S T A N T C A L C U L A T I O N S Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 16 steps. Minimization converged after 32 steps. Minimization converged after 37 steps. Minimization converged after 16 steps. Minimization converged after 29 steps. Minimization converged after 26 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.91514321e-03 -2.98165785e-04 -1.73859611e-03] [-2.91514321e-03 2.98165802e-04 -1.73859611e-03] [ 4.57714027e-03 2.84714611e-03 -3.79213420e-03] [-4.57714027e-03 -2.84714611e-03 -3.79213420e-03] [ 2.39378063e-03 2.89113258e-04 -2.87271989e-03] [-2.39378062e-03 -2.89113254e-04 -2.87271988e-03] [-7.43146775e-03 3.34583866e-03 -6.07009318e-03] [ 7.43146775e-03 -3.34583865e-03 -6.07009317e-03] [-2.63657735e-04 1.19175552e-02 -1.85118808e-03] [ 2.63657738e-04 -1.19175552e-02 -1.85118808e-03] [-8.07809940e-04 -3.14496583e-03 -1.51070350e-03] [ 8.07809941e-04 3.14496583e-03 -1.51070350e-03] [-4.65231838e-03 2.54608290e-03 -2.29685356e-04] [ 4.65231838e-03 -2.54608290e-03 -2.29685359e-04] [-4.54139305e-03 6.19452289e-04 1.19513590e-02] [ 4.54139305e-03 -6.19452296e-04 1.19513590e-02] [-2.64777158e-03 1.69763781e-03 -2.24101063e-03] [ 2.64777159e-03 -1.69763781e-03 -2.24101063e-03] [ 1.15862176e-03 -6.58674786e-03 2.27169846e-03] [-1.15862176e-03 6.58674786e-03 2.27169846e-03] [ 1.05934663e-02 -9.09217216e-03 5.17861000e-03] [-1.05934663e-02 9.09217215e-03 5.17861001e-03] [-9.06493771e-03 -2.04254183e-03 -7.36514625e-04] [ 9.06493771e-03 2.04254183e-03 -7.36514626e-04] [ 3.47627196e-03 -3.69847126e-03 -2.55483932e-03] [-3.47627196e-03 3.69847126e-03 -2.55483931e-03] [ 5.01270352e-04 2.79486402e-03 -1.16151069e-02] [-5.01270350e-04 -2.79486401e-03 -1.16151069e-02] [ 4.05207170e-03 1.11874298e-02 -2.67639910e-03] [-4.05207170e-03 -1.11874298e-02 -2.67639910e-03] [-1.07125298e-03 -9.70535076e-03 2.72534322e-03] [ 1.07125298e-03 9.70535076e-03 2.72534321e-03] [-8.78787277e-03 -3.39115345e-03 5.07585423e-04] [ 8.78787277e-03 3.39115345e-03 5.07585430e-04] [-8.18541760e-03 3.44861708e-03 1.32127791e-03] [ 8.18541760e-03 -3.44861708e-03 1.32127791e-03] [-2.74902236e-03 2.83945593e-03 7.51297424e-03] [ 2.74902236e-03 -2.83945594e-03 7.51297424e-03] [-2.43809101e-03 3.75131829e-03 6.34750075e-03] [ 2.43809101e-03 -3.75131829e-03 6.34750075e-03] [ 6.68586402e-04 -2.15543210e-03 -2.34264341e-03] [-6.68586408e-04 2.15543210e-03 -2.34264341e-03] [-6.64109894e-03 -1.38880728e-02 -4.51491879e-03] [ 6.64109894e-03 1.38880728e-02 -4.51491879e-03] [-2.80857182e-03 1.44501364e-03 7.91981564e-03] [ 2.80857181e-03 -1.44501363e-03 7.91981563e-03] [-5.00555389e-03 4.55760544e-03 6.26173427e-03] [ 5.00555389e-03 -4.55760544e-03 6.26173427e-03] [ 1.72610236e-03 1.45869175e-03 -8.57566401e-03] [-1.72610236e-03 -1.45869175e-03 -8.57566401e-03] [-5.15105591e-04 -1.19124105e-03 -6.13461608e-03] [ 5.15105585e-04 1.19124104e-03 -6.13461608e-03] [-5.99993031e-03 -2.06179564e-03 -3.63579858e-03] [ 5.99993031e-03 2.06179564e-03 -3.63579858e-03] [-3.85158011e-05 6.99300871e-04 1.29067583e-02] [ 3.85157994e-05 -6.99300874e-04 1.29067583e-02] [-1.42799975e-02 2.22818756e-03 1.78592302e-03] [ 1.42799975e-02 -2.22818756e-03 1.78592303e-03] [-8.15477635e-05 6.58826639e-03 -3.53945205e-03] [ 8.15477617e-05 -6.58826639e-03 -3.53945206e-03] [-9.21090346e-03 -2.65724323e-03 -1.02436217e-03] [ 9.21090346e-03 2.65724324e-03 -1.02436217e-03] [-4.94890548e-04 -3.26677497e-05 1.27602002e-02] [ 4.94890549e-04 3.26677482e-05 1.27602002e-02] [-2.42492668e-03 6.41299130e-03 -1.21750959e-02] [ 2.42492668e-03 -6.41299130e-03 -1.21750959e-02] [-2.50267819e-03 -1.99176287e-03 6.24383027e-03] [ 2.50267820e-03 1.99176287e-03 6.24383027e-03] [-9.46482697e-05 2.87388595e-03 -3.13336496e-03] [ 9.46482681e-05 -2.87388595e-03 -3.13336497e-03] [ 1.26208573e-02 -7.31639907e-03 -1.11165423e-02] [-1.26208573e-02 7.31639908e-03 -1.11165423e-02] [-2.60191886e-02 -5.61880106e-03 -1.17182068e-03] [ 2.60191886e-02 5.61880106e-03 -1.17182068e-03] [ 5.54341846e-03 -9.13500268e-04 -5.84771784e-03] [-5.54341846e-03 9.13500269e-04 -5.84771784e-03] [-2.81180315e-03 9.31328068e-04 3.11858403e-03] [ 2.81180315e-03 -9.31328067e-04 3.11858403e-03] [-2.90682973e-03 2.17256764e-03 1.52065499e-03] [ 2.90682973e-03 -2.17256764e-03 1.52065499e-03] [ 9.65215108e-05 2.09587344e-03 1.62509450e-03] [-9.65215079e-05 -2.09587345e-03 1.62509450e-03] [-7.28161943e-04 4.58311393e-03 -5.27197933e-03] [ 7.28161950e-04 -4.58311393e-03 -5.27197932e-03] [-7.52571872e-03 -2.52275115e-03 1.91026808e-04] [ 7.52571872e-03 2.52275115e-03 1.91026800e-04] [ 4.04563239e-03 8.61975423e-04 -4.12391110e-03] [-4.04563239e-03 -8.61975433e-04 -4.12391110e-03] [ 3.16285055e-03 -3.17957578e-03 -1.99231536e-03] [-3.16285055e-03 3.17957578e-03 -1.99231536e-03] [-1.01658390e-02 -4.02774119e-03 3.08182882e-03] [ 1.01658390e-02 4.02774119e-03 3.08182882e-03] [ 3.18158708e-03 2.99314120e-03 5.09394888e-03] [-3.18158707e-03 -2.99314119e-03 5.09394888e-03] [ 8.02274736e-03 -8.45473361e-03 4.80580594e-04] [-8.02274735e-03 8.45473360e-03 4.80580589e-04] [ 1.70764442e-03 -3.42401766e-03 -6.90174332e-05] [-1.70764442e-03 3.42401765e-03 -6.90174339e-05] [-3.00866581e-03 1.36646395e-03 4.02344367e-03] [ 3.00866580e-03 -1.36646396e-03 4.02344366e-03] [ 9.35864289e-03 -3.30572291e-05 7.72843775e-03] [-9.35864288e-03 3.30572200e-05 7.72843775e-03]] Final stress: [ 4.47249399e-05 9.51767318e-05 9.48235295e-05 -6.22472153e-15 -7.80091805e-15 -1.47037631e-04] Minimization converged after 118 steps. Minimization converged after 114 steps. Minimization converged after 112 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 120 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-3.27910191e-03 2.18027843e-03 -2.68028616e-03] [ 3.27910191e-03 -2.18027843e-03 -2.68028616e-03] [-3.60639411e-03 -6.88523094e-03 -1.77000794e-03] [ 3.60639411e-03 6.88523095e-03 -1.77000793e-03] [-1.66378093e-03 9.90826130e-04 3.45451362e-03] [ 1.66378094e-03 -9.90826128e-04 3.45451361e-03] [ 5.66773978e-03 8.43417457e-03 1.22501162e-03] [-5.66773978e-03 -8.43417457e-03 1.22501162e-03] [ 2.24901780e-04 -1.95759539e-03 3.60584773e-03] [-2.24901783e-04 1.95759539e-03 3.60584773e-03] [-1.06896403e-03 6.24944978e-04 -5.71358959e-03] [ 1.06896403e-03 -6.24944976e-04 -5.71358960e-03] [ 5.39539448e-03 -9.79531941e-05 4.30971026e-03] [-5.39539448e-03 9.79531946e-05 4.30971026e-03] [ 6.81118199e-03 -3.50024801e-04 1.21532243e-02] [-6.81118199e-03 3.50024800e-04 1.21532243e-02] [ 7.74525754e-04 -6.76683914e-03 5.70452608e-03] [-7.74525752e-04 6.76683914e-03 5.70452608e-03] [-2.88876427e-03 3.13754662e-04 -4.65650311e-03] [ 2.88876426e-03 -3.13754662e-04 -4.65650310e-03] [-1.07694959e-02 3.28456245e-03 -2.72986852e-03] [ 1.07694959e-02 -3.28456246e-03 -2.72986851e-03] [ 8.50631509e-03 -5.37474146e-04 -7.26296024e-04] [-8.50631509e-03 5.37474138e-04 -7.26296031e-04] [-3.66023869e-03 -8.59778552e-03 5.15420784e-03] [ 3.66023869e-03 8.59778552e-03 5.15420784e-03] [ 1.72223503e-03 -6.27417430e-04 -1.43499585e-02] [-1.72223504e-03 6.27417434e-04 -1.43499585e-02] [-5.56565198e-03 -6.65878087e-04 5.54303855e-03] [ 5.56565197e-03 6.65878089e-04 5.54303855e-03] [-7.55343262e-04 -5.21592348e-03 -4.33128391e-03] [ 7.55343263e-04 5.21592348e-03 -4.33128391e-03] [ 5.83913061e-03 4.07555560e-03 -7.48525509e-04] [-5.83913060e-03 -4.07555560e-03 -7.48525512e-04] [ 2.03482116e-03 -3.44720394e-03 6.03131460e-04] [-2.03482116e-03 3.44720393e-03 6.03131464e-04] [-6.01478048e-03 -3.45604890e-03 -2.11212618e-03] [ 6.01478048e-03 3.45604889e-03 -2.11212618e-03] [ 2.01547742e-03 -9.66602202e-04 -6.82993865e-03] [-2.01547742e-03 9.66602201e-04 -6.82993866e-03] [-1.97211020e-03 -1.04834883e-03 3.01387546e-03] [ 1.97211020e-03 1.04834883e-03 3.01387547e-03] [ 3.84960994e-03 1.24086869e-03 7.79315010e-03] [-3.84960995e-03 -1.24086869e-03 7.79315010e-03] [-7.33617841e-04 1.01160151e-02 -3.30860305e-03] [ 7.33617846e-04 -1.01160151e-02 -3.30860305e-03] [ 3.40412034e-03 -5.98135183e-03 2.09307439e-03] [-3.40412034e-03 5.98135183e-03 2.09307439e-03] [-7.89227570e-04 -9.53645363e-04 3.71608691e-03] [ 7.89227571e-04 9.53645360e-04 3.71608691e-03] [-5.98326283e-03 2.72809344e-03 6.53298569e-04] [ 5.98326284e-03 -2.72809344e-03 6.53298568e-04] [ 7.64612794e-04 -1.88515727e-03 1.46034420e-03] [-7.64612797e-04 1.88515727e-03 1.46034420e-03] [-4.98037794e-03 1.29054260e-03 -1.90507365e-03] [ 4.98037794e-03 -1.29054259e-03 -1.90507365e-03] [ 3.43327860e-03 -1.78246093e-03 3.80920389e-03] [-3.43327860e-03 1.78246093e-03 3.80920389e-03] [-4.28685873e-03 -2.57227462e-03 2.85865697e-03] [ 4.28685873e-03 2.57227462e-03 2.85865697e-03] [ 5.37132788e-03 2.07744321e-03 -1.54874646e-03] [-5.37132788e-03 -2.07744321e-03 -1.54874646e-03] [-3.19281448e-03 -2.14871687e-03 -7.49282731e-03] [ 3.19281448e-03 2.14871687e-03 -7.49282731e-03] [ 1.27692036e-03 -4.94822077e-03 1.27274953e-02] [-1.27692036e-03 4.94822077e-03 1.27274953e-02] [ 7.76850036e-03 5.53849209e-04 -4.28895723e-03] [-7.76850037e-03 -5.53849201e-04 -4.28895724e-03] [ 1.01999407e-03 -5.66338027e-03 6.12116185e-03] [-1.01999407e-03 5.66338027e-03 6.12116185e-03] [-1.16179209e-02 -1.95635520e-04 4.97210648e-04] [ 1.16179209e-02 1.95635520e-04 4.97210654e-04] [ 1.21840019e-02 9.85543471e-04 -4.51245808e-03] [-1.21840019e-02 -9.85543475e-04 -4.51245808e-03] [-5.56581774e-03 1.29385997e-03 -3.73242344e-03] [ 5.56581775e-03 -1.29385997e-03 -3.73242345e-03] [ 5.83750889e-03 -5.20015212e-03 -8.02124657e-03] [-5.83750889e-03 5.20015212e-03 -8.02124657e-03] [-1.57043397e-03 2.64129165e-03 1.35496631e-03] [ 1.57043397e-03 -2.64129165e-03 1.35496632e-03] [-1.44636343e-03 1.19385158e-02 9.17687201e-04] [ 1.44636342e-03 -1.19385158e-02 9.17687198e-04] [-6.35149393e-04 2.87046106e-03 8.60957005e-06] [ 6.35149395e-04 -2.87046107e-03 8.60956608e-06] [ 1.69820106e-03 2.06881259e-03 -4.04115563e-03] [-1.69820106e-03 -2.06881260e-03 -4.04115562e-03] [-7.59148559e-04 -6.59785251e-03 -1.10009797e-03] [ 7.59148560e-04 6.59785251e-03 -1.10009798e-03] [-1.23111782e-03 -9.91953782e-03 1.90191160e-03] [ 1.23111781e-03 9.91953781e-03 1.90191160e-03] [ 9.24258201e-03 5.88211225e-03 -2.31374256e-03] [-9.24258201e-03 -5.88211225e-03 -2.31374257e-03] [-1.52255682e-03 -1.57077026e-03 3.17240306e-04] [ 1.52255682e-03 1.57077026e-03 3.17240305e-04] [ 3.47181304e-04 5.73378098e-03 1.43116256e-03] [-3.47181303e-04 -5.73378098e-03 1.43116257e-03] [ 1.03164797e-03 -3.87361817e-03 -3.81047219e-03] [-1.03164797e-03 3.87361817e-03 -3.81047220e-03] [ 5.76827440e-03 -2.71846668e-03 1.83247172e-04] [-5.76827440e-03 2.71846668e-03 1.83247171e-04] [-3.27925073e-03 7.44039295e-04 1.12593751e-04] [ 3.27925073e-03 -7.44039292e-04 1.12593755e-04]] Final stress: [-1.54235010e-05 8.36457765e-05 -6.40110655e-05 -9.44642420e-15 1.15006182e-14 1.35703611e-04] Minimization converged after 112 steps. Minimization converged after 113 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.29164384e-03 2.07283659e-03 -4.31728486e-03] [-2.29164384e-03 -2.07283651e-03 -4.31728488e-03] [ 1.33545787e-03 -7.67709657e-03 3.89659497e-04] [-1.33545787e-03 7.67709656e-03 3.89659511e-04] [-3.00539959e-03 5.65262382e-03 -2.97983778e-03] [ 3.00539959e-03 -5.65262382e-03 -2.97983778e-03] [ 2.63297677e-03 -2.21608092e-03 7.50428657e-04] [-2.63297677e-03 2.21608090e-03 7.50428636e-04] [-2.02056357e-03 2.34872899e-03 3.07349162e-03] [ 2.02056357e-03 -2.34872899e-03 3.07349162e-03] [ 3.27220287e-03 -5.57608273e-04 2.57762701e-03] [-3.27220287e-03 5.57608270e-04 2.57762700e-03] [ 2.23001863e-03 -4.03076081e-03 -1.41906144e-03] [-2.23001863e-03 4.03076082e-03 -1.41906142e-03] [ 1.10061313e-02 3.27177387e-03 -9.08762388e-04] [-1.10061313e-02 -3.27177388e-03 -9.08762402e-04] [-6.04726805e-03 9.16845538e-04 -3.76757957e-04] [ 6.04726805e-03 -9.16845535e-04 -3.76757955e-04] [-2.85006629e-03 2.86948759e-03 1.47402903e-03] [ 2.85006629e-03 -2.86948758e-03 1.47402904e-03] [-1.79892261e-03 3.89697046e-04 1.70552595e-04] [ 1.79892261e-03 -3.89697047e-04 1.70552598e-04] [ 6.29747715e-03 -1.73447906e-03 2.05611014e-03] [-6.29747715e-03 1.73447911e-03 2.05611012e-03] [-2.43615491e-03 -6.87418373e-04 -4.00357211e-03] [ 2.43615491e-03 6.87418352e-04 -4.00357213e-03] [-3.29724725e-03 -4.98165114e-07 3.91367701e-03] [ 3.29724726e-03 4.98158805e-07 3.91367701e-03] [-4.05239555e-04 1.05387918e-02 -1.19042495e-02] [ 4.05239555e-04 -1.05387918e-02 -1.19042495e-02] [-4.12341724e-03 -9.26237532e-03 2.04282169e-03] [ 4.12341724e-03 9.26237533e-03 2.04282169e-03] [-5.84418966e-03 2.05146009e-03 -3.48353250e-03] [ 5.84418965e-03 -2.05146010e-03 -3.48353249e-03] [-2.32091861e-03 3.12479532e-03 -2.06543022e-03] [ 2.32091862e-03 -3.12479533e-03 -2.06543022e-03] [ 5.29357857e-03 1.31426910e-03 -2.57235823e-03] [-5.29357857e-03 -1.31426910e-03 -2.57235822e-03] [ 1.34213301e-03 1.83170054e-03 2.24331246e-03] [-1.34213303e-03 -1.83170053e-03 2.24331247e-03] [-4.54360201e-03 -3.83347801e-03 -3.73223594e-03] [ 4.54360201e-03 3.83347802e-03 -3.73223595e-03] [-1.94539987e-04 5.64895865e-03 6.03711134e-03] [ 1.94539986e-04 -5.64895866e-03 6.03711134e-03] [-2.48650319e-04 1.05290738e-03 8.44582581e-03] [ 2.48650322e-04 -1.05290739e-03 8.44582581e-03] [ 2.56808611e-03 5.76633569e-03 9.88282055e-03] [-2.56808610e-03 -5.76633568e-03 9.88282053e-03] [-5.11936308e-03 1.32837404e-03 -9.14601571e-03] [ 5.11936308e-03 -1.32837402e-03 -9.14601569e-03] [-5.09969960e-03 -3.07708834e-04 -1.32062549e-03] [ 5.09969960e-03 3.07708838e-04 -1.32062549e-03] [ 2.76964080e-03 -4.32516641e-03 5.37685638e-03] [-2.76964079e-03 4.32516641e-03 5.37685638e-03] [ 2.15059517e-03 2.38789913e-03 1.66601366e-03] [-2.15059518e-03 -2.38789914e-03 1.66601366e-03] [ 2.59674145e-03 -1.78007991e-03 6.81996049e-03] [-2.59674145e-03 1.78007991e-03 6.81996048e-03] [-3.32472957e-03 1.53990046e-03 -3.84490867e-03] [ 3.32472957e-03 -1.53990047e-03 -3.84490867e-03] [ 3.56208736e-03 7.17821641e-03 -8.69832660e-03] [-3.56208735e-03 -7.17821641e-03 -8.69832660e-03] [-3.25573043e-04 -7.46612344e-04 1.92960029e-03] [ 3.25573059e-04 7.46612362e-04 1.92960030e-03] [-6.66566172e-03 1.57553935e-03 -5.58743127e-03] [ 6.66566171e-03 -1.57553934e-03 -5.58743127e-03] [-4.34926781e-03 -3.10422126e-03 -1.20337940e-03] [ 4.34926782e-03 3.10422126e-03 -1.20337941e-03] [ 1.11537701e-02 8.51604800e-03 1.56322824e-03] [-1.11537701e-02 -8.51604800e-03 1.56322825e-03] [ 9.12568737e-04 9.45875613e-03 -8.84961953e-03] [-9.12568731e-04 -9.45875613e-03 -8.84961952e-03] [ 5.90160532e-03 1.34262602e-02 7.15068367e-03] [-5.90160532e-03 -1.34262602e-02 7.15068368e-03] [ 1.56296482e-03 4.04552183e-03 4.26890904e-03] [-1.56296482e-03 -4.04552183e-03 4.26890904e-03] [ 8.24915611e-03 -8.25369283e-04 6.98459109e-03] [-8.24915611e-03 8.25369287e-04 6.98459110e-03] [-9.45410532e-03 -3.09967578e-03 4.31387418e-03] [ 9.45410531e-03 3.09967579e-03 4.31387418e-03] [-5.50164713e-03 7.15558088e-04 -1.60154334e-03] [ 5.50164714e-03 -7.15558088e-04 -1.60154335e-03] [ 3.08791707e-03 -5.06218352e-03 -3.75690339e-03] [-3.08791707e-03 5.06218352e-03 -3.75690339e-03] [-4.29924403e-03 3.85278758e-03 -1.80718474e-03] [ 4.29924403e-03 -3.85278757e-03 -1.80718474e-03] [-2.34352099e-03 -7.31500909e-03 -5.44292709e-03] [ 2.34352099e-03 7.31500902e-03 -5.44292708e-03] [ 7.09693438e-03 -4.12520323e-04 -3.29102684e-03] [-7.09693439e-03 4.12520325e-04 -3.29102684e-03] [-4.44042310e-03 -7.24056340e-04 -1.53690410e-03] [ 4.44042310e-03 7.24056340e-04 -1.53690411e-03] [-2.51350802e-03 1.42539263e-04 2.07103970e-03] [ 2.51350802e-03 -1.42539311e-04 2.07103970e-03] [ 2.39024350e-03 -3.61579174e-03 8.38038564e-04] [-2.39024350e-03 3.61579173e-03 8.38038590e-04] [-9.75586128e-03 -9.55685773e-04 4.03005994e-03] [ 9.75586127e-03 9.55685761e-04 4.03005993e-03] [-6.28083254e-03 -3.66173016e-03 5.18011162e-03] [ 6.28083254e-03 3.66173016e-03 5.18011165e-03] [-4.75267918e-03 -5.57822186e-03 -1.40055513e-03] [ 4.75267918e-03 5.57822186e-03 -1.40055515e-03]] Final stress: [ 1.25570491e-05 3.63046641e-06 4.54259021e-04 -7.17593641e-15 3.48699125e-15 3.60417778e-04] Minimization converged after 119 steps. Minimization converged after 119 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 52 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 5.28213318e-04 3.04084992e-04 3.74026655e-04] [-5.05325857e-04 3.20912679e-04 -6.26060417e-04] [ 8.80554509e-04 -8.37864703e-04 -3.33999541e-05] [-9.12536779e-04 -9.03647027e-04 -8.68743372e-05] [ 1.09669033e-03 -3.58808066e-04 -1.84282970e-03] [-1.16026214e-03 -1.58140955e-04 1.76007472e-03] [-7.12027840e-04 2.53764003e-05 1.23383301e-03] [ 6.62730702e-04 -2.59005954e-04 -1.49360664e-03] [ 3.12145178e-04 1.50088210e-04 1.14484600e-03] [-3.21470629e-04 1.43635951e-04 -1.21291015e-03] [ 8.00754196e-04 -2.90406567e-04 1.29929762e-03] [-7.89858925e-04 -3.78829093e-04 -1.38504883e-03] [-7.98753628e-04 7.58756102e-04 6.12821717e-04] [ 7.84667164e-04 8.20925625e-04 -8.12413855e-04] [-3.00959672e-03 4.65602424e-05 7.42677716e-04] [ 2.99234263e-03 1.75099562e-04 -7.92805005e-04] [ 4.65542545e-04 -5.32653141e-05 6.15008111e-04] [-4.40493136e-04 -8.93289894e-05 -7.54792364e-04] [-1.29124978e-04 -6.08285153e-04 -7.82380167e-04] [ 1.31691378e-04 -5.67098501e-04 9.24733210e-04] [ 1.42416621e-03 -8.13583836e-04 -8.07931542e-04] [-1.40119379e-03 -8.33944963e-04 8.11920412e-04] [-6.39669759e-04 -9.11734975e-04 -4.22149896e-04] [ 6.41671519e-04 -9.18108701e-04 5.83246273e-04] [-3.37374573e-04 -1.92260166e-03 2.16337799e-04] [ 3.74164506e-04 -1.49019423e-03 -3.14420430e-05] [ 6.18765691e-05 -2.38831874e-05 -7.63177551e-04] [-5.20113194e-05 -1.96667756e-04 8.11063765e-04] [ 6.74609965e-04 2.02666777e-03 2.57481408e-03] [-6.28829718e-04 1.87343013e-03 -2.31823292e-03] [ 6.68919489e-04 -1.26602378e-03 4.43181526e-04] [-6.48998058e-04 -1.18222549e-03 -6.56383944e-04] [-1.47264824e-03 -1.04889281e-03 -2.55884882e-04] [ 1.48087906e-03 -8.17333792e-04 2.11410217e-04] [-6.96924578e-04 2.27720875e-03 6.51993759e-04] [ 1.30981362e-03 6.46300687e-04 1.83045793e-05] [ 5.37428734e-04 2.36966921e-03 -5.33420782e-04] [-9.63481255e-04 4.63409724e-04 1.58141160e-04] [ 9.71190886e-04 1.07185267e-03 9.15153168e-04] [-4.74016015e-04 5.38291148e-04 -3.35426981e-04] [-1.02211450e-03 1.11345414e-03 -7.79097535e-04] [ 5.63829158e-04 5.24856184e-04 4.49726513e-04] [ 7.41965218e-04 1.44075998e-04 -1.29521632e-03] [ 1.33422653e-03 9.05272946e-04 -2.15474945e-03] [-7.80306351e-04 5.24408587e-04 1.44200336e-03] [-1.33356593e-03 5.35861148e-04 2.29968684e-03] [ 9.70383624e-04 -5.35661766e-04 5.98057473e-05] [ 5.06187884e-04 -8.62315564e-04 8.68976659e-04] [-9.90242936e-04 -6.37645315e-04 1.11093408e-05] [-5.34290934e-04 -7.83683210e-04 -7.58909886e-04] [ 1.40897398e-03 4.53727178e-04 1.20738766e-03] [ 4.53214349e-04 6.34123414e-05 -1.26624557e-03] [-1.64120430e-03 3.36886731e-04 -1.28299677e-03] [-3.13902948e-04 1.42618618e-04 1.18693134e-03] [ 1.76168168e-03 2.03679212e-04 -4.87803220e-04] [-3.40103863e-05 1.29139082e-03 -7.35153233e-05] [-1.65841986e-03 1.65860958e-04 5.35532486e-04] [-1.48269570e-05 1.30813328e-03 1.15400965e-04] [ 3.36278665e-03 1.93510596e-04 -1.05772616e-03] [ 2.01397066e-04 -1.46611717e-03 -1.18119331e-03] [-3.37392813e-03 -1.51292780e-05 1.03233582e-03] [-2.12190690e-04 -1.23525675e-03 1.17981691e-03] [ 7.91700935e-05 1.03377403e-03 3.00558283e-04] [ 2.03798849e-04 -1.96403606e-03 4.21131913e-04] [-1.67303257e-04 1.05575088e-03 -4.37682559e-04] [-1.25149630e-04 -2.00077671e-03 -5.64377154e-04] [ 5.32471123e-04 5.50082378e-04 1.29244675e-03] [-1.33007896e-03 -8.33524283e-04 -3.11569089e-05] [-4.88692012e-04 5.38716052e-04 -1.28354616e-03] [ 1.25782101e-03 -8.30113330e-04 3.85446913e-05] [ 2.18212121e-03 6.58866519e-04 -7.72162206e-04] [ 3.47065261e-04 -1.32522397e-03 -9.58830166e-04] [-2.16458875e-03 4.50624702e-04 7.60744115e-04] [-3.83668816e-04 -1.23165703e-03 9.80131959e-04] [ 1.24362991e-04 5.18483510e-04 -3.74952292e-04] [-3.81478607e-04 -9.56552876e-05 -1.14757258e-03] [-6.71230899e-05 5.49788193e-04 2.53706910e-04] [ 3.41860230e-04 -1.19255360e-04 1.03678398e-03] [ 2.24293415e-03 4.70371975e-04 1.17609048e-03] [-2.25514001e-03 4.72100053e-04 -9.72252601e-04] [ 8.23013036e-04 6.46010218e-04 7.48480242e-04] [-8.54518488e-04 5.59631475e-04 -6.46549708e-04] [ 5.36164644e-04 -3.72115917e-04 -1.33486574e-03] [-5.34559601e-04 -3.46482128e-04 1.29354280e-03] [-1.68667526e-04 7.81797921e-04 -1.63388330e-03] [ 1.55029982e-04 7.72591837e-04 1.49560598e-03] [-1.78957915e-03 -5.84682747e-04 6.78271685e-04] [ 1.86300508e-03 -1.49550614e-04 -8.68804887e-04] [-4.52684455e-04 -1.08760685e-03 -6.73397388e-04] [ 4.55172858e-04 -9.45871877e-04 5.95970065e-04] [-1.22896331e-03 9.23639550e-04 1.42638555e-03] [ 1.20020962e-03 8.72735654e-04 -1.48844253e-03] [ 3.20314574e-04 -4.54935368e-05 -1.87500524e-03] [-3.18172372e-04 -2.02396793e-04 2.00691286e-03] [-2.98332899e-04 2.19320608e-03 -6.09833696e-04] [ 1.72539700e-04 7.82852011e-04 -1.41883281e-03] [ 3.01744843e-04 2.06283978e-03 8.25877134e-04] [-1.94575048e-04 9.17737192e-04 1.68545364e-03] [-6.38886703e-04 -1.49072428e-03 -1.37081753e-03] [ 8.88290493e-04 -1.06599598e-03 4.41008715e-04] [ 6.28335641e-04 -1.46052169e-03 1.33308522e-03] [-9.14359500e-04 -1.11364959e-03 -5.34741161e-04]] Final stress: [-4.62356752e-06 1.41497753e-06 -7.16043027e-06 5.59522084e-05 1.08805597e-07 -4.16518636e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-5.65008342e-04 -4.47319396e-04 1.67114140e-04] [ 5.43718087e-04 -3.49116791e-04 -4.62354557e-04] [-9.51738691e-04 -8.32177781e-04 3.73872759e-05] [ 9.87175521e-04 -9.05148203e-04 -1.82800703e-04] [-1.19292250e-03 -3.55319463e-04 -2.04561204e-03] [ 1.26487686e-03 -1.23689792e-04 1.95221821e-03] [ 7.50011554e-04 2.44314566e-04 9.70465689e-04] [-6.99034993e-04 -9.88692920e-05 -1.29931636e-03] [-3.75706293e-04 2.72752529e-04 1.35178312e-03] [ 3.86638904e-04 2.63116700e-04 -1.41656743e-03] [-8.36635492e-04 -2.91393196e-04 1.32933948e-03] [ 8.24215170e-04 -3.98202743e-04 -1.43462309e-03] [ 8.45728296e-04 8.00751569e-04 7.42508902e-04] [-8.31040054e-04 8.62794237e-04 -9.73273082e-04] [ 3.20815991e-03 3.14813453e-04 7.61826291e-04] [-3.18930898e-03 4.25260621e-04 -8.27221619e-04] [-4.55715657e-04 -7.16562183e-05 6.38126558e-04] [ 4.25955755e-04 -1.02262795e-04 -7.96545397e-04] [ 1.35300182e-04 -7.49153457e-04 -7.79880927e-04] [-1.38182661e-04 -6.93707418e-04 9.41276283e-04] [-1.49246179e-03 -9.20388110e-04 -9.19625454e-04] [ 1.46852873e-03 -9.41767555e-04 9.16094965e-04] [ 6.38100006e-04 -1.27719198e-03 -4.81872428e-04] [-6.41386978e-04 -1.29849402e-03 6.55663385e-04] [ 4.10812342e-04 -1.92042448e-03 1.16706085e-04] [-4.51368774e-04 -1.41293838e-03 1.11146845e-04] [-6.59711102e-05 -2.01654581e-05 -9.30450485e-04] [ 5.58211438e-05 -1.98066015e-04 9.79150834e-04] [-7.33330807e-04 2.07411716e-03 2.80696254e-03] [ 6.79196039e-04 1.89134134e-03 -2.54115904e-03] [-6.85990875e-04 -1.28625725e-03 5.20787766e-04] [ 6.64045657e-04 -1.18954885e-03 -7.55222818e-04] [ 1.59835342e-03 -1.02349897e-03 -2.40779249e-04] [-1.60726935e-03 -7.71312349e-04 2.02367228e-04] [ 1.05739018e-03 4.64141710e-04 1.20783129e-04] [-5.66179244e-04 2.54671138e-03 -5.43731509e-04] [-1.46422229e-03 6.67976425e-04 6.81448714e-05] [ 7.59053873e-04 2.44858021e-03 6.72428151e-04] [-6.15277949e-04 4.63048138e-04 5.11843842e-04] [ 1.20720705e-03 1.18887438e-03 -7.51148854e-04] [ 5.11119816e-04 4.76096382e-04 -3.76706007e-04] [-1.14023393e-03 1.14851327e-03 9.06185384e-04] [ 1.35381087e-03 5.68562682e-04 2.50019909e-03] [ 7.84494987e-04 6.29946713e-04 1.58139899e-03] [-1.35877657e-03 9.90862996e-04 -2.32211452e-03] [-7.35275446e-04 1.97795676e-04 -1.40174069e-03] [ 5.68585892e-04 -9.40075199e-04 -9.98927503e-04] [ 1.00440451e-03 -8.47042098e-04 7.62993229e-05] [-5.34628734e-04 -1.02458841e-03 1.11382881e-03] [-9.83029023e-04 -7.39686536e-04 -2.95641382e-06] [ 3.30750713e-04 2.27570906e-04 1.29885330e-03] [ 1.78851434e-03 3.86691480e-04 -1.39329437e-03] [-5.01158123e-04 1.37211472e-04 -1.38467746e-03] [-1.50932623e-03 5.18145523e-04 1.31439801e-03] [ 1.27580179e-05 1.40850162e-03 1.09885006e-04] [ 1.91831090e-03 1.76168458e-04 5.35989898e-04] [ 2.75504644e-05 1.39077425e-03 -5.68588467e-05] [-2.02381874e-03 2.13578696e-04 -4.77477018e-04] [ 1.37634938e-04 -1.34585670e-03 1.28564243e-03] [ 3.56509731e-03 1.08473777e-05 1.09109561e-03] [-1.28293233e-04 -1.60061224e-03 -1.29000269e-03] [-3.54878059e-03 2.42341658e-04 -1.12380936e-03] [ 5.94717158e-05 -2.32851396e-03 -4.38970215e-04] [-5.11514627e-06 1.04313174e-03 -5.81011162e-04] [-1.58803429e-04 -2.26874547e-03 2.87666169e-04] [ 1.12167417e-04 1.00051051e-03 4.34854065e-04] [-1.46098704e-03 -8.82957342e-04 -2.62339040e-05] [ 5.21854848e-04 5.97943380e-04 -1.35172598e-03] [ 1.54810142e-03 -8.84231509e-04 3.23102820e-05] [-5.74673661e-04 6.09333797e-04 1.35918462e-03] [ 3.87301237e-04 -1.21594199e-03 1.17339100e-03] [ 2.42845317e-03 4.15526786e-04 7.95410198e-04] [-3.59132102e-04 -1.33404493e-03 -1.15238327e-03] [-2.43048766e-03 6.67093364e-04 -8.10467037e-04] [-3.47868511e-04 -1.38216859e-04 1.07951801e-03] [ 2.54164837e-05 5.68781363e-04 2.73376962e-04] [ 3.96528644e-04 -1.12953880e-04 -1.20320771e-03] [-9.54473641e-05 5.35981382e-04 -4.10361964e-04] [-2.33845482e-03 4.48785398e-04 1.39339774e-03] [ 2.35298610e-03 4.53216158e-04 -1.15683747e-03] [-9.82898272e-04 6.93273093e-04 7.85186118e-04] [ 1.01707650e-03 5.99607761e-04 -6.74412111e-04] [-5.93625921e-04 -3.82876315e-04 -1.49886705e-03] [ 5.92756598e-04 -3.51993586e-04 1.45166713e-03] [ 2.12915479e-04 6.74321999e-04 -1.68928974e-03] [-1.98585235e-04 6.65287354e-04 1.54030472e-03] [ 1.91885354e-03 -4.23445896e-05 7.43997915e-04] [-2.00597203e-03 4.08846545e-04 -9.62563706e-04] [ 6.02625368e-04 -1.20354484e-03 -7.78366582e-04] [-6.02539688e-04 -1.04451515e-03 6.96549564e-04] [ 1.32245263e-03 9.54521627e-04 1.55996723e-03] [-1.28949268e-03 8.94956034e-04 -1.62624022e-03] [-3.84544788e-04 1.85914358e-04 -1.98032612e-03] [ 3.76470250e-04 1.61503346e-05 2.13065123e-03] [ 1.26929097e-04 1.15080741e-03 2.01863132e-03] [-3.42563587e-04 2.28681842e-03 6.29029489e-04] [-1.14999274e-04 9.80629639e-04 -1.69169292e-03] [ 3.51148521e-04 2.44705491e-03 -3.66719364e-04] [ 9.46023002e-04 -1.23285210e-03 -4.59172760e-04] [-7.35041672e-04 -1.56881845e-03 1.36364950e-03] [-9.19185931e-04 -1.17344636e-03 3.45350568e-04] [ 7.49638812e-04 -1.60876848e-03 -1.41239607e-03]] Final stress: [-5.15460930e-06 1.82304794e-06 -7.43338448e-06 5.65363865e-05 -1.25252180e-07 4.51539768e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 2.03451827e-03 3.05582686e-03 -1.56954312e-03] [-2.12413269e-03 4.45522529e-03 6.82469557e-05] [ 3.81714174e-03 1.52018293e-03 -8.38129271e-04] [-3.62484302e-03 1.34266455e-03 -3.02752953e-04] [ 3.95440169e-03 8.13813439e-04 5.44442206e-03] [-3.51507528e-03 2.09556534e-03 -5.82332030e-03] [-1.82337026e-03 1.75734012e-03 -5.29876714e-03] [ 2.19971142e-03 -3.32673164e-04 3.34819413e-03] [ 1.98961979e-03 -3.73678256e-03 -5.65291738e-03] [-1.89713252e-03 -3.88742130e-03 5.58646745e-03] [ 1.63213698e-03 1.30836782e-04 -2.46720768e-03] [-1.66015960e-03 -5.46728394e-04 1.70858295e-03] [-3.08500958e-03 -1.82513972e-03 -3.60157119e-03] [ 3.10414177e-03 -1.36099905e-03 2.34729278e-03] [-1.23209673e-02 -3.87954477e-03 -2.90734465e-03] [ 1.24122238e-02 -3.32744601e-03 2.06893416e-03] [ 1.51974221e-03 8.03297047e-04 -2.90999048e-03] [-1.71477237e-03 1.15208606e-03 2.04241776e-03] [ 4.26737891e-04 2.08707244e-03 4.18775141e-03] [-4.62754448e-04 2.10309759e-03 -3.43573280e-03] [ 4.11526271e-03 5.66286532e-03 5.16898259e-03] [-4.10675528e-03 5.72649765e-03 -5.52330432e-03] [-5.89563030e-04 5.94777807e-03 2.80692237e-03] [ 5.05947210e-04 5.68070757e-03 -2.34063306e-03] [-1.80214851e-03 3.40544187e-03 -5.08390164e-04] [ 1.58918630e-03 6.41666400e-03 1.94081739e-03] [ 2.16916463e-03 7.86403269e-04 1.75995190e-03] [-2.19531439e-03 -3.90576036e-04 -1.20110997e-03] [ 1.64227263e-03 -7.25505353e-03 -7.41106295e-03] [-2.02678626e-03 -8.47529288e-03 7.82718352e-03] [ 1.60821271e-03 5.07556759e-03 -1.45263778e-03] [-1.77481506e-03 5.68563702e-03 5.55955183e-04] [-4.78033744e-03 2.77095163e-03 -1.49492111e-04] [ 4.69447346e-03 3.87408401e-03 1.75417576e-04] [-5.77386199e-03 -3.37752719e-03 -7.96096963e-04] [ 2.39936312e-03 -6.93150569e-03 2.43011197e-03] [ 3.03348963e-03 -2.09416068e-03 1.28109071e-03] [-9.30876424e-04 -7.42867083e-03 -2.02993071e-03] [ 2.99906245e-03 -1.52204920e-03 -1.65853202e-03] [-2.66214867e-03 -3.22798470e-03 3.99545296e-03] [-3.47283600e-03 -1.60918762e-03 2.26133522e-03] [ 2.85904235e-03 -3.29229882e-03 -3.34654642e-03] [-3.44883479e-03 -3.26259565e-03 -6.20456343e-03] [-2.75928176e-03 -1.66351710e-04 -3.23899960e-03] [ 3.32839627e-03 -1.08971107e-03 7.91554973e-03] [ 3.15115018e-03 -2.26337451e-03 4.91877581e-03] [-2.16206658e-03 2.61061910e-03 6.71564491e-03] [-6.77708544e-03 3.55807154e-03 4.83119623e-04] [ 2.42467851e-03 2.31908119e-03 -6.21007658e-03] [ 6.64643173e-03 3.92285512e-03 -1.92817224e-04] [-2.48902620e-03 -4.08860096e-04 -3.03157163e-03] [-4.21168694e-03 -1.24788339e-03 4.05373115e-03] [ 1.20473090e-03 -1.02510143e-03 2.80951056e-03] [ 6.17483317e-03 -4.45993493e-04 -4.02975405e-03] [-1.70618355e-03 -6.99522008e-03 -7.77167381e-04] [-6.41218136e-03 -1.19972964e-03 -8.22050385e-04] [ 1.78267917e-03 -7.03442201e-03 1.25210070e-03] [ 5.85140396e-03 -1.09976926e-03 1.29628154e-03] [-1.54628364e-03 3.97344112e-03 -4.55262667e-03] [-1.02424117e-02 -3.28525655e-04 -4.71915347e-03] [ 1.54011576e-03 2.96605042e-03 4.23273061e-03] [ 1.04110611e-02 6.31616240e-04 4.25903097e-03] [ 5.63436235e-04 7.47272159e-03 -1.60117280e-03] [ 4.89881277e-04 -1.90507105e-03 3.76425851e-04] [-1.00819786e-03 8.14775641e-03 1.00684732e-03] [-2.07088522e-05 -2.41743805e-03 -9.49187909e-04] [ 5.81335128e-03 6.29499550e-04 -6.57213350e-04] [-1.67378498e-03 -1.76587495e-03 5.26236480e-03] [-5.31242313e-03 6.16874873e-04 4.86229163e-04] [ 1.44173240e-03 -1.63604725e-03 -5.39062993e-03] [-4.63928599e-03 8.82326124e-03 -1.36070121e-03] [-5.77519850e-03 -4.61156309e-04 -2.11355645e-03] [ 4.70424756e-03 7.87364564e-03 1.30572354e-03] [ 5.92074223e-03 1.14520156e-03 1.89801896e-03] [ 2.47752757e-03 -5.26018869e-04 -2.99510005e-03] [ 1.56591597e-03 -1.11948415e-05 -1.21250522e-03] [-2.33089270e-03 -4.42986832e-04 2.57639860e-03] [-1.95295757e-03 -1.62268719e-04 7.50591018e-04] [ 8.37248018e-03 -2.41237543e-03 -2.36978202e-03] [-8.14264216e-03 -2.13150120e-03 3.98769149e-03] [ 4.86926108e-03 -2.64472658e-03 -4.51870827e-03] [-4.60410318e-03 -3.16047860e-03 4.96648388e-03] [ 1.36812831e-03 1.91555980e-03 5.71825888e-03] [-1.36871462e-03 2.36167564e-03 -5.77658455e-03] [-6.93020086e-04 -2.39752581e-03 3.89845084e-03] [ 6.35855243e-04 -2.68427998e-03 -4.80553920e-03] [-9.51597828e-03 -4.59956051e-03 -2.28367708e-03] [ 9.01408363e-03 -2.56389580e-03 8.29416444e-04] [-2.72833349e-03 3.37592164e-03 4.52059303e-03] [ 2.87127283e-03 4.26403975e-03 -4.76783822e-03] [-1.72077627e-03 -1.84398193e-03 -5.60858876e-03] [ 1.91361849e-03 -2.50430255e-03 5.30192246e-03] [-1.08978909e-04 -2.00193089e-03 5.63317975e-03] [ 9.24392721e-05 -2.88867913e-03 -4.73180280e-03] [-6.37338988e-04 -2.92346836e-03 -4.23915691e-03] [ 2.45784059e-03 -9.56163818e-03 -3.18519954e-03] [ 4.13985347e-04 -3.93658740e-03 6.09832908e-03] [-2.21716334e-03 -8.61350634e-03 4.71407723e-03] [-2.71444173e-03 3.72077548e-03 -9.42600812e-05] [ 1.90338679e-03 5.36348121e-03 -3.89050676e-03] [ 2.86257728e-03 4.13583544e-03 -4.96541907e-04] [-1.70945440e-03 5.08748466e-03 3.77903794e-03]] Final stress: [-2.77718616e-05 1.76800363e-05 -1.09872101e-05 -7.30171309e-05 -4.55272763e-07 -1.22828828e-04] Minimization converged after 139 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 147 steps. Minimization converged after 146 steps. Minimization converged after 148 steps. Minimization converged after 146 steps. Minimization converged after 110 steps. Minimization converged after 110 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 15 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 15 steps. Minimization converged after 23 steps. Minimization converged after 26 steps. Minimization converged after 29 steps. Minimization converged after 23 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 4.12043922e-03 9.00282559e-03 1.51005049e-03] [-4.12043922e-03 -9.00282558e-03 1.51005049e-03] [ 3.66801040e-03 7.52324139e-05 -3.06078203e-03] [-3.66801040e-03 -7.52324241e-05 -3.06078203e-03] [ 2.67092718e-03 9.18307854e-04 -2.07360255e-03] [-2.67092718e-03 -9.18307862e-04 -2.07360255e-03] [-6.82869401e-03 1.08652673e-03 -2.46347364e-03] [ 6.82869402e-03 -1.08652673e-03 -2.46347364e-03] [-3.43925610e-05 1.16871630e-02 -3.42103742e-03] [ 3.43925599e-05 -1.16871630e-02 -3.42103742e-03] [ 1.73573452e-04 -4.04595553e-03 -1.45460296e-03] [-1.73573453e-04 4.04595552e-03 -1.45460297e-03] [-3.32606448e-03 2.34877335e-03 -1.37194937e-04] [ 3.32606448e-03 -2.34877335e-03 -1.37194928e-04] [-3.37149638e-03 -3.40632038e-03 9.75633230e-03] [ 3.37149638e-03 3.40632037e-03 9.75633228e-03] [-1.93675286e-03 2.89704142e-03 -3.98375545e-03] [ 1.93675285e-03 -2.89704143e-03 -3.98375546e-03] [-6.92843183e-04 -5.12019374e-03 1.70492559e-03] [ 6.92843179e-04 5.12019374e-03 1.70492560e-03] [ 9.81878216e-03 -8.81673090e-03 4.99347253e-03] [-9.81878216e-03 8.81673090e-03 4.99347253e-03] [-1.00803880e-02 7.78681167e-03 4.53127140e-04] [ 1.00803880e-02 -7.78681168e-03 4.53127150e-04] [ 3.82417816e-03 -3.64476878e-03 1.14971306e-03] [-3.82417816e-03 3.64476879e-03 1.14971306e-03] [-1.29021439e-03 1.98153982e-03 -7.31238116e-03] [ 1.29021439e-03 -1.98153981e-03 -7.31238115e-03] [ 5.10565772e-03 9.68718789e-03 -2.34418839e-03] [-5.10565772e-03 -9.68718789e-03 -2.34418839e-03] [-7.72928013e-04 -8.86522270e-03 3.93258085e-03] [ 7.72928015e-04 8.86522271e-03 3.93258085e-03] [-8.93471624e-03 -3.55068391e-03 -2.70792361e-03] [ 8.93471624e-03 3.55068390e-03 -2.70792361e-03] [-7.98223769e-03 3.29316274e-03 2.14826336e-03] [ 7.98223769e-03 -3.29316274e-03 2.14826337e-03] [-2.10899845e-03 4.90994069e-03 8.83795553e-03] [ 2.10899844e-03 -4.90994070e-03 8.83795552e-03] [-3.65328246e-03 4.77263827e-03 5.40500586e-03] [ 3.65328246e-03 -4.77263826e-03 5.40500587e-03] [ 9.68640118e-04 -3.72068154e-03 -4.10378092e-03] [-9.68640121e-04 3.72068154e-03 -4.10378092e-03] [-7.28372818e-03 -1.60870185e-02 -3.41355881e-03] [ 7.28372818e-03 1.60870185e-02 -3.41355881e-03] [-1.67507828e-03 1.41353636e-03 7.02660861e-03] [ 1.67507827e-03 -1.41353636e-03 7.02660862e-03] [-3.96235241e-03 7.66426850e-03 7.13273254e-03] [ 3.96235241e-03 -7.66426849e-03 7.13273254e-03] [ 8.60788669e-04 9.50095237e-05 -3.11239697e-03] [-8.60788668e-04 -9.50095202e-05 -3.11239698e-03] [ 1.35956147e-04 3.28984860e-04 -8.60050633e-03] [-1.35956152e-04 -3.28984869e-04 -8.60050633e-03] [-4.86891378e-03 -1.75603890e-03 -3.96684816e-03] [ 4.86891379e-03 1.75603890e-03 -3.96684817e-03] [ 2.46038215e-03 1.40347963e-04 1.30622567e-02] [-2.46038214e-03 -1.40347959e-04 1.30622567e-02] [-1.38988603e-02 5.42305740e-03 2.67160298e-03] [ 1.38988603e-02 -5.42305741e-03 2.67160297e-03] [ 1.36332871e-03 6.71683347e-03 -1.45007435e-03] [-1.36332871e-03 -6.71683347e-03 -1.45007435e-03] [-9.74753685e-03 -4.86250008e-03 -2.03096660e-03] [ 9.74753685e-03 4.86250009e-03 -2.03096660e-03] [ 1.44471339e-03 3.19627957e-03 9.21465540e-03] [-1.44471339e-03 -3.19627956e-03 9.21465540e-03] [-3.26029152e-03 3.87833742e-03 -1.49216711e-02] [ 3.26029152e-03 -3.87833742e-03 -1.49216711e-02] [-2.79714263e-03 -2.59688741e-04 6.35923676e-03] [ 2.79714262e-03 2.59688740e-04 6.35923677e-03] [-2.19171871e-03 2.87441848e-03 -3.27113327e-03] [ 2.19171871e-03 -2.87441847e-03 -3.27113327e-03] [ 1.03854844e-02 -3.80261321e-03 -1.06520089e-02] [-1.03854844e-02 3.80261322e-03 -1.06520089e-02] [-2.19463490e-02 -7.96551868e-04 -2.25262010e-03] [ 2.19463490e-02 7.96551874e-04 -2.25262010e-03] [ 2.71126825e-03 -1.19341436e-04 -3.85782557e-03] [-2.71126825e-03 1.19341438e-04 -3.85782557e-03] [-4.54966532e-03 3.10755557e-03 3.88327013e-03] [ 4.54966532e-03 -3.10755557e-03 3.88327014e-03] [-1.03222461e-03 2.06168520e-03 2.23747273e-03] [ 1.03222461e-03 -2.06168521e-03 2.23747272e-03] [-1.11598742e-03 9.97606044e-04 2.48103216e-03] [ 1.11598742e-03 -9.97606039e-04 2.48103216e-03] [-2.92446464e-04 2.82311938e-03 -3.75453795e-03] [ 2.92446472e-04 -2.82311937e-03 -3.75453795e-03] [-6.20596916e-03 -2.02919453e-03 -3.48512942e-03] [ 6.20596915e-03 2.02919454e-03 -3.48512942e-03] [ 6.84144604e-04 -9.96439467e-03 -3.65399206e-03] [-6.84144614e-04 9.96439467e-03 -3.65399205e-03] [ 4.25208089e-03 -1.34027101e-03 -2.46719909e-03] [-4.25208088e-03 1.34027102e-03 -2.46719909e-03] [-1.16314572e-02 -2.43735575e-03 1.50573608e-03] [ 1.16314572e-02 2.43735575e-03 1.50573609e-03] [ 4.99861096e-03 -2.71389140e-03 3.69500389e-03] [-4.99861095e-03 2.71389141e-03 3.69500389e-03] [ 6.20865058e-03 -7.11244582e-03 -1.32794927e-03] [-6.20865058e-03 7.11244582e-03 -1.32794926e-03] [ 1.68736367e-03 7.95107797e-04 -2.16220852e-04] [-1.68736367e-03 -7.95107796e-04 -2.16220855e-04] [-3.81462655e-03 1.15640649e-03 2.74045148e-03] [ 3.81462655e-03 -1.15640650e-03 2.74045148e-03] [ 7.44226905e-03 1.56164814e-03 3.59587568e-03] [-7.44226906e-03 -1.56164814e-03 3.59587568e-03]] Final stress: [-1.88130055e-05 1.09629447e-04 6.04969691e-05 3.08260149e-14 -1.45555674e-15 -1.67284735e-04] Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.26823713e-03 -6.53830088e-04 -9.44407766e-04] [-1.26823714e-03 6.53830084e-04 -9.44407769e-04] [ 1.62648927e-03 -8.31896908e-04 8.04638735e-04] [-1.62648927e-03 8.31896904e-04 8.04638734e-04] [ 8.87924293e-04 -1.18310023e-03 3.55302325e-04] [-8.87924293e-04 1.18310023e-03 3.55302323e-04] [-3.48900435e-03 -3.06949912e-04 8.57351726e-04] [ 3.48900435e-03 3.06949908e-04 8.57351726e-04] [-4.02797323e-04 -5.23421439e-03 1.14016169e-03] [ 4.02797325e-04 5.23421439e-03 1.14016169e-03] [ 2.30058079e-04 1.87154847e-03 5.27627103e-04] [-2.30058077e-04 -1.87154847e-03 5.27627107e-04] [-1.46405468e-03 -1.55399909e-03 -6.60971039e-04] [ 1.46405467e-03 1.55399909e-03 -6.60971035e-04] [-1.57765495e-03 -1.43852446e-03 -4.63746218e-03] [ 1.57765495e-03 1.43852446e-03 -4.63746218e-03] [-8.38270233e-04 -1.07518868e-03 9.27716305e-04] [ 8.38270232e-04 1.07518868e-03 9.27716310e-04] [ 3.63360441e-04 2.88313796e-03 -4.25226290e-04] [-3.63360441e-04 -2.88313796e-03 -4.25226295e-04] [ 4.63084434e-03 3.99167826e-03 -2.30466352e-03] [-4.63084435e-03 -3.99167827e-03 -2.30466352e-03] [-4.43634487e-03 -1.71414895e-03 2.73342852e-04] [ 4.43634487e-03 1.71414896e-03 2.73342855e-04] [ 1.96924901e-03 -4.75373270e-04 1.14870758e-03] [-1.96924902e-03 4.75373268e-04 1.14870758e-03] [-1.86902434e-05 9.35040253e-04 3.86832710e-03] [ 1.86902446e-05 -9.35040251e-04 3.86832709e-03] [ 1.88156642e-03 -3.82273523e-03 1.24089954e-03] [-1.88156642e-03 3.82273523e-03 1.24089954e-03] [-7.25912705e-04 3.37920331e-03 -1.94307296e-03] [ 7.25912702e-04 -3.37920331e-03 -1.94307296e-03] [-3.31843251e-03 7.63190859e-04 2.87508837e-04] [ 3.31843251e-03 -7.63190861e-04 2.87508834e-04] [-2.87461302e-04 6.23815981e-04 -3.12873585e-03] [ 2.87461301e-04 -6.23815982e-04 -3.12873585e-03] [ 1.11066030e-03 1.98518338e-03 2.25711721e-04] [-1.11066030e-03 -1.98518338e-03 2.25711721e-04] [-1.10581869e-03 -1.65669194e-03 2.03110678e-03] [ 1.10581869e-03 1.65669194e-03 2.03110678e-03] [ 1.52683163e-03 1.02512711e-03 -2.72683941e-03] [-1.52683164e-03 -1.02512712e-03 -2.72683940e-03] [ 1.01965724e-03 -1.09781741e-03 -2.15305166e-03] [-1.01965724e-03 1.09781741e-03 -2.15305166e-03] [ 3.04570542e-03 -5.04977419e-03 2.19654579e-03] [-3.04570542e-03 5.04977418e-03 2.19654579e-03] [-9.66882987e-05 1.18263725e-03 2.39574818e-03] [ 9.66883023e-05 -1.18263725e-03 2.39574818e-03] [ 2.26521990e-03 2.37365988e-03 -1.82420923e-03] [-2.26521991e-03 -2.37365988e-03 -1.82420923e-03] [ 5.69215554e-04 -2.57699912e-05 1.01656751e-03] [-5.69215552e-04 2.57699904e-05 1.01656750e-03] [-1.00773901e-03 -8.58041930e-04 2.89086999e-03] [ 1.00773900e-03 8.58041929e-04 2.89086999e-03] [ 5.37641753e-03 1.54359048e-03 -9.43473257e-04] [-5.37641754e-03 -1.54359048e-03 -9.43473258e-04] [ 5.34455463e-05 8.27114217e-04 -5.05727535e-03] [-5.34455449e-05 -8.27114217e-04 -5.05727535e-03] [ 3.79596010e-03 -1.32552608e-03 5.56616974e-04] [-3.79596010e-03 1.32552608e-03 5.56616979e-04] [ 4.23106442e-04 1.78653469e-03 9.18852974e-04] [-4.23106445e-04 -1.78653469e-03 9.18852970e-04] [ 1.03305031e-03 4.25971617e-04 6.07109388e-03] [-1.03305031e-03 -4.25971618e-04 6.07109388e-03] [-1.03712462e-03 4.95554745e-04 -5.21422462e-03] [ 1.03712462e-03 -4.95554745e-04 -5.21422462e-03] [-2.80872666e-04 1.07730601e-03 9.40145570e-04] [ 2.80872661e-04 -1.07730601e-03 9.40145572e-04] [ 2.10284616e-03 -1.98924474e-05 -2.81536287e-03] [-2.10284616e-03 1.98924441e-05 -2.81536287e-03] [ 1.01011485e-02 9.86981965e-05 1.32806067e-03] [-1.01011485e-02 -9.86981962e-05 1.32806067e-03] [-4.98545221e-03 -3.87355755e-03 4.63013192e-03] [ 4.98545220e-03 3.87355755e-03 4.63013192e-03] [ 1.87205086e-03 7.00852892e-04 -1.58122615e-03] [-1.87205086e-03 -7.00852891e-04 -1.58122614e-03] [-1.89705059e-03 -5.66916502e-04 2.17327964e-03] [ 1.89705059e-03 5.66916503e-04 2.17327964e-03] [-4.89545578e-04 -1.42771583e-03 6.53151515e-04] [ 4.89545580e-04 1.42771583e-03 6.53151511e-04] [-1.27605841e-03 -1.14080823e-04 -7.74558955e-04] [ 1.27605841e-03 1.14080825e-04 -7.74558959e-04] [-3.96226187e-04 -2.19096586e-03 1.53877674e-03] [ 3.96226187e-04 2.19096586e-03 1.53877674e-03] [-3.40405992e-03 1.65605445e-03 -4.54613762e-04] [ 3.40405992e-03 -1.65605444e-03 -4.54613761e-04] [ 9.13589834e-04 -6.82337510e-04 4.23822165e-04] [-9.13589831e-04 6.82337515e-04 4.23822167e-04] [ 2.39481963e-03 -2.24610095e-05 7.96390268e-04] [-2.39481963e-03 2.24610119e-05 7.96390265e-04] [-4.04472736e-03 2.26069410e-03 -9.56999979e-04] [ 4.04472736e-03 -2.26069410e-03 -9.56999979e-04] [ 1.83849387e-03 7.78078807e-04 -1.14888453e-03] [-1.83849386e-03 -7.78078805e-04 -1.14888453e-03] [-8.34032762e-04 4.47207013e-04 8.12815254e-04] [ 8.34032759e-04 -4.47207010e-04 8.12815256e-04] [-3.27496274e-03 -4.22800612e-03 1.12623161e-03] [ 3.27496274e-03 4.22800612e-03 1.12623162e-03] [-3.49001787e-03 -8.75092389e-05 -2.50225325e-03] [ 3.49001788e-03 8.75092450e-05 -2.50225325e-03] [ 1.16815401e-03 9.81500034e-04 -1.95999030e-03] [-1.16815401e-03 -9.81500033e-04 -1.95999030e-03]] Final stress: [-6.66910502e-05 -3.01394774e-05 -6.47430439e-05 8.79658195e-16 4.58952102e-15 -6.17318655e-05] Minimization converged after 117 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 3.26854791e-04 -1.89961588e-04 -1.20031525e-04] [-3.26854789e-04 1.89961592e-04 -1.20031526e-04] [ 3.84418191e-04 -8.68226428e-04 -3.97457146e-05] [-3.84418191e-04 8.68226427e-04 -3.97457149e-05] [ 5.73987005e-04 3.41615366e-04 4.90392270e-04] [-5.73987006e-04 -3.41615366e-04 4.90392271e-04] [-5.22280936e-04 1.17117446e-03 -3.57740582e-05] [ 5.22280936e-04 -1.17117446e-03 -3.57740583e-05] [ 4.58485509e-05 -2.75823792e-04 4.27628586e-04] [-4.58485509e-05 2.75823792e-04 4.27628587e-04] [-2.55979355e-04 -5.91679478e-05 -5.56208060e-04] [ 2.55979355e-04 5.91679474e-05 -5.56208060e-04] [-5.67486753e-04 8.45269543e-06 4.46813613e-04] [ 5.67486753e-04 -8.45269559e-06 4.46813612e-04] [-9.16975917e-04 7.79167610e-04 9.35379182e-04] [ 9.16975917e-04 -7.79167610e-04 9.35379181e-04] [-3.93163420e-04 -8.44170128e-04 8.06098472e-04] [ 3.93163420e-04 8.44170129e-04 8.06098473e-04] [ 4.16722166e-04 -5.79979155e-05 -3.85174564e-04] [-4.16722166e-04 5.79979150e-05 -3.85174565e-04] [ 1.26864449e-03 4.85202767e-04 -2.56370733e-04] [-1.26864449e-03 -4.85202768e-04 -2.56370733e-04] [-6.69206681e-04 -1.94801447e-04 -2.75946283e-04] [ 6.69206681e-04 1.94801450e-04 -2.75946284e-04] [ 2.88650396e-04 -6.88977900e-04 4.74734195e-04] [-2.88650397e-04 6.88977899e-04 4.74734196e-04] [-2.59032338e-04 -7.51521880e-04 -1.26924398e-03] [ 2.59032338e-04 7.51521879e-04 -1.26924398e-03] [ 8.38266984e-04 -1.28623683e-04 6.91816232e-04] [-8.38266984e-04 1.28623684e-04 6.91816233e-04] [-8.98508289e-05 -5.45058102e-04 -4.14205300e-04] [ 8.98508280e-05 5.45058102e-04 -4.14205300e-04] [-6.64109249e-04 7.22454270e-04 -1.55920269e-04] [ 6.64109249e-04 -7.22454272e-04 -1.55920269e-04] [-4.02398649e-04 5.93729005e-04 -1.38181315e-04] [ 4.02398650e-04 -5.93729007e-04 -1.38181314e-04] [ 7.60136843e-04 8.26658211e-04 -4.03914694e-04] [-7.60136844e-04 -8.26658211e-04 -4.03914694e-04] [-8.14095557e-05 4.19918843e-04 2.28332525e-04] [ 8.14095564e-05 -4.19918843e-04 2.28332524e-04] [ 2.00781282e-04 6.30867255e-04 -5.39854201e-04] [-2.00781282e-04 -6.30867255e-04 -5.39854201e-04] [ 2.39459928e-04 -7.76307900e-04 -8.18431059e-04] [-2.39459929e-04 7.76307900e-04 -8.18431060e-04] [ 3.15887960e-04 -3.72013319e-05 7.52465574e-04] [-3.15887960e-04 3.72013320e-05 7.52465575e-04] [ 4.34942672e-04 -2.27365137e-04 2.59218228e-04] [-4.34942672e-04 2.27365139e-04 2.59218227e-04] [ 7.37491277e-04 5.45224197e-04 6.48132486e-05] [-7.37491276e-04 -5.45224196e-04 6.48132495e-05] [ 5.50205448e-04 3.22531247e-04 4.09476936e-04] [-5.50205449e-04 -3.22531247e-04 4.09476937e-04] [-4.93620631e-04 -5.46257218e-04 9.74913504e-06] [ 4.93620631e-04 5.46257218e-04 9.74913509e-06] [ 9.01076843e-04 3.24384382e-04 6.27236175e-04] [-9.01076843e-04 -3.24384382e-04 6.27236174e-04] [-1.05628547e-03 -1.77622877e-04 -5.35855908e-04] [ 1.05628547e-03 1.77622878e-04 -5.35855907e-04] [ 7.18083566e-04 -1.04286479e-04 -1.53038412e-04] [-7.18083566e-04 1.04286479e-04 -1.53038412e-04] [-4.78492250e-04 5.60316127e-04 6.20179101e-04] [ 4.78492250e-04 -5.60316127e-04 6.20179100e-04] [ 2.95007799e-04 1.22962345e-03 1.22892635e-03] [-2.95007798e-04 -1.22962345e-03 1.22892635e-03] [-3.39382500e-04 5.81052171e-04 -5.08814854e-04] [ 3.39382499e-04 -5.81052170e-04 -5.08814855e-04] [ 2.26062234e-04 7.32200945e-04 8.98333728e-04] [-2.26062234e-04 -7.32200945e-04 8.98333727e-04] [ 1.11002317e-03 1.06272952e-04 -7.73362721e-04] [-1.11002317e-03 -1.06272953e-04 -7.73362721e-04] [ 1.14061226e-03 -2.07587907e-04 -6.59208151e-04] [-1.14061226e-03 2.07587906e-04 -6.59208151e-04] [-1.11074853e-03 3.34056388e-04 -3.34480733e-05] [ 1.11074853e-03 -3.34056387e-04 -3.34480716e-05] [ 9.00078851e-04 7.39888231e-04 -7.65596197e-04] [-9.00078851e-04 -7.39888230e-04 -7.65596197e-04] [-5.05918845e-04 -6.64479444e-05 -5.56999156e-04] [ 5.05918845e-04 6.64479445e-05 -5.56999155e-04] [ 2.21954379e-04 3.77599005e-04 -1.47154013e-04] [-2.21954380e-04 -3.77599005e-04 -1.47154014e-04] [ 6.04244004e-04 1.39761612e-03 1.79280843e-04] [-6.04244005e-04 -1.39761612e-03 1.79280842e-04] [ 3.23389373e-04 3.86051208e-04 -1.66908841e-04] [-3.23389373e-04 -3.86051208e-04 -1.66908841e-04] [-4.28340412e-04 -1.58568747e-05 -1.79295048e-04] [ 4.28340412e-04 1.58568749e-05 -1.79295047e-04] [-1.01435551e-04 -5.01710249e-04 4.29621143e-05] [ 1.01435551e-04 5.01710245e-04 4.29621142e-05] [-3.21798390e-04 -1.19956999e-03 2.24858657e-04] [ 3.21798390e-04 1.19956999e-03 2.24858656e-04] [-1.18577353e-03 5.37794883e-04 9.98500939e-05] [ 1.18577353e-03 -5.37794883e-04 9.98500941e-05] [ 3.32906906e-04 1.10483494e-04 7.61788253e-05] [-3.32906907e-04 -1.10483496e-04 7.61788263e-05] [ 2.15171362e-04 6.36965053e-04 -2.92240742e-04] [-2.15171362e-04 -6.36965053e-04 -2.92240741e-04] [ 5.28676967e-05 -3.48690830e-04 1.71613285e-04] [-5.28676973e-05 3.48690830e-04 1.71613284e-04] [-3.53857973e-04 2.48768584e-04 2.25745901e-05] [ 3.53857973e-04 -2.48768584e-04 2.25745904e-05] [ 6.73968502e-04 4.79604938e-04 -7.98808429e-06] [-6.73968501e-04 -4.79604939e-04 -7.98808379e-06]] Final stress: [ 3.00366567e-05 5.21072998e-05 1.35703910e-05 5.37767269e-17 -6.85952028e-16 -1.34577264e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-4.91386812e-04 -5.62947923e-04 -6.25912324e-05] [ 4.91386811e-04 5.62947923e-04 -6.25912312e-05] [-4.69155715e-04 -8.51837667e-04 -1.22070311e-04] [ 4.69155714e-04 8.51837669e-04 -1.22070311e-04] [-3.04600167e-04 7.58762059e-05 8.06031816e-04] [ 3.04600167e-04 -7.58762060e-05 8.06031818e-04] [ 5.79014534e-04 1.03867186e-03 2.80248071e-04] [-5.79014533e-04 -1.03867186e-03 2.80248074e-04] [-2.16057945e-04 -2.20511644e-04 4.35957428e-04] [ 2.16057945e-04 2.20511646e-04 4.35957428e-04] [-3.07426888e-04 5.61294080e-05 -9.33091862e-04] [ 3.07426888e-04 -5.61294083e-05 -9.33091862e-04] [ 7.15744738e-04 1.74807002e-04 4.40779776e-04] [-7.15744738e-04 -1.74807002e-04 4.40779778e-04] [ 1.42195649e-03 1.34493710e-03 7.84792638e-04] [-1.42195649e-03 -1.34493710e-03 7.84792639e-04] [ 2.55606757e-05 -7.67625035e-04 7.62178613e-04] [-2.55606767e-05 7.67625036e-04 7.62178614e-04] [-5.88581591e-04 -4.35315208e-04 -3.45605090e-04] [ 5.88581591e-04 4.35315209e-04 -3.45605091e-04] [-8.34029749e-04 3.47455104e-04 -2.30005918e-04] [ 8.34029749e-04 -3.47455104e-04 -2.30005918e-04] [ 3.72193937e-04 -1.84574524e-04 -4.59400224e-04] [-3.72193938e-04 1.84574516e-04 -4.59400223e-04] [ 2.51828404e-04 -3.18203069e-04 -4.29621060e-04] [-2.51828403e-04 3.18203069e-04 -4.29621061e-04] [ 2.23846293e-04 -1.06493391e-03 -1.29199195e-03] [-2.23846293e-04 1.06493391e-03 -1.29199195e-03] [-7.07884366e-04 4.06383900e-05 7.30967693e-04] [ 7.07884367e-04 -4.06383896e-05 7.30967693e-04] [-8.30062355e-05 -5.54654915e-04 -5.28621946e-04] [ 8.30062352e-05 5.54654914e-04 -5.28621946e-04] [ 5.23962763e-04 6.73017033e-04 -3.95576658e-05] [-5.23962763e-04 -6.73017032e-04 -3.95576664e-05] [ 8.91365193e-04 -6.87984783e-04 -4.10076413e-04] [-8.91365192e-04 6.87984783e-04 -4.10076413e-04] [-5.49123987e-04 -5.61829480e-04 -7.64776515e-05] [ 5.49123987e-04 5.61829480e-04 -7.64776523e-05] [-5.64031169e-04 -5.55792699e-04 -3.67960654e-04] [ 5.64031171e-04 5.55792697e-04 -3.67960656e-04] [ 5.84066426e-04 -1.45539503e-04 6.89832845e-05] [-5.84066428e-04 1.45539501e-04 6.89832852e-05] [ 1.48806977e-04 -1.16093234e-04 6.83117909e-04] [-1.48806977e-04 1.16093234e-04 6.83117908e-04] [ 2.88266859e-05 8.60862404e-04 -4.96674925e-04] [-2.88266853e-05 -8.60862405e-04 -4.96674924e-04] [ 4.27156068e-04 -4.99941449e-04 -4.96124059e-05] [-4.27156067e-04 4.99941448e-04 -4.96124054e-05] [ 1.94533546e-04 1.79460715e-04 3.75304870e-04] [-1.94533547e-04 -1.79460717e-04 3.75304870e-04] [-3.15330477e-04 6.01620612e-04 1.69063855e-04] [ 3.15330476e-04 -6.01620612e-04 1.69063856e-04] [ 4.96198625e-04 -1.53996897e-04 2.44294124e-04] [-4.96198625e-04 1.53996896e-04 2.44294124e-04] [-5.04873738e-04 7.59472640e-04 -3.91452923e-05] [ 5.04873739e-04 -7.59472641e-04 -3.91452931e-05] [ 3.50087043e-04 4.56720856e-05 1.74177703e-04] [-3.50087044e-04 -4.56720853e-05 1.74177703e-04] [-9.14613888e-04 -2.65485462e-04 3.53748241e-04] [ 9.14613887e-04 2.65485463e-04 3.53748242e-04] [ 7.12487191e-04 2.74629232e-05 -2.08767145e-04] [-7.12487190e-04 -2.74629228e-05 -2.08767145e-04] [ 2.55008375e-04 -3.80050034e-04 2.15189026e-05] [-2.55008375e-04 3.80050034e-04 2.15189041e-05] [-6.00094284e-05 -1.24950305e-03 6.35614769e-04] [ 6.00094285e-05 1.24950305e-03 6.35614767e-04] [ 6.66415536e-04 -6.24101339e-06 -3.90056895e-04] [-6.66415536e-04 6.24101417e-06 -3.90056895e-04] [ 7.37401647e-04 -7.11215688e-04 9.68855455e-04] [-7.37401646e-04 7.11215688e-04 9.68855455e-04] [-8.21025308e-04 -8.39776817e-04 -7.34347730e-05] [ 8.21025308e-04 8.39776817e-04 -7.34347730e-05] [ 5.97156799e-04 7.37351327e-06 -8.51118200e-04] [-5.97156798e-04 -7.37351375e-06 -8.51118200e-04] [-2.13056439e-04 1.06257790e-04 -6.70343078e-04] [ 2.13056439e-04 -1.06257791e-04 -6.70343077e-04] [ 6.40307263e-04 -6.58589195e-04 -8.77911769e-04] [-6.40307263e-04 6.58589195e-04 -8.77911769e-04] [-4.46563235e-04 2.44519618e-04 -3.68671734e-05] [ 4.46563235e-04 -2.44519618e-04 -3.68671745e-05] [-1.25761091e-03 1.21877104e-03 7.11609791e-05] [ 1.25761091e-03 -1.21877104e-03 7.11609798e-05] [-3.33067485e-04 5.39536674e-04 -2.56994611e-05] [ 3.33067485e-04 -5.39536672e-04 -2.56994619e-05] [-3.62530154e-04 1.63280469e-05 -2.50280508e-04] [ 3.62530154e-04 -1.63280493e-05 -2.50280510e-04] [ 3.94762361e-04 -5.17642669e-04 2.12224276e-04] [-3.94762362e-04 5.17642668e-04 2.12224276e-04] [ 9.30927583e-04 -1.10050263e-03 3.13146474e-04] [-9.30927583e-04 1.10050263e-03 3.13146476e-04] [ 8.49905596e-04 2.53659476e-04 -4.50899931e-05] [-8.49905595e-04 -2.53659476e-04 -4.50899934e-05] [ 9.75157981e-05 1.93076124e-04 4.71050949e-06] [-9.75157983e-05 -1.93076116e-04 4.71050854e-06] [-9.50007961e-07 2.04282496e-04 3.15078132e-04] [ 9.50008468e-07 -2.04282497e-04 3.15078131e-04] [ 1.36138780e-04 -6.29575728e-04 -4.45228235e-04] [-1.36138781e-04 6.29575729e-04 -4.45228234e-04] [ 6.41049372e-04 1.42914150e-04 5.89300680e-04] [-6.41049371e-04 -1.42914149e-04 5.89300680e-04] [-6.22529526e-04 1.62876964e-04 3.16045633e-04] [ 6.22529525e-04 -1.62876964e-04 3.16045632e-04]] Final stress: [ 3.06047931e-05 4.94101764e-05 1.36180946e-05 1.00502727e-15 -5.30597039e-16 1.60563894e-05] Minimization converged after 117 steps. Minimization converged after 114 steps. Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 111 steps. Minimization converged after 113 steps. Minimization converged after 120 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.42816254e-03 4.03034351e-04 2.97172541e-03] [-2.42816254e-03 -4.03034352e-04 2.97172541e-03] [ 1.53066140e-03 5.52202577e-03 -4.17884328e-03] [-1.53066140e-03 -5.52202577e-03 -4.17884327e-03] [-1.24356567e-03 -5.23399770e-03 2.17592697e-03] [ 1.24356567e-03 5.23399769e-03 2.17592696e-03] [ 9.30959018e-04 4.92253837e-03 -4.52824044e-03] [-9.30959020e-04 -4.92253838e-03 -4.52824045e-03] [-1.19722324e-03 -4.33345566e-04 -1.04866980e-03] [ 1.19722324e-03 4.33345566e-04 -1.04866980e-03] [ 1.74228119e-03 1.95073355e-03 -2.92193155e-03] [-1.74228118e-03 -1.95073355e-03 -2.92193154e-03] [ 1.06662964e-03 2.55424885e-03 3.94320555e-04] [-1.06662964e-03 -2.55424885e-03 3.94320559e-04] [ 6.64499078e-03 -2.55388656e-03 8.61035854e-04] [-6.64499077e-03 2.55388656e-03 8.61035852e-04] [-4.28424350e-03 -1.63873116e-03 -1.52294223e-05] [ 4.28424350e-03 1.63873117e-03 -1.52294168e-05] [-1.86684186e-03 -1.45074789e-03 -8.28273750e-04] [ 1.86684185e-03 1.45074789e-03 -8.28273747e-04] [-1.09741192e-03 -5.69404065e-04 -1.79476716e-03] [ 1.09741191e-03 5.69404068e-04 -1.79476716e-03] [ 4.26551316e-03 1.19644684e-03 -2.74439224e-03] [-4.26551317e-03 -1.19644682e-03 -2.74439224e-03] [-2.07896487e-03 -3.08954604e-03 6.39792469e-03] [ 2.07896487e-03 3.08954604e-03 6.39792469e-03] [-2.09347171e-03 9.76441472e-04 -3.63003498e-03] [ 2.09347171e-03 -9.76441478e-04 -3.63003499e-03] [-4.12078397e-05 -5.32317061e-03 7.41479581e-03] [ 4.12078389e-05 5.32317061e-03 7.41479580e-03] [-2.63230377e-03 6.06579625e-03 -1.57351500e-03] [ 2.63230376e-03 -6.06579625e-03 -1.57351500e-03] [-4.22903414e-03 -3.96199518e-03 4.23700169e-03] [ 4.22903414e-03 3.96199518e-03 4.23700169e-03] [-7.32078158e-03 1.55455214e-03 1.01595912e-03] [ 7.32078158e-03 -1.55455215e-03 1.01595912e-03] [-2.06883191e-03 3.67457891e-03 8.32826711e-04] [ 2.06883191e-03 -3.67457891e-03 8.32826715e-04] [ 4.04090958e-03 -2.69067024e-03 3.75013127e-03] [-4.04090958e-03 2.69067024e-03 3.75013126e-03] [-1.43905740e-03 1.46421931e-03 -1.27183869e-03] [ 1.43905740e-03 -1.46421930e-03 -1.27183870e-03] [-2.65512795e-03 5.89075728e-04 -2.94464283e-03] [ 2.65512795e-03 -5.89075726e-04 -2.94464283e-03] [-1.57509012e-03 5.94630474e-03 -3.90947268e-04] [ 1.57509012e-03 -5.94630474e-03 -3.90947269e-04] [ 4.97606516e-03 1.46863439e-03 6.56721421e-03] [-4.97606516e-03 -1.46863439e-03 6.56721421e-03] [ 6.54535041e-04 3.42787684e-03 -6.27983597e-03] [-6.54535039e-04 -3.42787684e-03 -6.27983596e-03] [-5.56564375e-03 -2.89870856e-03 -3.95257093e-03] [ 5.56564376e-03 2.89870856e-03 -3.95257093e-03] [-9.95936847e-04 -1.26751120e-03 1.46690715e-03] [ 9.95936849e-04 1.26751120e-03 1.46690715e-03] [-3.85147692e-03 -3.00128524e-03 -2.62189776e-03] [ 3.85147692e-03 3.00128524e-03 -2.62189777e-03] [-4.10149097e-03 3.54137119e-03 -1.88286112e-04] [ 4.10149097e-03 -3.54137119e-03 -1.88286111e-04] [-2.30284970e-03 4.79950356e-03 5.51610326e-03] [ 2.30284970e-03 -4.79950356e-03 5.51610326e-03] [ 1.69513234e-03 9.45477535e-04 2.44681165e-03] [-1.69513233e-03 -9.45477535e-04 2.44681165e-03] [ 4.71017768e-03 7.30316899e-04 2.06725205e-03] [-4.71017768e-03 -7.30316898e-04 2.06725205e-03] [ 1.59411315e-03 4.98901952e-04 -2.89108844e-03] [-1.59411315e-03 -4.98901953e-04 -2.89108844e-03] [-7.21893771e-03 6.67511620e-03 -3.32332841e-04] [ 7.21893771e-03 -6.67511620e-03 -3.32332841e-04] [ 3.31768579e-03 -1.58981602e-03 1.60127911e-04] [-3.31768580e-03 1.58981601e-03 1.60127913e-04] [-5.66033738e-03 1.20107737e-02 -5.75051155e-03] [ 5.66033737e-03 -1.20107737e-02 -5.75051155e-03] [-2.26677904e-03 5.33891004e-03 6.36093055e-03] [ 2.26677903e-03 -5.33891004e-03 6.36093055e-03] [-5.98057010e-03 -1.09483651e-03 -5.75015291e-03] [ 5.98057011e-03 1.09483650e-03 -5.75015291e-03] [-1.24740409e-03 3.70611926e-03 -2.68007715e-03] [ 1.24740409e-03 -3.70611926e-03 -2.68007715e-03] [-6.09159037e-03 2.53346836e-03 -1.79081970e-03] [ 6.09159037e-03 -2.53346836e-03 -1.79081969e-03] [-3.30105421e-03 -2.79648070e-04 9.55847970e-04] [ 3.30105422e-03 2.79648069e-04 9.55847971e-04] [ 2.16152982e-03 3.23473707e-03 2.83411930e-03] [-2.16152982e-03 -3.23473707e-03 2.83411930e-03] [-3.54422225e-03 -8.67796547e-04 -1.40994602e-03] [ 3.54422224e-03 8.67796554e-04 -1.40994602e-03] [-1.90507051e-03 -2.82996181e-03 1.82027986e-03] [ 1.90507051e-03 2.82996181e-03 1.82027986e-03] [ 3.31854241e-03 -8.75507259e-04 1.95447652e-03] [-3.31854241e-03 8.75507255e-04 1.95447652e-03] [-3.46353316e-03 1.28767908e-03 1.54153869e-03] [ 3.46353316e-03 -1.28767908e-03 1.54153869e-03] [-6.52137871e-04 2.39788963e-03 -6.09518164e-04] [ 6.52137871e-04 -2.39788964e-03 -6.09518164e-04] [ 6.51128482e-03 1.34525266e-03 -7.44506511e-04] [-6.51128482e-03 -1.34525266e-03 -7.44506506e-04] [-3.05831351e-03 -3.18669028e-03 1.19691025e-03] [ 3.05831352e-03 3.18669028e-03 1.19691024e-03] [ 3.23518565e-03 -5.02245169e-03 7.90434393e-04] [-3.23518565e-03 5.02245169e-03 7.90434395e-04] [ 3.68357481e-03 -1.04374917e-03 -2.85773135e-03] [-3.68357481e-03 1.04374916e-03 -2.85773136e-03]] Final stress: [-9.58926491e-05 4.90838808e-05 -2.58297139e-04 2.42742635e-15 -5.09149988e-16 2.46008137e-04] Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 143 steps. Minimization converged after 142 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.33556600e-03 8.09600207e-04 -9.93041627e-04] [-1.38204428e-03 2.77162046e-03 -7.34468563e-05] [ 2.09379172e-03 1.14293561e-03 -2.05942162e-04] [-2.01929112e-03 1.05508282e-03 -7.32191174e-06] [ 2.33974117e-03 5.16338579e-04 3.14553536e-03] [-2.18789398e-03 1.16437683e-03 -3.49982630e-03] [-1.22754527e-03 1.14025871e-03 -3.41026951e-03] [ 1.35584308e-03 2.52042803e-04 2.37108624e-03] [ 1.01479522e-03 -1.58734100e-03 -2.92255667e-03] [-9.90599185e-04 -1.72766567e-03 2.84402172e-03] [ 1.03196379e-03 6.49353018e-05 -1.73879639e-03] [-1.03498448e-03 -3.22894950e-04 1.40911299e-03] [-1.89673959e-03 -1.08376972e-03 -1.99584234e-03] [ 1.91255048e-03 -8.64532911e-04 1.13521679e-03] [-7.13317735e-03 -1.32152693e-03 -1.61900933e-03] [ 7.14741554e-03 -1.36288301e-03 9.78783881e-04] [ 1.22153035e-03 5.33598180e-04 -1.67587781e-03] [-1.29906467e-03 4.86874927e-04 1.22562181e-03] [ 1.12433778e-04 1.03708635e-03 2.35295556e-03] [-1.32594411e-04 1.24172881e-03 -1.91231409e-03] [ 2.39288753e-03 2.72919574e-03 2.64371863e-03] [-2.39621828e-03 2.81577702e-03 -2.68786182e-03] [-3.93124682e-04 3.09869373e-03 1.58298173e-03] [ 3.70791056e-04 2.99805004e-03 -1.10681838e-03] [-1.07179158e-03 2.15391338e-03 -2.41275725e-04] [ 9.92400520e-04 3.44335813e-03 6.58925846e-04] [ 8.21559404e-04 1.09850488e-04 1.13102948e-03] [-8.28109436e-04 -5.67231283e-04 -5.99493454e-04] [ 1.11413704e-03 -4.16900641e-03 -4.11332125e-03] [-1.29592001e-03 -4.70525326e-03 4.62583023e-03] [ 1.02774067e-03 2.90275519e-03 -8.78473368e-04] [-1.09719947e-03 3.17836624e-03 3.63552329e-04] [-2.67503525e-03 1.63231385e-03 -6.24490667e-05] [ 2.64289052e-03 1.92607268e-03 -1.15435643e-05] [-2.98865609e-03 -1.60979068e-03 -3.09235185e-04] [ 1.37866409e-03 -4.06134796e-03 1.52348989e-03] [ 2.09650670e-03 -1.10890084e-03 7.22160760e-04] [-9.30844016e-04 -4.29449454e-03 -1.14482222e-03] [ 1.77834481e-03 -1.14836141e-03 -4.95927972e-04] [-1.70399182e-03 -1.73670380e-03 2.62246598e-03] [-2.13966221e-03 -1.07749705e-03 9.44556024e-04] [ 1.97288396e-03 -1.85296514e-03 -2.17767073e-03] [-2.06066114e-03 -1.80625252e-03 -3.77801034e-03] [-1.82318806e-03 -2.97404050e-04 -2.13522366e-03] [ 2.09561495e-03 -6.61891587e-04 4.29276948e-03] [ 1.89188563e-03 -1.41895422e-03 2.63428067e-03] [-1.16212909e-03 1.49105648e-03 3.38311597e-03] [-3.57329083e-03 1.91378471e-03 1.86311258e-04] [ 1.15120774e-03 1.42065134e-03 -3.31326605e-03] [ 3.68952711e-03 2.01245474e-03 -2.02365030e-04] [-1.37962638e-03 -3.78124515e-04 -1.96038066e-03] [-2.57887995e-03 -7.19941501e-04 2.20027477e-03] [ 9.67799450e-04 -6.53086008e-04 1.73184299e-03] [ 3.22008385e-03 -3.71754748e-04 -2.33821759e-03] [-1.08286806e-03 -3.82405053e-03 -4.73603517e-04] [-2.93188251e-03 -6.65132498e-06 -8.36509354e-04] [ 1.39185544e-03 -4.00926024e-03 6.72147757e-04] [ 2.41393839e-03 1.91926141e-04 1.04282472e-03] [-9.19250079e-04 2.46797377e-03 -2.54966858e-03] [-6.10431085e-03 -1.97752397e-04 -2.59503821e-03] [ 9.62279794e-04 1.82439637e-03 2.49967093e-03] [ 6.11403348e-03 4.25361105e-04 2.49728451e-03] [ 1.93730414e-04 4.20378085e-03 -4.49493023e-04] [ 2.94153038e-04 -1.16071002e-03 3.46216653e-04] [-7.05065087e-04 4.69022583e-03 3.89304645e-04] [ 2.46246410e-04 -1.61732716e-03 -3.74555264e-04] [ 2.88268894e-03 5.96925994e-04 -3.58635465e-04] [-8.54501340e-04 -6.66426304e-04 2.74328037e-03] [-2.72745005e-03 5.36819432e-04 2.35433507e-04] [ 8.01192489e-04 -5.69519123e-04 -2.85591099e-03] [-2.93475659e-03 5.29655448e-03 -5.58566115e-04] [-2.62569801e-03 -1.28553078e-03 -7.53327987e-04] [ 3.11770754e-03 4.76042503e-03 6.42182007e-04] [ 2.55968913e-03 -4.96490446e-04 7.96292449e-04] [ 1.25277457e-03 -4.09983128e-04 -1.86023666e-03] [ 7.21396162e-04 -3.46693202e-04 -5.10843604e-04] [-1.15378647e-03 -2.94028155e-04 1.52334459e-03] [-8.80815070e-04 -4.91538737e-04 1.67758541e-04] [ 5.46665743e-03 -1.06538293e-03 -1.70943839e-03] [-5.40421058e-03 -9.16202247e-04 2.43618913e-03] [ 2.67773820e-03 -1.39115382e-03 -2.16267006e-03] [-2.58182275e-03 -1.63061863e-03 2.49572096e-03] [ 7.50562402e-04 1.14921072e-03 3.11998384e-03] [-7.48949385e-04 1.31066249e-03 -3.15610578e-03] [ 4.00302689e-05 -1.99200319e-03 2.90895207e-03] [-5.08300480e-05 -1.94914367e-03 -3.20413211e-03] [-5.28525617e-03 -1.66097367e-03 -1.27509889e-03] [ 5.06467495e-03 -1.96424760e-03 6.98062048e-04] [-1.46845503e-03 1.83664125e-03 2.13791426e-03] [ 1.51429707e-03 2.27045161e-03 -2.42465803e-03] [-1.11502863e-03 -1.42890105e-03 -3.17058895e-03] [ 1.18778662e-03 -1.61364466e-03 2.90608318e-03] [-3.78783964e-04 -8.04627221e-04 3.40338160e-03] [ 3.42207110e-04 -1.10740882e-03 -2.91040506e-03] [-4.21489253e-04 -1.10218239e-03 -2.62942052e-03] [ 1.32755140e-03 -5.78924842e-03 -1.83328572e-03] [ 3.58229753e-04 -1.85630909e-03 3.75762972e-03] [-1.22519007e-03 -5.08037064e-03 2.84959910e-03] [-1.64323363e-03 1.89532250e-03 2.47365195e-04] [ 1.06288945e-03 3.10165541e-03 -2.26794817e-03] [ 1.78633294e-03 1.98837035e-03 -7.05853483e-04] [-1.05530324e-03 3.04847860e-03 2.01033281e-03]] Final stress: [-9.93834559e-06 6.26586629e-06 -1.47276033e-05 -4.49236442e-05 -1.18913167e-07 -7.42590186e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.12856622e-04 -1.02586071e-04 -2.18497903e-04] [ 2.13599100e-04 1.72617014e-04 8.64780822e-05] [-2.98269400e-04 3.16206618e-04 2.57108729e-06] [ 2.92669862e-04 2.99686290e-04 3.57728629e-05] [-4.21632857e-04 3.03475206e-05 6.35678557e-04] [ 4.12310774e-04 7.03992317e-05 -6.74047550e-04] [ 2.10751409e-04 1.27913163e-04 -5.11915265e-04] [-2.19756477e-04 6.79116148e-05 4.55454552e-04] [-1.10789781e-04 -9.14836013e-05 -4.20608727e-04] [ 1.07997544e-04 -8.86021724e-05 3.80523259e-04] [-2.89740790e-04 1.62330278e-04 -5.20484313e-04] [ 2.92734885e-04 1.40083925e-04 4.88394128e-04] [ 2.64281352e-04 -3.13559991e-04 -2.98011927e-04] [-2.66876157e-04 -2.92136466e-04 1.98329814e-04] [ 1.01241621e-03 -1.18431487e-04 -3.54972746e-04] [-1.01725890e-03 -1.34743554e-04 2.92477925e-04] [-1.64098668e-04 4.00214037e-06 -2.54718976e-04] [ 1.66315752e-04 -4.43429706e-05 2.08379391e-04] [ 7.96344214e-05 1.97631023e-04 3.56737213e-04] [-8.06285956e-05 2.33946999e-04 -2.93716892e-04] [-4.61698353e-04 3.14530948e-04 3.41062999e-04] [ 4.67765479e-04 3.11992867e-04 -2.92208075e-04] [ 1.85634442e-04 3.87173743e-04 2.14333278e-04] [-1.84271505e-04 3.67380653e-04 -1.25986983e-04] [ 1.65923995e-04 5.57587490e-04 -1.62044983e-04] [-1.59409824e-04 6.56223303e-04 1.31725740e-04] [ 5.52762101e-05 1.14653849e-04 3.57469506e-04] [-5.22806830e-05 4.40211074e-05 -2.81848998e-04] [-2.25915608e-04 -6.19893277e-04 -7.53913611e-04] [ 2.27178270e-04 -6.35773812e-04 9.03027772e-04] [-2.24360059e-04 3.96037127e-04 -2.20664879e-04] [ 2.28140740e-04 4.11719676e-04 1.33421518e-04] [ 5.13253125e-04 3.18753429e-04 3.36906725e-05] [-5.11602310e-04 3.29524682e-04 -5.56660496e-05] [ 2.40830734e-04 -8.70249784e-04 -2.08694199e-04] [-3.92851246e-04 -1.50385047e-04 2.13173539e-05] [-2.30850517e-04 -8.40267295e-04 2.69590322e-04] [ 4.08979435e-04 -1.89257505e-04 5.49219050e-05] [-4.11034255e-04 -3.42543860e-04 -2.99245957e-04] [ 2.62926418e-04 -1.48682767e-04 1.53604019e-04] [ 3.73124518e-04 -3.18546235e-04 3.56088853e-04] [-2.09509054e-04 -1.61886737e-04 -1.08311447e-04] [-2.95304339e-04 -2.23301130e-04 4.74558014e-04] [-4.81599686e-04 -1.36110588e-04 7.31095989e-04] [ 3.13914411e-04 -9.13556252e-05 -4.94779312e-04] [ 4.60034349e-04 -2.64568605e-04 -7.52123316e-04] [-4.33372636e-04 2.17919384e-04 1.51446137e-06] [-9.91549522e-05 3.10690049e-04 -3.41003925e-04] [ 3.81459442e-04 2.14004672e-04 -2.24960861e-05] [ 1.46417654e-04 3.08872075e-04 3.29908013e-04] [-5.52209648e-04 -1.33848486e-04 -4.51913765e-04] [-1.80799931e-04 -8.34052189e-05 4.57582610e-04] [ 5.44818397e-04 -1.60012993e-04 4.07991139e-04] [ 1.77077705e-04 -6.24904005e-05 -4.96597430e-04] [-5.07913224e-04 -1.35416774e-05 1.83076148e-04] [-3.54127059e-05 -4.93548326e-04 1.01404574e-04] [ 5.91325789e-04 -6.51713729e-05 -1.70976130e-04] [-4.52273619e-05 -4.48819463e-04 -9.17168879e-05] [-1.22054412e-03 -2.46875573e-05 3.53437661e-04] [-8.17212338e-05 4.47101584e-04 3.95279653e-04] [ 1.22893663e-03 -1.23681422e-04 -3.37511374e-04] [ 6.97320773e-05 5.50785621e-04 -3.75742796e-04] [-1.14893898e-04 -4.32355545e-04 -7.66983564e-05] [ 3.99059615e-05 7.82339453e-04 -1.11548066e-04] [ 3.11379612e-05 -3.75067363e-04 9.64563204e-05] [ 4.02181043e-05 7.24570594e-04 1.28206504e-04] [-1.62812665e-04 -2.07780302e-04 -4.59172780e-04] [ 4.18547562e-04 2.53409504e-04 5.78928982e-05] [ 1.63392718e-04 -2.21772809e-04 4.59721150e-04] [-4.23558740e-04 2.67515496e-04 -5.63018158e-05] [-6.44837035e-04 -2.32805662e-04 3.25502622e-04] [-3.02520533e-04 6.12983946e-04 2.76196864e-04] [ 7.04104408e-04 -2.71593379e-04 -3.19055927e-04] [ 2.47173822e-04 6.36173376e-04 -2.63728468e-04] [-7.02956828e-06 -1.90341825e-04 6.53791515e-05] [ 7.09578367e-05 1.09026033e-04 3.62669787e-04] [ 2.95923014e-05 -1.69103557e-04 -1.23963774e-04] [-8.98869388e-05 8.77018228e-05 -4.17948765e-04] [-8.35149129e-04 -2.80197490e-04 -3.65622954e-04] [ 8.34793906e-04 -2.80868265e-04 4.02621295e-04] [-2.94801263e-04 -2.55921202e-04 -2.03289495e-04] [ 2.89511438e-04 -2.81585580e-04 2.52039510e-04] [-2.02602170e-04 1.03930392e-04 4.65267399e-04] [ 2.03296675e-04 1.11313541e-04 -4.80557723e-04] [ 1.64854629e-05 -2.43699376e-04 6.48883498e-04] [-2.12530892e-05 -2.05115769e-04 -6.57866290e-04] [ 7.28605058e-04 1.56648612e-04 -3.00944499e-04] [-7.18069623e-04 -5.29400943e-05 2.73302410e-04] [ 1.56426864e-04 3.43484811e-04 1.93824642e-04] [-1.54394643e-04 3.95759457e-04 -2.41147151e-04] [ 4.44661868e-04 -2.79973568e-04 -5.31658708e-04] [-4.48832346e-04 -2.71187543e-04 4.89169158e-04] [-6.69500577e-05 -8.01071386e-05 6.89455675e-04] [ 5.88056320e-05 -6.15063284e-05 -6.43552897e-04] [ 1.32349422e-04 -8.10910402e-04 3.03728947e-04] [-3.10516263e-05 -3.39020512e-04 6.23474574e-04] [-1.22723162e-04 -8.74834358e-04 -2.04303527e-04] [ 1.96414234e-05 -2.75018003e-04 -5.18127159e-04] [ 2.38969757e-04 5.70821740e-04 4.29708042e-04] [-3.29354191e-04 3.37161852e-04 -2.47860601e-04] [-2.32471592e-04 5.57228774e-04 -4.73389715e-04] [ 3.18104453e-04 3.49504091e-04 1.96759651e-04]] Final stress: [-1.49762682e-06 -1.24284322e-06 -5.33944482e-06 -3.32436611e-05 2.49856465e-08 1.34952828e-05] Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 146 steps. Minimization converged after 146 steps. Minimization converged after 147 steps. Minimization converged after 147 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 1.21047825e-03 -2.29273946e-04 -1.21226626e-04] [-1.21047825e-03 2.29273950e-04 -1.21226625e-04] [ 1.15505477e-03 6.61958104e-05 -5.10252729e-05] [-1.15505476e-03 -6.61958118e-05 -5.10252729e-05] [ 1.41485577e-03 -1.75544883e-04 9.84485246e-05] [-1.41485577e-03 1.75544881e-04 9.84485246e-05] [-2.69736985e-03 -1.31606461e-04 9.24128655e-05] [ 2.69736985e-03 1.31606468e-04 9.24128712e-05] [-9.27022824e-04 5.59908687e-06 -1.62320197e-06] [ 9.27022824e-04 -5.59909203e-06 -1.62320062e-06] [ 4.06299985e-04 1.53162628e-04 -1.05019759e-04] [-4.06299984e-04 -1.53162629e-04 -1.05019761e-04] [ 3.01775571e-04 4.98027108e-05 2.70015887e-04] [-3.01775570e-04 -4.98027132e-05 2.70015877e-04] [-2.47382174e-03 3.17098364e-04 4.39651507e-04] [ 2.47382174e-03 -3.17098369e-04 4.39651508e-04] [-3.77662743e-04 -8.43322449e-06 4.80725307e-05] [ 3.77662743e-04 8.43321918e-06 4.80725259e-05] [-4.88496008e-04 -1.70817711e-04 -8.89178388e-05] [ 4.88496008e-04 1.70817710e-04 -8.89178424e-05] [ 2.35913105e-03 7.70233100e-05 9.77068263e-05] [-2.35913105e-03 -7.70233123e-05 9.77068219e-05] [-4.19546111e-04 2.12480456e-04 1.53262628e-05] [ 4.19546111e-04 -2.12480449e-04 1.53262632e-05] [ 3.09547696e-05 1.62197396e-04 -4.67019673e-04] [-3.09547699e-05 -1.62197372e-04 -4.67019645e-04] [-9.53151521e-04 -3.05938729e-04 -6.10304189e-04] [ 9.53151521e-04 3.05938723e-04 -6.10304177e-04] [ 2.14725762e-03 1.82987009e-04 1.58483593e-04] [-2.14725762e-03 -1.82987009e-04 1.58483592e-04] [-1.34656925e-03 -1.15100434e-04 -1.99305422e-04] [ 1.34656925e-03 1.15100435e-04 -1.99305425e-04] [-1.84948881e-03 -2.07819324e-04 -2.21717143e-05] [ 1.84948881e-03 2.07819323e-04 -2.21717140e-05] [-1.54386428e-03 2.02333226e-03 3.42824522e-04] [ 1.54386428e-03 -2.02333226e-03 3.42824525e-04] [ 1.08476112e-03 1.99139747e-03 -1.18456279e-05] [-1.08476113e-03 -1.99139748e-03 -1.18456324e-05] [ 9.29038145e-04 -4.17320812e-04 2.11048993e-03] [-9.29038146e-04 4.17320813e-04 2.11048993e-03] [-1.07324261e-03 -3.71789928e-04 -1.83709075e-03] [ 1.07324261e-03 3.71789929e-04 -1.83709075e-03] [-7.27903482e-04 -1.27781509e-03 -1.66076289e-03] [ 7.27903481e-04 1.27781509e-03 -1.66076289e-03] [ 5.66078747e-04 -7.90495077e-04 1.78266569e-03] [-5.66078747e-04 7.90495078e-04 1.78266569e-03] [-1.43667916e-03 1.38914089e-03 1.77070805e-03] [ 1.43667915e-03 -1.38914089e-03 1.77070805e-03] [ 1.32592989e-03 1.21298110e-03 -1.69774583e-03] [-1.32592988e-03 -1.21298110e-03 -1.69774583e-03] [-6.37258945e-04 -1.26110503e-03 -1.55469055e-03] [ 6.37258945e-04 1.26110503e-03 -1.55469055e-03] [ 3.18746735e-04 -1.26092883e-03 1.29161462e-03] [-3.18746736e-04 1.26092883e-03 1.29161462e-03] [ 1.13588460e-03 -2.25133918e-03 1.46175433e-04] [-1.13588459e-03 2.25133919e-03 1.46175430e-04] [-2.00190103e-03 -1.74706646e-03 -3.41311379e-04] [ 2.00190102e-03 1.74706647e-03 -3.41311374e-04] [ 2.02787704e-03 7.05068225e-04 -1.97808010e-04] [-2.02787704e-03 -7.05068225e-04 -1.97808012e-04] [-2.18514728e-03 4.38428086e-04 8.87829398e-05] [ 2.18514728e-03 -4.38428086e-04 8.87829419e-05] [ 2.22304181e-03 1.37779215e-03 2.09773070e-03] [-2.22304182e-03 -1.37779215e-03 2.09773070e-03] [-2.22763160e-03 1.39402504e-03 -2.43681158e-03] [ 2.22763161e-03 -1.39402504e-03 -2.43681158e-03] [-1.50318060e-04 4.42041636e-04 7.50805324e-04] [ 1.50318057e-04 -4.42041635e-04 7.50805332e-04] [ 3.25851004e-04 6.38843652e-04 -6.03384489e-04] [-3.25851000e-04 -6.38843652e-04 -6.03384498e-04] [ 2.13664607e-03 1.31810540e-03 -1.72232045e-03] [-2.13664607e-03 -1.31810540e-03 -1.72232045e-03] [-2.68155670e-03 9.90919842e-04 1.65040298e-03] [ 2.68155670e-03 -9.90919834e-04 1.65040299e-03] [ 6.47828876e-05 4.73031780e-04 -1.18355104e-03] [-6.47828863e-05 -4.73031780e-04 -1.18355103e-03] [ 1.21921741e-04 3.23571008e-04 1.15186406e-03] [-1.21921743e-04 -3.23571008e-04 1.15186405e-03] [ 9.76885973e-04 -1.82808753e-04 1.16024602e-04] [-9.76885975e-04 1.82808741e-04 1.16024589e-04] [-1.17299064e-03 -2.11755836e-05 1.81109995e-05] [ 1.17299064e-03 2.11755837e-05 1.81110001e-05] [ 1.34408497e-03 7.53778938e-05 -1.97000581e-04] [-1.34408497e-03 -7.53778937e-05 -1.97000581e-04] [-6.55694063e-04 2.57567820e-04 -1.54132929e-04] [ 6.55694065e-04 -2.57567826e-04 -1.54132934e-04] [-9.97538526e-04 -1.46985439e-04 -5.04037393e-05] [ 9.97538525e-04 1.46985440e-04 -5.04037370e-05] [ 2.60203774e-03 -4.68942526e-05 -6.35513295e-05] [-2.60203774e-03 4.68942515e-05 -6.35513305e-05] [-2.96959082e-03 -9.87736539e-05 1.02009864e-04] [ 2.96959083e-03 9.87736562e-05 1.02009864e-04] [-5.16863282e-04 -4.71384376e-05 4.35066242e-05] [ 5.16863284e-04 4.71384299e-05 4.35066253e-05] [ 1.42093875e-03 -5.05289500e-04 -5.96941722e-04] [-1.42093875e-03 5.05289497e-04 -5.96941726e-04] [-1.55924552e-03 -8.56600439e-04 5.95392546e-04] [ 1.55924552e-03 8.56600436e-04 5.95392549e-04] [-2.58209300e-03 -2.23151635e-03 3.94030632e-04] [ 2.58209299e-03 2.23151635e-03 3.94030618e-04] [ 2.25246689e-03 -1.73270636e-03 3.02709075e-04] [-2.25246688e-03 1.73270635e-03 3.02709090e-04]] Final stress: [-4.29118199e-06 7.72710432e-08 -5.66079394e-06 6.02934549e-15 -2.15598400e-15 -3.36248876e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-2.59322103e-03 -5.15733548e-03 -1.45523611e-03] [ 2.59322103e-03 5.15733545e-03 -1.45523610e-03] [-2.77807703e-03 6.44248401e-04 -8.96359018e-05] [ 2.77807703e-03 -6.44248399e-04 -8.96359042e-05] [-3.13385683e-03 -7.12630183e-04 -3.94519194e-05] [ 3.13385683e-03 7.12630182e-04 -3.94519206e-05] [ 6.54172380e-03 6.86311817e-04 -1.68892699e-03] [-6.54172380e-03 -6.86311791e-04 -1.68892697e-03] [ 2.19619715e-03 5.06461840e-05 4.20037523e-04] [-2.19619715e-03 -5.06461885e-05 4.20037521e-04] [-1.06337797e-03 7.42035605e-04 -7.53671212e-04] [ 1.06337797e-03 -7.42035606e-04 -7.53671208e-04] [-4.66469778e-04 9.54671137e-06 1.59876083e-04] [ 4.66469778e-04 -9.54671802e-06 1.59876058e-04] [ 6.66764997e-03 2.09494961e-03 4.37467551e-04] [-6.66764997e-03 -2.09494961e-03 4.37467562e-04] [ 8.12851088e-04 -3.18886676e-04 5.92934935e-05] [-8.12851088e-04 3.18886667e-04 5.92934858e-05] [ 6.15454535e-04 -8.10927314e-04 -2.05798954e-04] [-6.15454535e-04 8.10927307e-04 -2.05798960e-04] [-5.62435639e-03 -8.50138449e-06 1.60857423e-04] [ 5.62435639e-03 8.50138136e-06 1.60857416e-04] [ 1.13124081e-03 -1.99205575e-03 -6.04171466e-04] [-1.13124080e-03 1.99205574e-03 -6.04171455e-04] [ 2.14472177e-04 -4.09225289e-04 -1.04968128e-03] [-2.14472177e-04 4.09225338e-04 -1.04968122e-03] [ 1.75508742e-03 -1.28652949e-04 -1.57174430e-03] [-1.75508742e-03 1.28652937e-04 -1.57174428e-03] [-5.40166989e-03 9.86769544e-04 -1.29199691e-04] [ 5.40166988e-03 -9.86769547e-04 -1.29199695e-04] [ 2.86029734e-03 -3.36363412e-04 -7.63635365e-04] [-2.86029734e-03 3.36363412e-04 -7.63635371e-04] [ 4.11288067e-03 -4.94570406e-05 4.29014882e-04] [-4.11288067e-03 4.94570452e-05 4.29014880e-04] [ 2.24750151e-03 -4.65841367e-03 1.10971582e-04] [-2.24750151e-03 4.65841366e-03 1.10971589e-04] [-4.40568609e-03 -4.69959846e-03 6.87402174e-04] [ 4.40568609e-03 4.69959846e-03 6.87402166e-04] [-2.34644373e-03 -1.93213804e-05 -3.12311461e-03] [ 2.34644373e-03 1.93213784e-05 -3.12311460e-03] [ 2.04240313e-03 1.39258570e-03 5.71366532e-03] [-2.04240313e-03 -1.39258570e-03 5.71366532e-03] [ 1.47132640e-03 1.47542067e-03 4.75214695e-03] [-1.47132640e-03 -1.47542067e-03 4.75214695e-03] [-2.00548588e-03 3.82768800e-03 -3.53266421e-03] [ 2.00548588e-03 -3.82768799e-03 -3.53266422e-03] [ 3.80746949e-03 -3.59619924e-03 -4.39603922e-03] [-3.80746950e-03 3.59619924e-03 -4.39603921e-03] [-4.09075925e-03 -2.70230959e-03 2.82673679e-03] [ 4.09075926e-03 2.70230959e-03 2.82673678e-03] [ 1.80263744e-04 3.14970732e-03 2.84755195e-03] [-1.80263744e-04 -3.14970732e-03 2.84755195e-03] [-1.94670830e-03 2.60844725e-03 -3.39113913e-03] [ 1.94670830e-03 -2.60844725e-03 -3.39113913e-03] [-4.77799959e-03 4.45558358e-03 -5.37770259e-04] [ 4.77799960e-03 -4.45558356e-03 -5.37770271e-04] [ 2.76108435e-03 4.93275353e-03 5.12930777e-04] [-2.76108436e-03 -4.93275351e-03 5.12930788e-04] [-5.14325633e-03 -6.75753450e-04 2.81135263e-04] [ 5.14325633e-03 6.75753452e-04 2.81135258e-04] [ 4.56076498e-03 -1.37924569e-03 -7.66484571e-04] [-4.56076499e-03 1.37924569e-03 -7.66484567e-04] [-4.92139749e-03 -3.82253429e-03 -5.38671118e-03] [ 4.92139748e-03 3.82253428e-03 -5.38671119e-03] [ 3.97407300e-03 -1.77833391e-03 5.92265434e-03] [-3.97407298e-03 1.77833390e-03 5.92265435e-03] [ 7.21305145e-04 -1.72792037e-03 -1.84840756e-03] [-7.21305152e-04 1.72792037e-03 -1.84840755e-03] [-1.39642585e-04 -1.24368403e-03 1.74295974e-03] [ 1.39642593e-04 1.24368403e-03 1.74295973e-03] [-6.71608028e-03 -1.54526172e-03 3.91303114e-03] [ 6.71608028e-03 1.54526173e-03 3.91303113e-03] [ 4.55966909e-03 -4.02311466e-03 -4.04448003e-03] [-4.55966909e-03 4.02311467e-03 -4.04448002e-03] [ 3.64261906e-04 -6.06618510e-04 2.36587002e-03] [-3.64261899e-04 6.06618513e-04 2.36587003e-03] [ 6.08279535e-04 -1.03460986e-03 -2.97691100e-03] [-6.08279537e-04 1.03460985e-03 -2.97691101e-03] [-2.53208909e-03 -6.38659270e-04 8.94106174e-04] [ 2.53208909e-03 6.38659245e-04 8.94106150e-04] [ 2.33693488e-03 -1.27616069e-04 2.26594179e-04] [-2.33693488e-03 1.27616068e-04 2.26594183e-04] [-3.20742807e-03 1.00973010e-04 -6.03288314e-04] [ 3.20742807e-03 -1.00973009e-04 -6.03288317e-04] [ 1.60112718e-03 2.17020076e-04 3.17222722e-05] [-1.60112718e-03 -2.17020098e-04 3.17222535e-05] [ 1.50800171e-03 2.13278313e-03 -1.90799697e-04] [-1.50800171e-03 -2.13278310e-03 -1.90799697e-04] [-5.57471023e-03 -3.93997297e-04 -8.36694442e-05] [ 5.57471023e-03 3.93997292e-04 -8.36694438e-05] [ 6.66657008e-03 -1.48990663e-04 2.05693745e-04] [-6.66657008e-03 1.48990667e-04 2.05693742e-04] [ 4.96004915e-04 2.26308406e-03 3.34823257e-04] [-4.96004918e-04 -2.26308406e-03 3.34823256e-04] [-4.00210854e-03 2.78811173e-03 2.73354044e-03] [ 4.00210854e-03 -2.78811173e-03 2.73354043e-03] [ 2.78179827e-03 6.73849286e-05 -4.50415544e-04] [-2.78179827e-03 -6.73849298e-05 -4.50415529e-04] [ 5.26114172e-03 4.16075295e-03 1.20282566e-03] [-5.26114174e-03 -4.16075296e-03 1.20282563e-03] [-5.65382960e-03 4.77831589e-03 7.10139219e-04] [ 5.65382961e-03 -4.77831590e-03 7.10139254e-04]] Final stress: [-2.00519637e-05 9.93656509e-06 -6.03955210e-06 1.03903131e-14 2.85153981e-15 8.58169057e-05] Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 15 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 12 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 115 steps. Minimization converged after 117 steps. Minimization converged after 112 steps. Minimization converged after 118 steps. Minimization converged after 24 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 20 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 2.16969263e-04 -5.61881205e-05 -2.13855241e-05] [-2.16969263e-04 5.61881357e-05 -2.13855281e-05] [ 2.50473533e-04 -3.51039581e-04 -4.23903725e-05] [-2.50473533e-04 3.51039579e-04 -4.23903707e-05] [ 1.72488818e-04 8.11302069e-05 2.26345387e-04] [-1.72488818e-04 -8.11302077e-05 2.26345386e-04] [-3.36855469e-04 4.84378205e-04 -7.60336172e-05] [ 3.36855469e-04 -4.84378210e-04 -7.60336227e-05] [ 5.54906473e-05 -2.02011632e-04 1.89810622e-04] [-5.54906472e-05 2.02011632e-04 1.89810622e-04] [ 5.79596669e-05 -1.01708800e-06 -2.94136452e-04] [-5.79596668e-05 1.01708704e-06 -2.94136453e-04] [-3.03331335e-04 -1.27061968e-05 2.14401834e-04] [ 3.03331334e-04 1.27061983e-05 2.14401836e-04] [-6.56064683e-04 4.92611495e-04 2.89509985e-04] [ 6.56064683e-04 -4.92611498e-04 2.89509984e-04] [ 7.12404891e-06 -3.55186872e-04 3.57248977e-04] [-7.12404900e-06 3.55186873e-04 3.57248977e-04] [ 1.61803380e-04 -6.55649992e-05 -1.45842648e-04] [-1.61803380e-04 6.55650016e-05 -1.45842647e-04] [ 4.73439179e-04 2.85129254e-04 -5.41628552e-05] [-4.73439180e-04 -2.85129255e-04 -5.41628545e-05] [-3.01558212e-04 -8.47521593e-06 -1.62885664e-04] [ 3.01558212e-04 8.47522802e-06 -1.62885668e-04] [ 5.39203757e-06 -1.52061226e-04 1.54429014e-06] [-5.39203791e-06 1.52061219e-04 1.54428155e-06] [-2.33440823e-05 -4.58756594e-04 -5.04995216e-04] [ 2.33440824e-05 4.58756593e-04 -5.04995219e-04] [ 3.14548919e-04 -8.84256204e-05 2.96766861e-04] [-3.14548918e-04 8.84256212e-05 2.96766862e-04] [ 1.83734791e-05 -2.23335380e-04 -2.01332292e-04] [-1.83734788e-05 2.23335381e-04 -2.01332291e-04] [-3.09952694e-04 2.29771440e-04 1.07803132e-06] [ 3.09952694e-04 -2.29771443e-04 1.07803286e-06] [-1.19231118e-04 2.34876377e-04 -8.08556476e-05] [ 1.19231118e-04 -2.34876377e-04 -8.08556479e-05] [ 3.87278465e-04 2.30636092e-04 -2.38147962e-06] [-3.87278464e-04 -2.30636092e-04 -2.38147882e-06] [ 3.84514524e-07 -6.50028607e-05 2.30155587e-04] [-3.84517343e-07 6.50028620e-05 2.30155588e-04] [-9.35837691e-05 1.35916145e-04 -3.36403691e-04] [ 9.35837713e-05 -1.35916142e-04 -3.36403693e-04] [ 4.98664987e-05 -4.47406066e-04 -2.92143382e-04] [-4.98664991e-05 4.47406066e-04 -2.92143382e-04] [ 1.38548806e-04 -1.17392200e-04 2.48052521e-04] [-1.38548806e-04 1.17392199e-04 2.48052521e-04] [ 7.69642279e-05 -8.90628479e-06 3.32294617e-04] [-7.69642278e-05 8.90628834e-06 3.32294614e-04] [ 8.99341264e-05 2.50786842e-04 -1.06269263e-04] [-8.99341259e-05 -2.50786839e-04 -1.06269260e-04] [ 2.44104165e-04 5.58670012e-05 3.90125678e-05] [-2.44104165e-04 -5.58670006e-05 3.90125670e-05] [-7.58678716e-05 -2.65566925e-04 7.86042746e-05] [ 7.58678715e-05 2.65566925e-04 7.86042747e-05] [ 2.82264158e-04 -1.18127517e-04 9.00699796e-05] [-2.82264159e-04 1.18127515e-04 9.00699808e-05] [-1.17977735e-04 -1.43186473e-04 -1.40232351e-04] [ 1.17977737e-04 1.43186471e-04 -1.40232353e-04] [ 2.80993922e-04 -1.28407616e-04 -5.62593238e-05] [-2.80993922e-04 1.28407615e-04 -5.62593236e-05] [-3.40708413e-04 1.29990371e-04 2.02241034e-04] [ 3.40708412e-04 -1.29990372e-04 2.02241033e-04] [ 1.44546007e-04 4.85995124e-04 4.67099420e-04] [-1.44546005e-04 -4.85995122e-04 4.67099422e-04] [-1.25321834e-04 5.84750361e-05 -2.40742247e-04] [ 1.25321831e-04 -5.84750331e-05 -2.40742249e-04] [ 2.70590962e-04 1.76348694e-04 3.53925569e-04] [-2.70590962e-04 -1.76348694e-04 3.53925568e-04] [ 3.48090417e-04 -8.40903829e-05 -2.39017492e-04] [-3.48090418e-04 8.40903832e-05 -2.39017490e-04] [ 4.38966616e-04 1.70157660e-04 -1.87161131e-04] [-4.38966616e-04 -1.70157660e-04 -1.87161131e-04] [-1.85964687e-04 2.93065580e-04 -7.33175436e-05] [ 1.85964687e-04 -2.93065581e-04 -7.33175440e-05] [ 3.01407988e-04 2.70012976e-04 -3.90821065e-04] [-3.01407989e-04 -2.70012975e-04 -3.90821066e-04] [-9.86923056e-05 -1.65524181e-04 -1.80899522e-04] [ 9.86923059e-05 1.65524181e-04 -1.80899521e-04] [ 2.98547583e-04 8.09741840e-05 4.50548725e-06] [-2.98547583e-04 -8.09741808e-05 4.50549081e-06] [ 2.67073124e-04 5.94394768e-04 1.50908336e-05] [-2.67073124e-04 -5.94394768e-04 1.50908332e-05] [ 4.39712439e-05 2.18418853e-04 9.21486158e-05] [-4.39712442e-05 -2.18418852e-04 9.21486157e-05] [-1.62212190e-05 1.43075368e-05 -9.54180523e-05] [ 1.62212187e-05 -1.43075336e-05 -9.54180500e-05] [-2.17378348e-04 -3.72112995e-04 5.49738041e-05] [ 2.17378348e-04 3.72112983e-04 5.49738047e-05] [-7.18943387e-05 -5.20090729e-04 1.01520092e-04] [ 7.18943390e-05 5.20090729e-04 1.01520091e-04] [-3.68613987e-04 1.54352371e-04 -1.74212167e-04] [ 3.68613987e-04 -1.54352371e-04 -1.74212167e-04] [-2.36770451e-06 7.17866499e-05 -3.10185784e-05] [ 2.36770425e-06 -7.17866603e-05 -3.10185782e-05] [ 8.31639621e-05 3.10595564e-04 -1.85864472e-04] [-8.31639618e-05 -3.10595565e-04 -1.85864468e-04] [ 5.87401060e-05 -1.32331470e-04 2.58061947e-04] [-5.87401064e-05 1.32331469e-04 2.58061944e-04] [-2.61398730e-04 -1.24235344e-04 4.61738192e-05] [ 2.61398730e-04 1.24235344e-04 4.61738258e-05] [ 2.82726626e-04 3.85505038e-05 1.25545901e-04] [-2.82726627e-04 -3.85505039e-05 1.25545895e-04]] Final stress: [ 1.91001479e-05 3.23966373e-05 8.72114213e-06 -1.61094948e-15 1.17116505e-15 -7.01703391e-06] Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 5.85885072e-04 2.24565213e-04 6.93746634e-05] [-5.85885073e-04 -2.24565185e-04 6.93746580e-05] [ 8.78264493e-04 1.03151583e-03 1.53561987e-04] [-8.78264493e-04 -1.03151583e-03 1.53561989e-04] [ 3.36596372e-04 -6.67767855e-04 -6.86406451e-04] [-3.36596373e-04 6.67767856e-04 -6.86406454e-04] [-1.22197701e-03 -1.39725711e-03 -7.58884708e-05] [ 1.22197701e-03 1.39725711e-03 -7.58884754e-05] [ 1.47366737e-04 7.04197531e-04 -5.90259403e-04] [-1.47366738e-04 -7.04197530e-04 -5.90259403e-04] [ 2.19713997e-04 1.31345991e-04 8.70557978e-04] [-2.19713997e-04 -1.31345995e-04 8.70557979e-04] [-1.03232324e-03 2.36386139e-05 -9.51013278e-04] [ 1.03232324e-03 -2.36386135e-05 -9.51013275e-04] [-1.72753606e-03 -8.94504217e-04 -1.50144948e-03] [ 1.72753605e-03 8.94504209e-04 -1.50144948e-03] [-4.55382742e-05 1.23933261e-03 -1.22475930e-03] [ 4.55382753e-05 -1.23933261e-03 -1.22475930e-03] [ 3.97867206e-04 -1.63880656e-04 8.50414191e-04] [-3.97867207e-04 1.63880656e-04 8.50414190e-04] [ 1.73399795e-03 -9.10581854e-04 2.17943774e-04] [-1.73399795e-03 9.10581852e-04 2.17943775e-04] [-1.34026708e-03 1.12355336e-04 5.35475105e-04] [ 1.34026708e-03 -1.12355337e-04 5.35475106e-04] [ 3.37296324e-04 6.19000070e-04 -5.31156347e-04] [-3.37296324e-04 -6.19000068e-04 -5.31156343e-04] [-5.34962835e-05 8.53008228e-04 2.04780279e-03] [ 5.34962835e-05 -8.53008226e-04 2.04780279e-03] [ 9.20489460e-04 4.80897840e-04 -5.14134695e-04] [-9.20489461e-04 -4.80897840e-04 -5.14134694e-04] [ 6.24198387e-05 7.40529888e-04 4.17653186e-04] [-6.24198384e-05 -7.40529887e-04 4.17653186e-04] [-1.25389551e-03 -8.71110476e-04 -1.69717737e-04] [ 1.25389551e-03 8.71110472e-04 -1.69717736e-04] [-1.24822780e-03 2.28939151e-04 7.72238889e-05] [ 1.24822780e-03 -2.28939153e-04 7.72238892e-05] [ 3.47592695e-04 8.98267090e-04 6.85925216e-04] [-3.47592695e-04 -8.98267090e-04 6.85925218e-04] [-3.01476050e-04 1.89589016e-04 1.49131325e-03] [ 3.01476052e-04 -1.89589016e-04 1.49131324e-03] [ 3.55202587e-04 -1.54235374e-05 -5.90346750e-04] [-3.55202587e-04 1.54235374e-05 -5.90346748e-04] [-5.68717050e-04 -8.38283600e-04 -1.03640017e-03] [ 5.68717049e-04 8.38283602e-04 -1.03640017e-03] [ 5.66252979e-06 -1.29994639e-03 9.81327113e-04] [-5.66252719e-06 1.29994639e-03 9.81327114e-04] [-3.36301683e-04 1.26822041e-03 4.67104453e-04] [ 3.36301684e-04 -1.26822041e-03 4.67104449e-04] [ 1.49172798e-04 -9.05805689e-05 -1.10340113e-03] [-1.49172802e-04 9.05805720e-05 -1.10340113e-03] [ 5.78540254e-04 -6.33882808e-04 -4.51523293e-04] [-5.78540255e-04 6.33882806e-04 -4.51523291e-04] [-7.24400877e-04 -9.63245370e-05 -3.01450368e-04] [ 7.24400878e-04 9.63245349e-05 -3.01450368e-04] [ 6.91685117e-04 -2.39937845e-04 4.50713039e-04] [-6.91685116e-04 2.39937846e-04 4.50713040e-04] [-1.12893631e-03 5.23263289e-05 -6.99206821e-04] [ 1.12893631e-03 -5.23263297e-05 -6.99206821e-04] [ 1.06094580e-03 8.04569140e-04 -6.69504557e-04] [-1.06094581e-03 -8.04569139e-04 -6.69504558e-04] [-8.30562857e-04 -7.10541065e-04 1.77034689e-04] [ 8.30562857e-04 7.10541066e-04 1.77034687e-04] [ 5.99178214e-04 3.05432490e-04 1.02073365e-03] [-5.99178211e-04 -3.05432487e-04 1.02073365e-03] [-5.54305078e-04 1.15244019e-03 -2.44732748e-03] [ 5.54305075e-04 -1.15244018e-03 -2.44732748e-03] [-9.97522090e-04 -4.16214529e-04 7.09438993e-04] [ 9.97522090e-04 4.16214528e-04 7.09438992e-04] [-5.91214255e-04 6.76687018e-04 -1.05194844e-03] [ 5.91214255e-04 -6.76687018e-04 -1.05194844e-03] [ 1.34911454e-03 5.57120358e-04 8.43443812e-05] [-1.34911454e-03 -5.57120356e-04 8.43443806e-05] [-2.10156507e-03 -1.96589620e-05 8.35488594e-04] [ 2.10156507e-03 1.96589646e-05 8.35488594e-04] [ 6.54987261e-04 -4.94951986e-04 4.19793613e-04] [-6.54987260e-04 4.94951988e-04 4.19793613e-04] [-8.74437275e-04 7.85936129e-04 1.51586254e-03] [ 8.74437275e-04 -7.85936129e-04 1.51586254e-03] [ 5.80914470e-04 -3.94320656e-04 1.16397594e-04] [-5.80914470e-04 3.94320654e-04 1.16397595e-04] [ 3.77262976e-04 -1.97113869e-03 -9.16205462e-05] [-3.77262977e-04 1.97113869e-03 -9.16205470e-05] [-3.97539236e-05 -5.07768253e-04 -5.11045363e-04] [ 3.97539227e-05 5.07768252e-04 -5.11045364e-04] [-4.53270369e-04 -1.50021536e-04 2.35965907e-04] [ 4.53270369e-04 1.50021536e-04 2.35965904e-04] [-9.56164660e-05 4.25009141e-04 -1.18097994e-04] [ 9.56164674e-05 -4.25009164e-04 -1.18097993e-04] [ 2.39946324e-04 1.53016510e-03 -4.17254965e-04] [-2.39946324e-04 -1.53016510e-03 -4.17254966e-04] [-1.39974371e-03 -8.38222565e-04 7.53335443e-04] [ 1.39974371e-03 8.38222565e-04 7.53335442e-04] [ 1.85465670e-04 2.76770791e-04 2.21289479e-04] [-1.85465671e-04 -2.76770788e-04 2.21289480e-04] [ 1.25778693e-04 -7.36312064e-04 -2.62347133e-04] [-1.25778693e-04 7.36312060e-04 -2.62347129e-04] [-1.65252118e-04 4.53767417e-04 8.64030901e-04] [ 1.65252117e-04 -4.53767420e-04 8.64030898e-04] [-9.32942753e-04 7.60887968e-05 -3.14416582e-04] [ 9.32942753e-04 -7.60887983e-05 -3.14416582e-04] [ 8.55802614e-04 -1.62862073e-04 4.05703537e-05] [-8.55802616e-04 1.62862074e-04 4.05703534e-05]] Final stress: [-2.23968730e-05 -2.82030508e-05 -1.25095678e-05 1.52024320e-15 4.45794586e-15 -2.40989650e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.76452370e-04 1.35361437e-04 3.43406582e-06] [ 2.76452370e-04 -1.35361434e-04 3.43406573e-06] [-3.46334132e-04 3.90130672e-04 1.10266299e-04] [ 3.46334133e-04 -3.90130669e-04 1.10266297e-04] [-1.75817915e-04 -2.19464799e-04 -3.23641412e-04] [ 1.75817915e-04 2.19464800e-04 -3.23641411e-04] [ 4.42387871e-04 -6.33143730e-04 9.34628035e-05] [-4.42387871e-04 6.33143731e-04 9.34628028e-05] [-1.01066933e-04 2.56062963e-04 -2.40166214e-04] [ 1.01066933e-04 -2.56062963e-04 -2.40166213e-04] [-9.17894850e-05 3.73641516e-05 3.66369371e-04] [ 9.17894847e-05 -3.73641514e-05 3.66369370e-04] [ 3.94804350e-04 2.10883547e-05 -3.33803421e-04] [-3.94804350e-04 -2.10883570e-05 -3.33803423e-04] [ 7.53364593e-04 -5.77623495e-04 -4.08475621e-04] [-7.53364593e-04 5.77623493e-04 -4.08475622e-04] [-1.24807431e-05 4.99482336e-04 -4.72999692e-04] [ 1.24807433e-05 -4.99482336e-04 -4.72999692e-04] [-1.32321840e-04 -1.71115604e-05 2.52507111e-04] [ 1.32321840e-04 1.71115603e-05 2.52507110e-04] [-5.80521435e-04 -3.26118603e-04 8.58097609e-05] [ 5.80521434e-04 3.26118604e-04 8.58097591e-05] [ 4.08870036e-04 5.77923204e-05 2.69541635e-04] [-4.08870035e-04 -5.77923404e-05 2.69541640e-04] [-7.21435255e-06 1.78006700e-04 -1.13344275e-04] [ 7.21435162e-06 -1.78006695e-04 -1.13344266e-04] [ 4.43592799e-05 5.15613041e-04 6.88199640e-04] [-4.43592802e-05 -5.15613036e-04 6.88199646e-04] [-3.65488468e-04 1.16007192e-04 -1.75451426e-04] [ 3.65488468e-04 -1.16007192e-04 -1.75451425e-04] [-2.68726044e-05 2.98128377e-04 1.68257874e-04] [ 2.68726046e-05 -2.98128377e-04 1.68257872e-04] [ 4.61191179e-04 -3.00343817e-04 -9.44188513e-05] [-4.61191179e-04 3.00343817e-04 -9.44188523e-05] [ 2.00207570e-04 -3.62438640e-04 2.38950279e-04] [-2.00207570e-04 3.62438640e-04 2.38950280e-04] [-4.92085157e-04 -1.52698897e-04 1.03060601e-04] [ 4.92085158e-04 1.52698897e-04 1.03060601e-04] [ 1.99164678e-05 4.17190314e-05 -2.40888560e-04] [-1.99164663e-05 -4.17190353e-05 -2.40888562e-04] [ 2.71096382e-05 -1.29184957e-04 5.02997603e-04] [-2.71096407e-05 1.29184953e-04 5.02997606e-04] [ 1.95829791e-06 4.77642162e-04 3.20241366e-04] [-1.95829715e-06 -4.77642162e-04 3.20241366e-04] [-1.45022760e-04 2.60692036e-04 -3.88324926e-04] [ 1.45022759e-04 -2.60692036e-04 -3.88324926e-04] [-5.58482067e-05 5.89882661e-05 -4.92886647e-04] [ 5.58482086e-05 -5.89882683e-05 -4.92886646e-04] [-1.27800959e-04 -4.37045182e-04 2.53292822e-04] [ 1.27800956e-04 4.37045180e-04 2.53292819e-04] [-2.73018270e-04 4.38082331e-05 -1.24087485e-04] [ 2.73018268e-04 -4.38082330e-05 -1.24087484e-04] [ 1.83246586e-04 3.02122854e-04 -2.36945616e-04] [-1.83246584e-04 -3.02122853e-04 -2.36945617e-04] [-3.91554924e-04 9.35990668e-05 -2.04591752e-04] [ 3.91554925e-04 -9.35990684e-05 -2.04591752e-04] [ 2.36621652e-04 1.49103382e-04 1.60118422e-04] [-2.36621652e-04 -1.49103383e-04 1.60118422e-04] [-3.15216576e-04 2.49416235e-04 6.38959674e-05] [ 3.15216575e-04 -2.49416233e-04 6.38959677e-05] [ 4.90082787e-04 -3.05199271e-04 -2.06591900e-04] [-4.90082787e-04 3.05199271e-04 -2.06591899e-04] [-2.51858871e-04 -5.94273469e-04 -7.41110753e-04] [ 2.51858871e-04 5.94273469e-04 -7.41110752e-04] [ 1.54303495e-04 -1.28460291e-04 3.13861730e-04] [-1.54303495e-04 1.28460291e-04 3.13861730e-04] [-3.52580714e-04 -1.89882131e-04 -4.04548118e-04] [ 3.52580713e-04 1.89882131e-04 -4.04548116e-04] [-3.54323014e-04 1.81423197e-04 2.39744160e-04] [ 3.54323014e-04 -1.81423197e-04 2.39744158e-04] [-5.59440614e-04 -1.63709712e-04 3.11244083e-04] [ 5.59440614e-04 1.63709713e-04 3.11244083e-04] [ 3.42503142e-04 -3.60498209e-04 8.93365416e-05] [-3.42503142e-04 3.60498211e-04 8.93365428e-05] [-3.05122912e-04 -3.22499918e-04 5.62823379e-04] [ 3.05122913e-04 3.22499919e-04 5.62823378e-04] [ 1.30695839e-04 2.00209200e-04 1.98787222e-04] [-1.30695839e-04 -2.00209200e-04 1.98787222e-04] [-3.01612459e-04 -1.18056620e-04 1.87806449e-05] [ 3.01612459e-04 1.18056616e-04 1.87806420e-05] [-2.74916136e-04 -7.13346611e-04 -2.71297459e-05] [ 2.74916136e-04 7.13346611e-04 -2.71297445e-05] [-1.53957185e-05 -2.22617841e-04 -1.89523344e-04] [ 1.53957179e-05 2.22617842e-04 -1.89523344e-04] [ 4.93834904e-05 -2.96390394e-05 5.83672804e-05] [-4.93834903e-05 2.96390399e-05 5.83672806e-05] [ 1.83639790e-04 3.62671038e-04 -7.46690854e-05] [-1.83639790e-04 -3.62671040e-04 -7.46690852e-05] [ 3.94460396e-05 5.86828840e-04 -1.58165507e-04] [-3.94460397e-05 -5.86828840e-04 -1.58165506e-04] [ 5.17993732e-04 -2.61795520e-04 2.53632109e-04] [-5.17993732e-04 2.61795520e-04 2.53632108e-04] [ 2.67297687e-06 -2.52507602e-05 9.62025491e-05] [-2.67297623e-06 2.52507758e-05 9.62025483e-05] [-5.11353238e-05 -2.44898146e-04 2.94467952e-04] [ 5.11353246e-05 2.44898145e-04 2.94467952e-04] [ 4.28926961e-05 2.07513468e-04 -2.05613038e-04] [-4.28926961e-05 -2.07513469e-04 -2.05613037e-04] [ 3.84342839e-04 1.27921882e-04 -5.81984213e-05] [-3.84342838e-04 -1.27921880e-04 -5.81984273e-05] [-3.42808453e-04 4.69837766e-05 -2.02077467e-04] [ 3.42808453e-04 -4.69837739e-05 -2.02077461e-04]] Final stress: [-2.17976484e-05 -3.42025700e-05 -1.88661151e-05 3.30939735e-15 2.07240701e-15 8.14512981e-06] Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-2.78356028e-04 3.92455353e-04 -4.36637523e-04] [ 2.78356029e-04 -3.92455357e-04 -4.36637522e-04] [-1.23487314e-04 -5.03645682e-04 1.75321973e-04] [ 1.23487314e-04 5.03645681e-04 1.75321973e-04] [ 6.23878375e-04 9.92716020e-04 7.50520301e-05] [-6.23878374e-04 -9.92716020e-04 7.50520306e-05] [-2.25534104e-04 1.13226859e-04 -4.13748883e-04] [ 2.25534105e-04 -1.13226860e-04 -4.13748883e-04] [ 5.66630808e-04 4.39477084e-04 7.70245285e-04] [-5.66630808e-04 -4.39477084e-04 7.70245286e-04] [-4.61262453e-04 -3.10906633e-04 2.23280495e-04] [ 4.61262453e-04 3.10906633e-04 2.23280494e-04] [-5.13991108e-04 -4.17816049e-04 2.67767417e-04] [ 5.13991109e-04 4.17816051e-04 2.67767419e-04] [-1.86428397e-03 2.05823511e-04 1.03703474e-03] [ 1.86428397e-03 -2.05823509e-04 1.03703474e-03] [ 6.13596260e-04 -5.22436056e-05 2.60673200e-04] [-6.13596259e-04 5.22436057e-05 2.60673200e-04] [ 6.93200856e-04 3.82227745e-04 -9.65911523e-05] [-6.93200855e-04 -3.82227745e-04 -9.65911527e-05] [ 2.84072784e-04 -3.06451778e-04 -3.37096950e-04] [-2.84072784e-04 3.06451778e-04 -3.37096950e-04] [-7.58174865e-04 -8.14526027e-04 1.13922666e-04] [ 7.58174865e-04 8.14526025e-04 1.13922667e-04] [-1.04426332e-05 -3.04798043e-04 1.12885976e-04] [ 1.04426339e-05 3.04798043e-04 1.12885975e-04] [ 3.77970056e-04 2.43793950e-04 -6.33658531e-04] [-3.77970056e-04 -2.43793950e-04 -6.33658532e-04] [ 3.32198210e-04 1.22293776e-03 -1.77029368e-03] [-3.32198210e-04 -1.22293776e-03 -1.77029368e-03] [ 4.94611749e-04 -1.13374910e-03 3.81661293e-04] [-4.94611748e-04 1.13374910e-03 3.81661294e-04] [ 6.55387361e-04 2.61203625e-04 -1.76990493e-04] [-6.55387362e-04 -2.61203623e-04 -1.76990493e-04] [ 5.68891708e-04 3.17200022e-04 -5.62046535e-04] [-5.68891708e-04 -3.17200022e-04 -5.62046535e-04] [-3.86558546e-06 -4.61117334e-04 -4.94982132e-04] [ 3.86558552e-06 4.61117335e-04 -4.94982132e-04] [-2.89756029e-04 7.28394290e-04 -5.95187819e-04] [ 2.89756030e-04 -7.28394290e-04 -5.95187819e-04] [-1.35657256e-04 -9.57370118e-05 2.62029712e-04] [ 1.35657254e-04 9.57370112e-05 2.62029714e-04] [ 1.10559357e-04 -7.39888053e-05 7.75931147e-04] [-1.10559358e-04 7.39888035e-05 7.75931146e-04] [-2.53910164e-04 -1.30129013e-03 6.12403760e-04] [ 2.53910164e-04 1.30129013e-03 6.12403760e-04] [-4.25283575e-04 -5.51392749e-04 -1.03583164e-03] [ 4.25283577e-04 5.51392748e-04 -1.03583164e-03] [ 6.57713607e-05 -7.27927954e-04 8.05870477e-04] [-6.57713626e-05 7.27927954e-04 8.05870473e-04] [ 5.30721475e-04 2.80392197e-04 9.41543417e-04] [-5.30721475e-04 -2.80392197e-04 9.41543417e-04] [-7.28797004e-04 3.07057940e-04 -9.64944429e-05] [ 7.28797004e-04 -3.07057939e-04 -9.64944423e-05] [ 6.55775217e-05 4.54370157e-04 1.03618008e-03] [-6.55775249e-05 -4.54370159e-04 1.03618008e-03] [-2.78661697e-04 -8.92359463e-04 2.77115827e-04] [ 2.78661697e-04 8.92359461e-04 2.77115828e-04] [ 5.21930641e-04 -1.26605792e-03 -1.17582477e-03] [-5.21930643e-04 1.26605792e-03 -1.17582477e-03] [-7.24277943e-04 2.12142264e-05 -3.63399734e-04] [ 7.24277944e-04 -2.12142267e-05 -3.63399734e-04] [-1.04572819e-03 3.09576017e-05 -6.58290192e-04] [ 1.04572819e-03 -3.09576019e-05 -6.58290193e-04] [ 2.41328504e-04 3.55553261e-04 5.95265267e-04] [-2.41328504e-04 -3.55553263e-04 5.95265268e-04] [ 1.72566146e-03 -9.98549614e-04 1.18898567e-03] [-1.72566146e-03 9.98549613e-04 1.18898567e-03] [-7.07589996e-04 4.02744701e-04 -1.83719903e-04] [ 7.07589998e-04 -4.02744700e-04 -1.83719904e-04] [ 3.98611610e-04 -1.95963392e-03 6.88454623e-04] [-3.98611611e-04 1.95963392e-03 6.88454622e-04] [-1.92628648e-04 -8.22430164e-04 -1.53874200e-03] [ 1.92628647e-04 8.22430163e-04 -1.53874200e-03] [ 1.31062039e-03 4.75361742e-05 7.40237632e-04] [-1.31062039e-03 -4.75361745e-05 7.40237631e-04] [ 2.86418438e-04 -4.33804190e-04 -2.19783240e-04] [-2.86418437e-04 4.33804189e-04 -2.19783240e-04] [ 1.35638480e-03 3.07263005e-05 -1.66741345e-04] [-1.35638480e-03 -3.07263002e-05 -1.66741346e-04] [ 1.66343138e-03 2.04569166e-06 -1.32929971e-04] [-1.66343138e-03 -2.04569275e-06 -1.32929971e-04] [-3.49356658e-04 -5.84778031e-04 -6.00186296e-04] [ 3.49356658e-04 5.84778031e-04 -6.00186296e-04] [ 7.01705211e-04 -8.48543610e-05 7.13429949e-04] [-7.01705210e-04 8.48543637e-05 7.13429950e-04] [-3.22135690e-04 -3.79770629e-04 -6.66357565e-04] [ 3.22135689e-04 3.79770631e-04 -6.66357566e-04] [-1.65868352e-03 1.71440710e-04 -4.29297865e-04] [ 1.65868352e-03 -1.71440710e-04 -4.29297863e-04] [ 6.17525612e-04 -2.05508063e-04 2.52891582e-06] [-6.17525612e-04 2.05508063e-04 2.52891676e-06] [ 5.16752193e-04 1.86375890e-04 2.40727680e-04] [-5.16752192e-04 -1.86375890e-04 2.40727681e-04] [-1.23468255e-03 3.87324039e-05 1.26645538e-04] [ 1.23468255e-03 -3.87324023e-05 1.26645538e-04] [ 6.13881092e-04 1.15573661e-03 4.54049302e-05] [-6.13881093e-04 -1.15573661e-03 4.54049310e-05] [-3.14995383e-04 1.18152273e-03 -2.71525240e-04] [ 3.14995383e-04 -1.18152272e-03 -2.71525241e-04] [-3.28866749e-04 3.55826739e-04 5.85758197e-04] [ 3.28866750e-04 -3.55826739e-04 5.85758197e-04]] Final stress: [ 1.74791898e-05 6.72343824e-06 8.18490154e-05 -1.11141173e-16 -2.54071113e-15 -5.56338927e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 7.24058363e-04 4.74936189e-03 -2.05659822e-03] [-7.24058359e-04 -4.74936190e-03 -2.05659822e-03] [ 6.14967372e-04 -1.72815757e-03 2.40272080e-04] [-6.14967373e-04 1.72815758e-03 2.40272071e-04] [-1.85741560e-03 3.29344428e-03 -4.28314318e-04] [ 1.85741559e-03 -3.29344428e-03 -4.28314319e-04] [ 1.15601125e-04 4.09501632e-03 -5.32961090e-03] [-1.15601123e-04 -4.09501631e-03 -5.32961089e-03] [-2.99124317e-03 2.20480600e-03 3.77297489e-03] [ 2.99124317e-03 -2.20480601e-03 3.77297489e-03] [ 1.89144858e-03 -1.51299415e-03 1.34329680e-03] [-1.89144858e-03 1.51299416e-03 1.34329680e-03] [ 1.07395225e-03 -1.49067704e-03 -6.42342935e-04] [-1.07395225e-03 1.49067704e-03 -6.42342940e-04] [ 5.87776825e-03 -1.83508825e-03 2.45730002e-03] [-5.87776826e-03 1.83508825e-03 2.45730002e-03] [-1.75511056e-03 -1.50748587e-04 4.33140286e-04] [ 1.75511056e-03 1.50748589e-04 4.33140286e-04] [-1.22835548e-03 1.56696811e-03 7.34265113e-04] [ 1.22835548e-03 -1.56696811e-03 7.34265120e-04] [ 3.73813291e-04 -1.65596276e-03 -2.93202774e-03] [-3.73813292e-04 1.65596277e-03 -2.93202774e-03] [ 2.13418155e-03 -1.06660820e-03 2.04202234e-03] [-2.13418156e-03 1.06660816e-03 2.04202235e-03] [ 9.31286489e-04 -5.51676439e-03 6.63824832e-03] [-9.31286484e-04 5.51676440e-03 6.63824834e-03] [-1.37053890e-03 2.54446563e-03 6.10934857e-05] [ 1.37053890e-03 -2.54446563e-03 6.10934969e-05] [-1.33505748e-03 3.98146800e-03 -6.02583474e-03] [ 1.33505748e-03 -3.98146800e-03 -6.02583474e-03] [-1.46474133e-03 -3.98133192e-03 1.95997031e-03] [ 1.46474134e-03 3.98133191e-03 1.95997030e-03] [-2.39188558e-03 -5.39270304e-04 -1.08266742e-03] [ 2.39188558e-03 5.39270307e-04 -1.08266742e-03] [ 5.36537236e-04 1.04481029e-03 -1.63967737e-03] [-5.36537239e-04 -1.04481029e-03 -1.63967737e-03] [ 1.45456156e-03 7.08698151e-05 -2.51477312e-03] [-1.45456156e-03 -7.08698163e-05 -2.51477312e-03] [ 3.18069583e-04 6.88096447e-04 -3.48834644e-04] [-3.18069574e-04 -6.88096457e-04 -3.48834647e-04] [-3.29627615e-03 -3.27386221e-03 -2.49865804e-03] [ 3.29627615e-03 3.27386220e-03 -2.49865803e-03] [-1.58502356e-04 4.28155553e-03 1.93751425e-03] [ 1.58502352e-04 -4.28155553e-03 1.93751424e-03] [-3.74519337e-04 8.64058418e-04 3.66424673e-03] [ 3.74519338e-04 -8.64058417e-04 3.66424673e-03] [ 4.28748103e-04 2.57667582e-03 2.94477091e-03] [-4.28748100e-04 -2.57667582e-03 2.94477092e-03] [-9.70015517e-04 8.14397809e-04 -1.87818574e-03] [ 9.70015513e-04 -8.14397816e-04 -1.87818574e-03] [-2.56800283e-03 2.89649831e-04 7.56069851e-04] [ 2.56800283e-03 -2.89649834e-04 7.56069857e-04] [ 2.15848047e-03 -5.86893270e-04 3.08662468e-03] [-2.15848046e-03 5.86893270e-04 3.08662468e-03] [-1.78390160e-03 3.83731276e-03 1.53587320e-03] [ 1.78390160e-03 -3.83731276e-03 1.53587319e-03] [ 4.52341773e-03 -4.08462855e-03 5.04664474e-03] [-4.52341773e-03 4.08462856e-03 5.04664474e-03] [-2.72776009e-03 7.57740654e-04 -1.78660779e-03] [ 2.72776009e-03 -7.57740655e-04 -1.78660779e-03] [ 2.52494164e-03 4.53888965e-03 -3.18425353e-03] [-2.52494164e-03 -4.53888964e-03 -3.18425353e-03] [-1.27220207e-03 -1.29513600e-03 1.76625126e-03] [ 1.27220207e-03 1.29513600e-03 1.76625126e-03] [-2.55839552e-03 -3.94430535e-04 -2.14043447e-03] [ 2.55839552e-03 3.94430531e-04 -2.14043447e-03] [-3.72222335e-03 1.90160351e-04 8.70014292e-05] [ 3.72222335e-03 -1.90160352e-04 8.70014330e-05] [ 7.96806395e-03 3.36282885e-03 4.68966466e-03] [-7.96806395e-03 -3.36282885e-03 4.68966466e-03] [ 3.64599957e-03 -1.12659980e-04 -6.05997669e-03] [-3.64599957e-03 1.12659982e-04 -6.05997669e-03] [-1.59843662e-04 6.13461661e-03 2.02180773e-03] [ 1.59843662e-04 -6.13461660e-03 2.02180773e-03] [ 2.58952282e-03 1.03131613e-03 -2.23609752e-03] [-2.58952282e-03 -1.03131613e-03 -2.23609752e-03] [ 3.16588328e-03 9.24146693e-04 1.26026591e-03] [-3.16588328e-03 -9.24146696e-04 1.26026591e-03] [-4.97167749e-03 2.09384864e-03 -1.52202285e-03] [ 4.97167750e-03 -2.09384864e-03 -1.52202285e-03] [-5.36514551e-03 1.64269126e-04 4.68640745e-04] [ 5.36514550e-03 -1.64269125e-04 4.68640748e-04] [ 1.73241482e-03 -2.53725355e-03 -1.02122273e-03] [-1.73241483e-03 2.53725356e-03 -1.02122274e-03] [-9.94463163e-04 -1.78342953e-03 2.96527676e-03] [ 9.94463165e-04 1.78342953e-03 2.96527676e-03] [ 3.19933381e-03 -5.09251400e-03 -3.57624185e-03] [-3.19933381e-03 5.09251400e-03 -3.57624185e-03] [ 5.58461051e-03 4.40183111e-04 -2.45563850e-03] [-5.58461051e-03 -4.40183108e-04 -2.45563851e-03] [-2.84091074e-03 9.86707735e-06 -1.10765084e-03] [ 2.84091074e-03 -9.86707436e-06 -1.10765084e-03] [-3.89045604e-03 -2.92753798e-05 1.79219713e-03] [ 3.89045604e-03 2.92754119e-05 1.79219712e-03] [ 3.70975122e-03 -4.94412782e-03 2.19473135e-03] [-3.70975122e-03 4.94412783e-03 2.19473134e-03] [-2.82053642e-03 2.84300658e-05 2.25653200e-03] [ 2.82053642e-03 -2.84300660e-05 2.25653201e-03] [-1.69207081e-04 -7.42850583e-04 -1.26085130e-03] [ 1.69207080e-04 7.42850587e-04 -1.26085132e-03] [ 1.03458377e-03 -4.68883309e-03 -4.42817372e-03] [-1.03458378e-03 4.68883309e-03 -4.42817371e-03]] Final stress: [ 1.07047553e-06 6.00538397e-06 1.84378246e-04 6.45933379e-15 -9.15420848e-15 2.07207526e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-8.49567514e-04 -1.07190419e-03 1.30075677e-03] [ 8.49567515e-04 1.07190409e-03 1.30075678e-03] [-6.00251811e-04 2.34135446e-03 -1.60376263e-03] [ 6.00251811e-04 -2.34135446e-03 -1.60376264e-03] [ 3.87893602e-04 -2.35104211e-03 9.99670758e-04] [-3.87893602e-04 2.35104212e-03 9.99670754e-04] [-8.59100606e-04 2.99506947e-03 -2.71657720e-03] [ 8.59100604e-04 -2.99506951e-03 -2.71657724e-03] [ 6.51997906e-04 1.89576105e-04 -1.18083063e-04] [-6.51997906e-04 -1.89576097e-04 -1.18083063e-04] [-8.50933133e-04 7.31363379e-04 -1.15439976e-03] [ 8.50933133e-04 -7.31363367e-04 -1.15439975e-03] [-2.33781636e-04 1.37616270e-03 2.68154513e-04] [ 2.33781638e-04 -1.37616270e-03 2.68154546e-04] [-3.44370623e-03 -1.27432667e-03 2.09469872e-04] [ 3.44370623e-03 1.27432672e-03 2.09469869e-04] [ 1.78101572e-03 -1.11098531e-03 5.41946009e-04] [-1.78101572e-03 1.11098532e-03 5.41946018e-04] [ 1.61365255e-03 -1.09596166e-03 1.85613428e-04] [-1.61365255e-03 1.09596166e-03 1.85613449e-04] [ 1.00456882e-03 1.50343240e-04 -3.69744153e-05] [-1.00456882e-03 -1.50343232e-04 -3.69744075e-05] [-1.54339137e-03 5.99003857e-05 -1.46805598e-03] [ 1.54339137e-03 -5.99004062e-05 -1.46805598e-03] [ 1.74150410e-03 -8.56642232e-05 -3.02383886e-04] [-1.74150409e-03 8.56641614e-05 -3.02383962e-04] [ 8.63493116e-04 1.69525059e-03 -1.97252388e-03] [-8.63493117e-04 -1.69525057e-03 -1.97252392e-03] [ 2.26883721e-04 -2.68358173e-03 3.21255448e-03] [-2.26883723e-04 2.68358173e-03 3.21255448e-03] [ 1.57126446e-04 2.82893402e-03 -9.51539431e-04] [-1.57126445e-04 -2.82893402e-03 -9.51539421e-04] [ 2.03519175e-03 -1.67053279e-03 1.97266851e-03] [-2.03519175e-03 1.67053280e-03 1.97266850e-03] [-4.65272027e-04 -1.41890787e-03 6.94595224e-04] [ 4.65272027e-04 1.41890787e-03 6.94595208e-04] [-3.20000120e-03 -9.42511819e-04 5.26660239e-04] [ 3.20000119e-03 9.42511825e-04 5.26660250e-04] [-7.36744486e-04 -5.00489319e-04 -6.93941326e-04] [ 7.36744483e-04 5.00489317e-04 -6.93941325e-04] [ 1.29275043e-03 7.67056612e-04 7.42194531e-04] [-1.29275043e-03 -7.67056612e-04 7.42194525e-04] [ 4.17236232e-05 -2.59270141e-03 -4.38338774e-04] [-4.17236207e-05 2.59270141e-03 -4.38338769e-04] [-1.33869037e-03 -4.98677074e-04 -1.92231760e-03] [ 1.33869037e-03 4.98677076e-04 -1.92231761e-03] [ 8.65641519e-04 -1.62710680e-03 -3.24259785e-03] [-8.65641524e-04 1.62710679e-03 -3.24259784e-03] [ 1.02294079e-03 -7.77902287e-04 2.86067439e-03] [-1.02294078e-03 7.77902269e-04 2.86067438e-03] [ 3.20948495e-05 3.96845390e-04 9.03151261e-04] [-3.20948445e-05 -3.96845382e-04 9.03151247e-04] [-2.26356199e-03 7.06409114e-04 -1.61115975e-03] [ 2.26356198e-03 -7.06409107e-04 -1.61115974e-03] [-1.23388744e-03 -7.05746931e-04 1.71337511e-04] [ 1.23388741e-03 7.05746893e-04 1.71337529e-04] [-1.81735729e-03 -2.18436461e-04 -1.19105879e-03] [ 1.81735732e-03 2.18436423e-04 -1.19105880e-03] [ 8.50447917e-04 -5.59422764e-04 8.11923585e-04] [-8.50447920e-04 5.59422764e-04 8.11923593e-04] [-1.28972427e-03 -2.74648101e-03 2.91191474e-03] [ 1.28972427e-03 2.74648101e-03 2.91191474e-03] [ 2.55169309e-03 -3.43776591e-04 -1.53385668e-03] [-2.55169309e-03 3.43776579e-04 -1.53385669e-03] [ 1.17530699e-03 3.53379071e-04 2.86377729e-03] [-1.17530700e-03 -3.53379084e-04 2.86377730e-03] [ 4.85071869e-04 1.29039204e-03 5.55593677e-05] [-4.85071863e-04 -1.29039204e-03 5.55593387e-05] [-3.08756761e-03 -2.96490598e-03 -7.29146018e-04] [ 3.08756760e-03 2.96490598e-03 -7.29145993e-04] [ 1.66502767e-05 -3.44745107e-03 2.55386751e-03] [-1.66502553e-05 3.44745103e-03 2.55386752e-03] [-2.68721295e-03 -5.84784508e-03 -3.20794061e-03] [ 2.68721293e-03 5.84784505e-03 -3.20794062e-03] [-3.06610162e-04 -2.13080554e-03 -1.73126752e-03] [ 3.06610148e-04 2.13080554e-03 -1.73126755e-03] [-3.26755054e-03 5.86263981e-04 -3.03036149e-03] [ 3.26755055e-03 -5.86263982e-04 -3.03036146e-03] [ 2.90867150e-03 3.64163071e-04 -4.34229201e-04] [-2.90867150e-03 -3.64163028e-04 -4.34229163e-04] [ 1.99687862e-03 -6.53998898e-04 3.73360493e-04] [-1.99687862e-03 6.53998900e-04 3.73360492e-04] [-7.84341061e-04 1.45573004e-03 1.24845901e-03] [ 7.84341062e-04 -1.45573005e-03 1.24845901e-03] [ 1.32365573e-03 -1.49798366e-03 8.49901762e-05] [-1.32365573e-03 1.49798369e-03 8.49902111e-05] [-1.25611754e-03 5.72646977e-04 9.30769643e-04] [ 1.25611754e-03 -5.72646901e-04 9.30769633e-04] [-1.24361565e-03 -3.22353890e-04 7.64437575e-04] [ 1.24361565e-03 3.22353896e-04 7.64437577e-04] [ 1.87868865e-03 7.09180731e-04 7.44119443e-04] [-1.87868865e-03 -7.09180738e-04 7.44119446e-04] [-9.57855524e-04 -1.55759042e-05 -1.60893657e-04] [ 9.57855520e-04 1.55759235e-05 -1.60893658e-04] [-1.13242469e-03 1.12503206e-03 1.15890170e-03] [ 1.13242467e-03 -1.12503203e-03 1.15890170e-03] [ 3.23005124e-03 -3.31290714e-04 -1.45707755e-04] [-3.23005123e-03 3.31290743e-04 -1.45707762e-04] [ 1.10802938e-03 1.16702785e-03 9.95277214e-05] [-1.10802937e-03 -1.16702783e-03 9.95277608e-05] [ 1.78601944e-03 1.60428031e-03 1.20606152e-03] [-1.78601946e-03 -1.60428029e-03 1.20606148e-03]] Final stress: [-3.76614442e-05 8.29276423e-06 -1.28040821e-04 -1.16265140e-14 -3.26039580e-15 -1.15900044e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.18877202e-04 -2.14032213e-05 2.53220383e-04] [-2.18877202e-04 2.14032352e-05 2.53220381e-04] [ 9.77485582e-05 4.55938248e-04 -2.21576030e-04] [-9.77485575e-05 -4.55938248e-04 -2.21576029e-04] [-2.06172398e-04 -4.70700987e-04 1.12321503e-04] [ 2.06172398e-04 4.70700987e-04 1.12321503e-04] [ 9.41681678e-05 2.08238815e-04 -9.08071556e-05] [-9.41681680e-05 -2.08238813e-04 -9.08071537e-05] [-1.35137408e-04 -1.80046641e-04 -2.28327032e-04] [ 1.35137408e-04 1.80046640e-04 -2.28327033e-04] [ 1.39662709e-04 1.44357368e-04 -1.99937085e-04] [-1.39662710e-04 -1.44357369e-04 -1.99937087e-04] [ 1.88432894e-04 2.45648041e-04 -3.04075019e-05] [-1.88432894e-04 -2.45648040e-04 -3.04075024e-05] [ 7.68856290e-04 -1.22773803e-04 -1.24968232e-04] [-7.68856290e-04 1.22773800e-04 -1.24968233e-04] [-3.43579215e-04 -8.38942920e-05 -4.24405865e-05] [ 3.43579216e-04 8.38942914e-05 -4.24405870e-05] [-2.49900520e-04 -1.83928489e-04 -4.23632927e-05] [ 2.49900520e-04 1.83928490e-04 -4.23632923e-05] [-8.83620798e-05 2.06258434e-05 -1.12193895e-04] [ 8.83620797e-05 -2.06258444e-05 -1.12193894e-04] [ 3.80105067e-04 2.35852496e-04 -1.28589872e-04] [-3.80105067e-04 -2.35852491e-04 -1.28589874e-04] [-2.38549183e-05 -1.99897060e-04 5.02229710e-04] [ 2.38549182e-05 1.99897058e-04 5.02229710e-04] [-2.17790822e-04 -1.25474290e-04 -5.54003722e-05] [ 2.17790821e-04 1.25474289e-04 -5.54003716e-05] [-6.80467883e-05 -5.07568927e-04 6.92492599e-04] [ 6.80467883e-05 5.07568927e-04 6.92492599e-04] [-3.15610456e-04 5.34595839e-04 -8.73621035e-05] [ 3.15610456e-04 -5.34595839e-04 -8.73621032e-05] [-3.86081827e-04 -2.55357693e-04 2.37636378e-04] [ 3.86081827e-04 2.55357692e-04 2.37636380e-04] [-4.60381238e-04 -2.06816985e-05 1.45547862e-04] [ 4.60381236e-04 2.06816984e-05 1.45547862e-04] [-5.74605683e-05 2.67673838e-04 1.31818259e-04] [ 5.74605695e-05 -2.67673838e-04 1.31818259e-04] [ 2.91715019e-04 -3.20180625e-04 3.18859498e-04] [-2.91715019e-04 3.20180625e-04 3.18859499e-04] [ 1.99130789e-05 1.45113179e-04 -1.48358722e-04] [-1.99130780e-05 -1.45113178e-04 -1.48358722e-04] [-9.81102007e-05 9.47969634e-05 -3.22551703e-04] [ 9.81102003e-05 -9.47969645e-05 -3.22551704e-04] [-7.02506381e-06 4.82163676e-04 -1.84464143e-04] [ 7.02506423e-06 -4.82163677e-04 -1.84464143e-04] [ 4.37782974e-04 1.55074218e-04 5.92219718e-04] [-4.37782973e-04 -1.55074216e-04 5.92219714e-04] [-1.13869914e-05 3.38125581e-04 -5.07704726e-04] [ 1.13869907e-05 -3.38125579e-04 -5.07704724e-04] [-3.26813425e-04 -2.36616669e-04 -3.80305128e-04] [ 3.26813424e-04 2.36616668e-04 -3.80305128e-04] [ 1.58688996e-04 -1.12770691e-04 1.19968490e-04] [-1.58688995e-04 1.12770690e-04 1.19968489e-04] [-1.15459237e-04 -2.55371359e-04 -3.35354149e-04] [ 1.15459238e-04 2.55371361e-04 -3.35354149e-04] [-1.74825333e-04 3.78652031e-04 -1.44868773e-04] [ 1.74825332e-04 -3.78652030e-04 -1.44868773e-04] [-1.85785178e-04 4.45746421e-04 5.16661241e-04] [ 1.85785178e-04 -4.45746421e-04 5.16661241e-04] [ 2.57873316e-04 7.66015553e-05 2.11293543e-04] [-2.57873317e-04 -7.66015558e-05 2.11293543e-04] [ 5.55235760e-04 1.13901848e-04 2.18421022e-04] [-5.55235758e-04 -1.13901845e-04 2.18421025e-04] [-6.91459556e-05 -6.54208086e-05 -2.21404492e-04] [ 6.91459542e-05 6.54208104e-05 -2.21404493e-04] [-6.56648534e-04 5.13044281e-04 -2.30348242e-04] [ 6.56648534e-04 -5.13044282e-04 -2.30348242e-04] [ 3.66821611e-04 -1.66716966e-04 9.58995820e-05] [-3.66821610e-04 1.66716966e-04 9.58995813e-05] [-2.79871708e-04 8.98876361e-04 -3.93485264e-04] [ 2.79871707e-04 -8.98876359e-04 -3.93485265e-04] [-1.26279084e-04 3.90739316e-04 6.38790477e-04] [ 1.26279084e-04 -3.90739315e-04 6.38790478e-04] [-5.25958371e-04 -2.96935307e-05 -4.57476060e-04] [ 5.25958371e-04 2.96935306e-05 -4.57476059e-04] [-9.83065705e-05 2.19260095e-04 -1.10234127e-04] [ 9.83065697e-05 -2.19260096e-04 -1.10234128e-04] [-6.01736152e-04 2.19833476e-04 -1.76085407e-04] [ 6.01736153e-04 -2.19833476e-04 -1.76085407e-04] [-4.89972962e-04 -1.17235939e-05 8.84717912e-05] [ 4.89972961e-04 1.17235939e-05 8.84717898e-05] [ 1.70001689e-04 3.44452988e-04 2.66858845e-04] [-1.70001689e-04 -3.44452988e-04 2.66858844e-04] [-3.64660727e-04 -4.20628349e-05 -1.41400155e-04] [ 3.64660726e-04 4.20628334e-05 -1.41400157e-04] [-1.80164192e-04 -1.10691421e-04 2.21593446e-04] [ 1.80164191e-04 1.10691409e-04 2.21593446e-04] [ 5.42695811e-04 -3.08832838e-05 2.11481569e-04] [-5.42695810e-04 3.08832842e-05 2.11481569e-04] [-3.19783636e-04 1.00100477e-04 8.86755147e-05] [ 3.19783636e-04 -1.00100477e-04 8.86755144e-05] [-2.19584001e-04 2.19109338e-04 -8.61946149e-05] [ 2.19584001e-04 -2.19109344e-04 -8.61946144e-05] [ 5.92636887e-04 2.71584530e-05 -1.09676300e-04] [-5.92636885e-04 -2.71584555e-05 -1.09676300e-04] [-2.34318394e-04 -4.34017999e-04 -5.20973028e-05] [ 2.34318393e-04 4.34017996e-04 -5.20973036e-05] [ 2.41869059e-04 -4.85217069e-04 5.75042506e-05] [-2.41869059e-04 4.85217068e-04 5.75042519e-05] [ 3.48414457e-04 -9.69558685e-05 -3.55583210e-04] [-3.48414455e-04 9.69558673e-05 -3.55583210e-04]] Final stress: [-2.05664660e-05 -1.59196869e-05 -5.37396648e-05 -1.32901764e-15 -1.42463042e-15 2.24881414e-05] Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 35 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 138 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-1.87958213e-03 1.55916284e-02 4.57278844e-03] [ 1.36200691e-03 -1.04674759e-02 -1.89404318e-03] [-3.34678464e-03 -6.27019102e-03 -1.87670947e-03] [ 3.69604535e-03 -6.83391513e-03 -2.11191020e-03] [-3.37661325e-03 -5.38811712e-03 -6.70902632e-03] [ 4.23748508e-03 -2.21060874e-03 5.14780832e-03] [ 1.32831371e-03 4.76207295e-03 -8.18248453e-04] [-1.17960570e-03 4.96009321e-03 4.34267195e-03] [-2.00834851e-03 4.27197824e-03 6.66397643e-03] [ 1.99284203e-03 4.05194922e-03 -8.72696735e-03] [-3.78825755e-03 -2.01943698e-04 1.15972504e-03] [ 3.80043328e-03 -5.35250530e-04 1.12190211e-04] [ 4.71688501e-03 -1.20978844e-03 4.54859945e-03] [-4.72716215e-03 8.81283502e-04 -5.07558262e-03] [ 1.14547407e-02 -1.07397748e-02 -4.15891042e-03] [-1.15166906e-02 -1.14348670e-03 6.85984183e-03] [-2.69972511e-03 -3.34893276e-03 3.25849376e-03] [ 2.11796357e-03 -3.17373541e-03 -5.07081238e-03] [ 1.51805178e-04 9.63497968e-04 1.36049034e-03] [-2.32931475e-04 -1.35150781e-03 -2.08864546e-04] [-4.05892760e-03 -8.41121624e-03 -4.39496747e-03] [ 4.23414522e-03 -8.36599280e-03 3.43016322e-03] [ 3.85598214e-03 -3.06624313e-03 -2.41117789e-03] [-3.69538789e-03 -1.34487166e-03 3.12052550e-03] [ 2.84817089e-03 1.77277269e-03 -6.96854797e-03] [-2.82057467e-03 4.77891969e-03 7.90950662e-03] [-1.38145168e-03 5.01970125e-03 9.33117364e-05] [ 1.44603038e-03 2.08982911e-03 -2.19559879e-03] [-2.21302857e-03 9.09218666e-03 1.33976930e-02] [ 9.74516997e-04 7.69155796e-03 -9.42351181e-03] [-5.65776135e-03 -5.67026066e-03 1.27449279e-03] [ 5.48206132e-03 -4.56881461e-03 -3.79619927e-03] [ 5.28320848e-03 -3.33369456e-03 -2.72348087e-03] [-5.40298289e-03 3.23516124e-03 9.69587144e-04] [ 3.77974610e-03 2.76044485e-04 2.23558860e-03] [ 2.38678143e-03 8.67510042e-03 -6.37276330e-04] [-1.07826665e-02 3.68799601e-03 -3.64465269e-04] [ 1.94611078e-03 6.95448554e-03 2.62505295e-03] [-3.00222857e-03 2.79175610e-03 3.33942957e-03] [ 3.42687325e-03 6.45826052e-03 -5.95359675e-04] [ 4.12626375e-03 3.14723848e-03 -3.25673299e-03] [-4.18399613e-03 6.62075764e-03 1.51356205e-04] [ 5.26102160e-03 2.63970440e-03 1.11899454e-02] [ 1.06690003e-03 3.46090437e-03 5.39193053e-03] [-4.99299205e-03 6.96426085e-03 -8.00347621e-03] [-6.46322315e-04 -8.27521663e-04 -2.24062320e-03] [ 7.09258854e-03 -3.90428481e-04 7.31987755e-05] [ 1.55941773e-03 -4.65342173e-03 4.20813191e-03] [-2.92870312e-03 -4.20010110e-03 5.00997146e-03] [-4.92485733e-03 -8.57903234e-04 7.86579789e-04] [ 4.14366596e-04 -1.82798784e-03 1.00784989e-03] [ 9.54978189e-03 1.95429791e-03 -3.80868082e-03] [-3.14146045e-03 -2.69213475e-03 -2.43217573e-03] [-5.21956789e-03 3.27704219e-03 3.26100485e-03] [-1.21148888e-03 7.00042619e-03 2.45504258e-03] [ 2.29077303e-03 6.72986287e-03 2.93103952e-04] [-4.22826839e-04 9.67259162e-03 -2.94637235e-03] [-1.89057892e-03 3.85844463e-03 -8.44863613e-04] [ 4.41397905e-04 -3.72003897e-03 3.12445621e-03] [ 1.15051532e-02 -1.87426648e-03 3.35913522e-03] [ 3.28244244e-04 -6.04843926e-03 -3.69499086e-03] [-1.20643012e-02 3.57691327e-04 -4.30002208e-03] [ 4.66928552e-03 -6.18812060e-03 -3.23404308e-03] [-9.48346850e-03 -1.12003689e-03 -7.41739550e-03] [-2.04726383e-03 -1.07337915e-02 -2.92128328e-03] [ 6.88198863e-03 3.71186455e-03 1.26661825e-03] [-8.56482263e-03 -2.89025380e-03 -9.11694161e-04] [ 3.61141170e-03 2.77890006e-03 -5.32574301e-03] [ 8.79240857e-03 -2.66426475e-03 1.06823620e-03] [-3.43167386e-03 2.93780311e-03 5.55780375e-03] [-6.46688744e-03 4.80423019e-04 4.91019301e-03] [ 3.05279370e-03 3.01767424e-03 2.41802299e-03] [ 6.73191425e-03 -1.17431411e-03 -4.62207136e-03] [-2.33725602e-03 6.13156955e-03 -2.41581493e-03] [-1.86071459e-04 -5.96442106e-04 -1.23158564e-03] [ 2.92864511e-03 3.22878024e-03 4.71649626e-03] [-9.76455406e-04 -5.29990471e-04 1.51839490e-03] [-1.91923368e-03 2.97857514e-03 -4.55085914e-03] [-6.37746796e-03 -3.14988910e-03 9.57751240e-03] [ 6.77637891e-03 -2.24987719e-03 -5.07001986e-03] [-5.63722432e-03 4.38195211e-03 5.13408887e-03] [ 6.05618318e-03 1.96954147e-03 -3.95724442e-03] [-1.47803109e-03 -3.49654394e-03 -1.94881838e-03] [ 1.43823485e-03 -2.92329971e-03 1.31326753e-03] [-2.64735143e-03 -1.92142575e-03 6.05158350e-04] [ 2.48688204e-03 -5.78353721e-03 -6.81194755e-03] [ 2.52227537e-03 -1.53520843e-02 6.73263824e-04] [-3.72165857e-03 1.43112508e-02 -4.83872722e-03] [ 6.40744259e-03 -8.08933146e-03 -5.60019670e-03] [-6.08509265e-03 -5.66921439e-03 4.48766202e-03] [ 4.90200948e-03 6.09991800e-03 3.25091096e-03] [-4.52445850e-03 3.93666346e-03 -3.06909637e-03] [-4.19519215e-03 -6.09620526e-04 -6.17024305e-03] [ 3.33914437e-03 -6.21934260e-03 7.99901235e-03] [ 4.06663150e-03 -4.36088989e-04 7.79329399e-03] [-6.38233292e-04 5.30303070e-03 -2.08903773e-04] [-3.20267092e-03 -8.15825896e-05 -8.99644056e-03] [ 9.42361746e-05 4.86192434e-03 -1.80163642e-03] [ 7.36587112e-04 -7.38577484e-03 3.88307410e-03] [-1.86967252e-03 -4.42497756e-03 3.33270682e-03] [-1.33703353e-03 -4.96802258e-03 -2.39506721e-03] [ 2.87251621e-03 -6.43347634e-03 -1.05093046e-03]] Final stress: [-6.97034178e-05 6.23554509e-05 -4.87874088e-05 3.70005508e-05 -1.00627747e-06 1.76325167e-04] Minimization converged after 141 steps. Minimization converged after 142 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 4.27584677e-03 -1.89772275e-03 -6.39343041e-04] [ 2.90044417e-03 1.30353798e-03 -9.08004066e-04] [ 4.00122066e-03 3.37088044e-04 9.42714627e-05] [ 9.51779006e-04 -1.82904889e-04 -6.69265131e-04] [ 2.78354251e-03 -1.34058803e-03 -3.24235240e-04] [ 4.19162404e-03 5.38967292e-04 -1.97069599e-04] [-2.84343985e-03 8.94614736e-04 -1.20227844e-03] [-1.55479633e-03 -1.87641539e-03 -2.00758318e-03] [ 5.54869588e-03 -1.18920241e-04 -4.73321050e-05] [-2.76805226e-04 -2.90590334e-05 1.18878959e-04] [-1.50272168e-04 2.56635203e-04 -3.67006838e-04] [-6.01229896e-03 -7.55242919e-04 -8.03088002e-04] [-1.52844514e-03 -3.51148172e-04 -1.01447374e-03] [ 4.64147755e-03 1.34954662e-04 -9.15782910e-04] [-4.89795553e-03 1.85942525e-04 -8.42520184e-04] [ 5.99066208e-03 5.01229667e-05 -7.90907680e-04] [ 8.99258140e-04 1.22645699e-04 -5.80450125e-04] [-2.34888631e-03 4.21974043e-04 -1.10922275e-04] [ 2.50386012e-03 -1.38286937e-04 4.76759804e-04] [-1.71536112e-03 1.40454041e-04 5.07096160e-04] [-8.07142652e-04 -4.06135117e-04 -5.29096063e-04] [-2.57267604e-03 8.86878295e-05 3.21945860e-05] [-3.69442600e-03 -1.62060199e-03 -1.75544952e-04] [ 4.36385996e-04 1.40883762e-03 -1.08953087e-04] [ 1.24287200e-03 -2.55633996e-03 1.44572028e-03] [ 3.49249861e-03 8.31674293e-04 2.00648225e-04] [-1.92631156e-04 9.40675177e-04 4.74810887e-04] [ 7.17721644e-04 -6.66483179e-04 5.66130663e-04] [ 3.43951396e-03 9.05742891e-04 5.40897656e-04] [-9.64198888e-04 -4.57261898e-05 5.59426105e-04] [ 7.48505211e-03 2.88061380e-06 -4.23995676e-04] [ 3.30476039e-03 3.88775049e-04 -8.83165641e-04] [-7.60804356e-04 2.26266953e-04 3.45077744e-04] [ 1.33279460e-03 3.13281962e-04 2.64382507e-04] [-3.16949650e-03 -6.63756027e-05 -1.09580245e-03] [ 4.70046115e-03 -5.59648146e-04 6.57448747e-05] [ 5.58942656e-04 2.03592951e-03 9.93605869e-05] [-2.35879009e-03 -6.04252799e-04 1.59162543e-03] [ 1.97939591e-03 1.68968362e-03 2.52391448e-03] [-3.50859547e-05 -4.92978358e-04 -1.56169852e-03] [-1.33964596e-04 1.36401169e-03 2.82100680e-03] [ 1.89155484e-03 -2.65276277e-03 -1.03750391e-03] [-4.60958603e-03 -2.95073948e-03 3.44031926e-03] [-3.34116865e-03 6.29427536e-03 -3.70550990e-03] [-2.93024512e-03 -5.08867221e-03 3.63743732e-03] [-4.02664130e-03 2.21690901e-04 -1.18231557e-03] [-1.19441548e-03 6.25340454e-04 -3.30587419e-03] [-1.89786962e-03 -9.02708506e-04 -1.74433620e-03] [-1.25304772e-03 8.72296417e-04 1.87847724e-03] [-1.46934307e-03 -1.37566393e-03 2.24700951e-03] [ 2.20465878e-03 1.57426129e-03 -5.87863663e-04] [-2.38044255e-03 -2.49401135e-04 1.36387622e-03] [-2.67039021e-03 -2.51135511e-04 -1.36097402e-03] [ 4.51297763e-03 -4.30665726e-04 7.17727412e-04] [ 3.02983271e-03 2.92167957e-03 2.11186821e-03] [-8.76364797e-04 2.49077378e-03 -3.01806793e-03] [ 4.99530980e-05 -2.52415807e-03 3.40601488e-03] [ 1.77241414e-03 -1.93337296e-03 -2.05007760e-03] [ 3.72937903e-03 1.47376907e-03 1.36064692e-03] [-2.58478237e-03 4.68703495e-03 -2.53283584e-03] [-2.54267695e-03 -6.00934541e-03 1.99322560e-03] [ 3.45661429e-03 -5.11615325e-04 -1.21381445e-03] [-2.70792265e-03 4.89167266e-03 2.44269072e-03] [ 1.60135717e-03 7.96387550e-04 -2.86175694e-03] [ 1.28841490e-03 -1.20691715e-04 2.72045578e-03] [-2.11395046e-03 -5.64988813e-03 -1.95378734e-03] [ 3.43807887e-03 9.72809980e-04 2.99206371e-03] [-3.98326887e-03 -2.52723207e-03 2.27660000e-03] [-4.31317268e-03 2.25422440e-03 -2.36082622e-03] [ 3.13824305e-03 -5.48561858e-04 -3.33166454e-03] [ 3.00605818e-04 3.80608580e-03 2.15899106e-03] [-1.36841109e-03 -1.32883831e-03 -2.10174446e-03] [-1.00430208e-03 1.78339321e-04 2.34623044e-03] [ 4.70362354e-04 -1.31453677e-03 -1.69866374e-03] [ 3.26231372e-03 7.86922208e-04 1.13700590e-03] [ 8.73216161e-04 -2.22512365e-03 -9.72318265e-04] [ 1.26860549e-03 2.28380644e-03 3.80031399e-04] [ 3.74038676e-03 -1.04637176e-03 -2.46469771e-03] [ 1.42631716e-03 4.95103933e-04 1.20773554e-03] [-3.37537426e-03 6.90522661e-05 6.38966082e-04] [ 6.16168056e-03 1.01636604e-04 1.66402516e-04] [-6.98606905e-03 -1.96141014e-04 2.48054734e-04] [-1.44989474e-03 -1.81958416e-04 -1.47702288e-04] [-1.25681874e-03 -1.75190748e-04 -2.95073781e-04] [ 5.68967016e-03 -4.83522491e-04 1.52324969e-04] [-2.57308980e-03 5.64213268e-04 -2.40855513e-04] [-5.28794540e-03 1.10322966e-03 -1.92655826e-04] [ 1.40658670e-03 1.24391762e-03 -8.65510089e-04] [-8.82162978e-03 -7.10493466e-04 -3.67705844e-04] [ 3.30293094e-03 3.23148559e-04 -1.35810551e-05] [-1.86374157e-03 3.16858744e-04 1.53108130e-05] [ 8.43198958e-04 -3.08939572e-04 -2.00678246e-04] [ 2.34899120e-03 2.30612434e-03 5.96181098e-04] [-1.67269421e-03 -1.27131391e-03 3.54579489e-04] [-1.87681585e-03 6.46537762e-03 -2.02639950e-03] [ 3.13155221e-03 1.62874400e-04 4.74303119e-04] [ 2.38718591e-03 -2.07634553e-03 1.39361867e-03] [-1.92093471e-03 -5.34225480e-03 4.24115738e-03] [-4.10989344e-03 1.12684274e-03 -2.73646558e-03] [-3.12052196e-03 -7.58221433e-04 1.50869037e-03] [-2.63967876e-03 2.02560217e-04 -2.35564067e-03] [-3.86531170e-03 -1.34099814e-03 2.78947626e-03]] Final stress: [-2.49016115e-05 1.82039705e-05 -2.63475717e-05 -1.39490758e-06 -4.00631999e-05 -4.99360536e-05] Minimization converged after 151 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.16406772e-03 -8.29774995e-04 -1.57183727e-04] [-1.10475893e-03 7.13148451e-04 -8.09130179e-05] [-7.65078114e-05 2.23745541e-04 -1.37033001e-04] [-1.26629423e-03 -2.10994908e-04 -8.36320980e-05] [-1.50640391e-03 -3.71912962e-04 1.84771009e-04] [-1.12062342e-03 5.26090560e-04 1.98395027e-04] [ 4.77731702e-04 -1.32391445e-03 1.38203724e-03] [ 1.34239181e-03 1.43367358e-03 1.56038916e-03] [ 3.21870078e-05 -3.18155647e-04 -4.91751621e-04] [-1.67417670e-03 4.09337353e-04 -5.61248230e-04] [ 2.22507339e-03 4.75410971e-04 2.49785278e-07] [ 1.03009899e-04 -3.82010889e-04 3.80784268e-05] [-1.80956789e-03 3.59053986e-05 9.41763115e-04] [ 5.45578266e-04 5.91438718e-05 1.27672235e-03] [-2.50732591e-03 1.05353890e-03 7.45899694e-04] [ 1.69654249e-03 -9.45755786e-04 8.05061078e-04] [ 1.00913187e-03 -7.71139624e-05 2.60669423e-04] [-4.34756434e-04 1.03166253e-04 2.72506883e-04] [ 3.49100946e-04 -1.04634316e-04 -6.05889673e-04] [-1.00435285e-03 1.12354333e-04 -5.80861467e-04] [ 9.23690112e-04 2.15303987e-04 3.72690071e-04] [ 1.06775324e-03 -1.84461086e-04 5.01228800e-04] [-8.47752196e-04 1.09974153e-03 9.77095393e-05] [ 8.77520219e-04 -1.38899298e-03 6.17571375e-05] [-2.21147117e-04 1.26149047e-03 -1.52663904e-03] [ 8.65670111e-04 -1.79051990e-03 -2.35584414e-03] [ 2.81829924e-04 -1.28388515e-03 -9.78367795e-04] [ 2.59489900e-04 1.44403711e-03 -1.39050366e-03] [ 8.00745852e-04 6.62589822e-05 4.42718804e-04] [-1.24060040e-03 -1.42515559e-04 4.24326599e-04] [-6.39758084e-04 -8.84124510e-05 -4.10611649e-04] [-2.47744082e-03 1.17259299e-05 -2.60291806e-04] [-1.42781233e-04 -2.41236964e-04 1.00291645e-05] [-7.88105271e-05 2.28783687e-04 -1.24587711e-05] [-1.55120779e-03 6.16539073e-04 4.72613895e-04] [ 1.06714353e-03 -4.20079560e-05 -1.28398959e-04] [ 4.99419186e-04 -2.11833156e-04 8.58854644e-04] [-5.84999921e-04 -3.32327014e-04 4.70117031e-04] [-2.64536351e-04 7.99395737e-04 -1.22335566e-03] [-1.04731413e-03 -6.16416142e-04 9.19707709e-04] [-8.05802306e-04 6.65293192e-04 -5.70560970e-04] [-6.06464667e-04 -1.01429650e-03 1.66075262e-03] [ 8.84644678e-04 -2.21616298e-03 -1.46066135e-03] [ 1.65877049e-03 7.09579582e-04 8.37726736e-04] [ 1.55678182e-03 -2.65300065e-04 -6.96365128e-04] [ 9.30777597e-04 1.88080083e-03 1.36804972e-03] [-1.40741956e-03 2.48087769e-04 -7.99367852e-04] [ 7.88692473e-04 -4.80599765e-04 -1.25806488e-03] [ 6.30069964e-04 3.18688606e-04 1.51067173e-03] [-1.37104473e-03 -1.48754626e-04 1.06063995e-03] [ 5.90278228e-04 -4.46483703e-04 9.65521288e-05] [-9.83042493e-04 -3.23261253e-04 -5.11142365e-04] [-1.51120721e-03 7.63502806e-04 -3.36413377e-04] [ 8.78790264e-04 -3.47905838e-05 -8.81824776e-04] [-1.73635903e-03 -3.09934264e-03 -2.23358907e-03] [ 2.39458540e-04 2.47258502e-04 5.72741452e-05] [-1.95820307e-03 2.57888493e-03 -1.44648128e-03] [ 1.01612537e-03 -3.20101701e-04 5.76710378e-04] [ 1.05773322e-03 -2.00774387e-03 -9.25056736e-04] [-8.36541847e-04 -8.79939069e-04 4.70680357e-04] [-8.97423887e-04 6.29384288e-04 -5.54621360e-04] [ 1.20116755e-03 2.33889630e-03 6.24086778e-04] [-8.86120620e-04 -1.98938695e-04 -1.03685198e-03] [ 8.42707499e-04 -2.23486146e-03 4.99794538e-04] [ 1.29963819e-03 1.89227123e-03 -1.27792203e-03] [-1.72229097e-03 6.74376397e-04 3.31562004e-05] [ 1.38917595e-03 6.53892925e-04 6.78501560e-04] [-1.94707377e-03 3.04213109e-04 9.94717135e-04] [-1.97588602e-03 1.72278630e-04 -1.44240252e-03] [ 1.24361116e-03 -1.18672734e-03 -5.74207517e-04] [-1.91012073e-04 8.48370868e-04 -6.01843945e-04] [ 1.48803140e-03 -2.49634476e-03 1.21405569e-03] [ 2.44752015e-05 2.71643485e-04 -5.53270464e-04] [ 1.16160394e-03 7.44722470e-04 1.14865009e-03] [-5.15925518e-04 1.35327830e-03 5.30247148e-04] [-1.14765039e-03 -5.01698170e-04 9.69112297e-04] [-1.18884339e-03 -5.66586473e-05 -3.46122478e-04] [-5.53037565e-04 -7.50285596e-04 3.02271718e-04] [ 1.34372492e-03 -7.73278473e-04 3.95821435e-04] [-6.38859747e-04 1.14071427e-03 8.39907882e-04] [ 2.56790588e-03 7.40180898e-05 -3.36784112e-05] [-2.20629963e-03 -5.21576603e-05 -6.81825451e-05] [ 5.70955276e-04 3.50768131e-04 -2.68111976e-04] [ 6.06778060e-04 -3.64603398e-04 -2.51331800e-04] [ 1.80737066e-03 1.53000029e-03 -1.10452616e-03] [-2.01191430e-03 -1.41627359e-03 -1.00064238e-03] [ 1.54777720e-03 5.09054332e-05 4.82634260e-05] [ 1.31360619e-03 -2.93633262e-04 6.99775040e-05] [-1.46053361e-03 -3.82120694e-05 6.23397307e-05] [ 3.60880076e-03 1.48837654e-04 3.00685451e-05] [-1.47117579e-04 -2.65981542e-04 2.29545609e-04] [ 5.59304301e-04 2.39013179e-04 3.16726224e-04] [ 2.50977468e-03 -5.13871021e-04 -7.32631377e-05] [-5.93231574e-04 7.55186749e-04 -4.11487779e-05] [-1.48705113e-03 7.51410230e-04 -7.70702881e-04] [ 6.95670982e-04 -2.53849700e-03 -1.39379054e-03] [ 3.36101428e-05 1.31906135e-03 2.35696007e-04] [-7.05340881e-04 7.35034452e-04 -3.12497685e-04] [ 3.23537145e-04 -4.07583736e-04 2.11417072e-03] [ 1.83345771e-03 1.10122752e-03 -2.26976741e-04] [ 2.98582538e-04 1.32922765e-03 3.10189882e-03] [ 1.32948254e-03 -1.49636148e-03 -3.39755968e-04]] Final stress: [ 1.74050945e-06 -4.91600155e-06 -8.76714286e-06 -1.55324527e-07 2.33713607e-06 -1.64550952e-05] Minimization converged after 151 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.71930532e-03 -7.12783382e-03 -1.74154619e-03] [-1.71930532e-03 7.12783380e-03 -1.74154619e-03] [ 2.35401662e-03 1.08642641e-03 2.43504508e-04] [-2.35401662e-03 -1.08642641e-03 2.43504508e-04] [ 2.84737870e-03 -6.86230759e-04 -6.24022863e-05] [-2.84737870e-03 6.86230758e-04 -6.24022845e-05] [-6.06279110e-03 4.38240962e-04 -1.80521326e-03] [ 6.06279110e-03 -4.38240978e-04 -1.80521327e-03] [-2.17126122e-03 -4.75593801e-05 5.08716677e-04] [ 2.17126122e-03 4.75593809e-05 5.08716677e-04] [ 1.06106638e-03 9.13918628e-04 -9.25435299e-04] [-1.06106638e-03 -9.13918624e-04 -9.25435298e-04] [ 2.96780068e-04 2.38847710e-05 3.52611234e-04] [-2.96780067e-04 -2.38847781e-05 3.52611224e-04] [-5.50405605e-03 3.29318498e-03 7.91015425e-04] [ 5.50405605e-03 -3.29318498e-03 7.91015425e-04] [-1.34903520e-05 -3.29296983e-04 1.64747335e-04] [ 1.34903495e-05 3.29296983e-04 1.64747335e-04] [-1.72696252e-03 -1.03461853e-03 -4.23460001e-04] [ 1.72696252e-03 1.03461853e-03 -4.23459996e-04] [ 4.57520797e-03 2.22052288e-06 2.97718725e-04] [-4.57520797e-03 -2.22052372e-06 2.97718722e-04] [-2.26059346e-03 -3.49719780e-03 -1.04893995e-03] [ 2.26059346e-03 3.49719779e-03 -1.04893995e-03] [-1.08617169e-03 -1.66435993e-04 -1.63329479e-03] [ 1.08617169e-03 1.66436004e-04 -1.63329477e-03] [-1.66643261e-03 -5.56503397e-04 -2.24530080e-03] [ 1.66643260e-03 5.56503404e-04 -2.24530079e-03] [ 4.82627724e-03 1.01103944e-03 -1.74170765e-05] [-4.82627723e-03 -1.01103943e-03 -1.74170777e-05] [-1.05760986e-03 -2.88687606e-04 -9.41105394e-04] [ 1.05760985e-03 2.88687606e-04 -9.41105395e-04] [-3.75962336e-03 1.93207184e-04 6.78216983e-04] [ 3.75962336e-03 -1.93207185e-04 6.78216979e-04] [-3.88738394e-03 4.10090115e-03 4.32558822e-04] [ 3.88738394e-03 -4.10090116e-03 4.32558824e-04] [ 1.98497087e-03 3.78443867e-03 4.90010418e-04] [-1.98497088e-03 -3.78443867e-03 4.90010413e-04] [ 8.92401760e-04 -1.92970157e-03 5.69381271e-03] [-8.92401762e-04 1.92970157e-03 5.69381271e-03] [-9.57009876e-04 4.19112482e-04 -2.00565372e-03] [ 9.57009877e-04 -4.19112482e-04 -2.00565372e-03] [-2.18493358e-03 -3.64494144e-03 -3.45886198e-03] [ 2.18493358e-03 3.64494144e-03 -3.45886198e-03] [ 1.72218649e-03 -1.17412032e-03 4.35473294e-03] [-1.72218649e-03 1.17412032e-03 4.35473294e-03] [-5.36951409e-03 2.17923081e-03 1.56033215e-03] [ 5.36951409e-03 -2.17923081e-03 1.56033215e-03] [ 5.13108971e-03 3.84302260e-03 -4.25779908e-03] [-5.13108970e-03 -3.84302261e-03 -4.25779907e-03] [-1.88053827e-03 -2.11013910e-03 -3.27855596e-03] [ 1.88053827e-03 2.11013910e-03 -3.27855596e-03] [ 7.29550727e-05 -2.49313185e-03 2.45433309e-03] [-7.29550731e-05 2.49313185e-03 2.45433309e-03] [ 1.52040549e-03 -3.66699229e-03 8.60311455e-04] [-1.52040549e-03 3.66699229e-03 8.60311449e-04] [-4.33705521e-03 -2.96391449e-03 -1.07129038e-03] [ 4.33705521e-03 2.96391449e-03 -1.07129038e-03] [ 3.62886134e-03 1.43464437e-03 -3.23924776e-04] [-3.62886134e-03 -1.43464437e-03 -3.23924775e-04] [-4.19789192e-03 8.03173051e-04 -5.13169910e-05] [ 4.19789192e-03 -8.03173054e-04 -5.13169902e-05] [ 1.30318630e-03 -7.22918102e-05 7.84537973e-03] [-1.30318631e-03 7.22918060e-05 7.84537973e-03] [-2.66154809e-03 2.64233991e-03 -6.64337998e-03] [ 2.66154810e-03 -2.64233991e-03 -6.64337998e-03] [ 4.10556071e-04 8.81391479e-05 6.88241827e-04] [-4.10556071e-04 -8.81391488e-05 6.88241831e-04] [ 4.82814569e-04 8.37892762e-04 -6.42392315e-04] [-4.82814565e-04 -8.37892760e-04 -6.42392319e-04] [ 3.00709817e-03 4.45261602e-03 -2.94933617e-03] [-3.00709817e-03 -4.45261602e-03 -2.94933616e-03] [-5.77201638e-03 1.50456471e-03 2.81732528e-03] [ 5.77201638e-03 -1.50456471e-03 2.81732527e-03] [ 6.63915942e-04 1.11696760e-03 -3.03951860e-03] [-6.63915944e-04 -1.11696760e-03 -3.03951860e-03] [ 7.97278462e-04 4.05353194e-04 2.20111896e-03] [-7.97278462e-04 -4.05353194e-04 2.20111896e-03] [ 2.93911729e-03 -7.22450279e-04 7.65074958e-04] [-2.93911729e-03 7.22450277e-04 7.65074949e-04] [-3.66811723e-03 -1.32235972e-04 2.62422798e-04] [ 3.66811723e-03 1.32235974e-04 2.62422798e-04] [ 2.25726504e-03 3.79582436e-04 -8.50070544e-04] [-2.25726504e-03 -3.79582437e-04 -8.50070543e-04] [-1.17996336e-03 3.07604703e-04 1.96034440e-04] [ 1.17996336e-03 -3.07604699e-04 1.96034455e-04] [ 3.79072772e-03 3.78625830e-03 8.81079866e-06] [-3.79072773e-03 -3.78625828e-03 8.81079857e-06] [ 5.24849145e-03 -4.64185219e-04 -7.57455626e-05] [-5.24849145e-03 4.64185221e-04 -7.57455640e-05] [-6.15426136e-03 -5.36071929e-04 3.47487616e-04] [ 6.15426136e-03 5.36071933e-04 3.47487616e-04] [ 6.86703408e-04 3.70505763e-03 3.53697158e-04] [-6.86703412e-04 -3.70505762e-03 3.53697159e-04] [ 2.27610905e-03 4.98306320e-04 -1.02852438e-04] [-2.27610906e-03 -4.98306314e-04 -1.02852429e-04] [-3.72385898e-03 -2.93900561e-03 2.61686143e-03] [ 3.72385898e-03 2.93900562e-03 2.61686143e-03] [-4.19268699e-03 -3.89502328e-03 2.64449403e-04] [ 4.19268699e-03 3.89502327e-03 2.64449387e-04] [ 3.93088761e-03 -3.32639204e-03 2.34528664e-03] [-3.93088760e-03 3.32639204e-03 2.34528665e-03]] Final stress: [-1.76654891e-05 8.13654595e-06 -1.16276979e-05 1.34557780e-14 -8.66456975e-15 -7.18097534e-05] Minimization converged after 114 steps. Minimization converged after 21 steps. Minimization converged after 22 steps. Minimization converged after 12 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 8 steps. Minimization converged after 16 steps. Minimization converged after 19 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 119 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-2.04118308e-04 2.60122039e-04 1.08436345e-04] [ 2.04118310e-04 -2.60122038e-04 1.08436346e-04] [-2.56662631e-04 1.22940043e-04 -1.49702353e-04] [ 2.56662631e-04 -1.22940043e-04 -1.49702352e-04] [-1.70561039e-04 3.19741664e-06 -7.78742133e-05] [ 1.70561038e-04 -3.19741557e-06 -7.78742135e-05] [ 4.99887833e-04 -8.13025923e-06 -1.51396572e-04] [-4.99887833e-04 8.13026369e-06 -1.51396567e-04] [ 1.57187577e-05 7.67892081e-04 -2.10904322e-04] [-1.57187578e-05 -7.67892081e-04 -2.10904323e-04] [-9.79136886e-06 -2.39316619e-04 -9.51885685e-05] [ 9.79136930e-06 2.39316619e-04 -9.51885698e-05] [ 2.84288364e-04 5.97764235e-05 7.12064478e-05] [-2.84288365e-04 -5.97764241e-05 7.12064476e-05] [ 1.89539955e-04 1.22462019e-04 5.63873746e-04] [-1.89539956e-04 -1.22462019e-04 5.63873748e-04] [ 7.68599558e-05 1.47885035e-04 -8.30000719e-05] [-7.68599558e-05 -1.47885036e-04 -8.30000723e-05] [ 7.30523476e-05 -3.45021337e-04 1.02756147e-04] [-7.30523477e-05 3.45021336e-04 1.02756145e-04] [-6.88101192e-04 -6.30052299e-04 3.09466798e-04] [ 6.88101192e-04 6.30052298e-04 3.09466799e-04] [ 7.26959299e-04 3.09202788e-04 -5.85926535e-05] [-7.26959299e-04 -3.09202789e-04 -5.85926532e-05] [-2.70995813e-04 1.39759973e-04 -1.55638873e-04] [ 2.70995813e-04 -1.39759971e-04 -1.55638870e-04] [ 5.38395791e-05 -1.12903138e-04 -4.67599388e-04] [-5.38395781e-05 1.12903137e-04 -4.67599385e-04] [-2.26315898e-04 5.62110554e-04 -2.19596002e-06] [ 2.26315898e-04 -5.62110555e-04 -2.19596011e-06] [ 2.70631336e-05 -5.13941428e-04 2.25590235e-04] [-2.70631337e-05 5.13941428e-04 2.25590236e-04] [ 5.67083396e-04 -1.78873177e-04 -1.07458391e-04] [-5.67083396e-04 1.78873177e-04 -1.07458390e-04] [ 4.33934470e-06 -2.61449579e-04 5.46296184e-04] [-4.33934511e-06 2.61449579e-04 5.46296184e-04] [-2.48995972e-04 -9.33470136e-05 5.59245907e-05] [ 2.48995971e-04 9.33470119e-05 5.59245886e-05] [ 1.36057378e-04 2.22910956e-04 -2.78321894e-04] [-1.36057378e-04 -2.22910958e-04 -2.78321893e-04] [-3.38285946e-04 -1.50582629e-04 4.70367249e-04] [ 3.38285943e-04 1.50582627e-04 4.70367251e-04] [-9.11716752e-05 3.18240973e-05 3.07920898e-04] [ 9.11716750e-05 -3.18240968e-05 3.07920898e-04] [-4.03026127e-04 9.05223084e-04 -3.99859370e-04] [ 4.03026127e-04 -9.05223085e-04 -3.99859370e-04] [-2.37885835e-06 -7.72092488e-05 -3.73916940e-04] [ 2.37885809e-06 7.72092493e-05 -3.73916940e-04] [-3.48424393e-04 -4.66734632e-04 4.73769134e-04] [ 3.48424393e-04 4.66734633e-04 4.73769135e-04] [-1.76429049e-04 1.73032091e-04 -2.17210733e-04] [ 1.76429050e-04 -1.73032091e-04 -2.17210733e-04] [ 1.85254748e-04 -2.88904453e-06 -5.30317233e-04] [-1.85254748e-04 2.88904482e-06 -5.30317235e-04] [-8.01185428e-04 -2.70056047e-04 3.73968360e-05] [ 8.01185427e-04 2.70056049e-04 3.73968364e-05] [ 6.20146479e-05 -1.19890314e-04 7.55533112e-04] [-6.20146492e-05 1.19890316e-04 7.55533112e-04] [-5.56255083e-04 2.20083682e-04 -6.54156092e-05] [ 5.56255083e-04 -2.20083681e-04 -6.54156087e-05] [ 7.56662509e-05 -4.22256862e-04 -6.29280772e-05] [-7.56662512e-05 4.22256862e-04 -6.29280767e-05] [-2.39476961e-04 -1.45852446e-04 -1.07048249e-03] [ 2.39476961e-04 1.45852446e-04 -1.07048249e-03] [ 1.26786301e-04 -2.16491072e-04 7.64767795e-04] [-1.26786300e-04 2.16491073e-04 7.64767796e-04] [-1.55396141e-05 -5.81507276e-05 -2.80065234e-05] [ 1.55396140e-05 5.81507278e-05 -2.80065223e-05] [-1.53044630e-04 1.44022062e-04 4.19979857e-04] [ 1.53044630e-04 -1.44022062e-04 4.19979856e-04] [-1.48079472e-03 8.36287870e-05 -1.91930342e-04] [ 1.48079472e-03 -8.36287868e-05 -1.91930342e-04] [ 7.93963685e-04 5.34929609e-04 -6.47072907e-04] [-7.93963683e-04 -5.34929607e-04 -6.47072906e-04] [-1.79220519e-04 -1.21679928e-04 2.19528375e-04] [ 1.79220520e-04 1.21679928e-04 2.19528376e-04] [ 2.97430570e-04 7.47226321e-05 -4.22163796e-04] [-2.97430570e-04 -7.47226320e-05 -4.22163797e-04] [ 5.40670856e-05 2.20256139e-04 -4.97302526e-05] [-5.40670858e-05 -2.20256139e-04 -4.97302530e-05] [ 2.21106855e-04 1.48211112e-04 1.16695038e-04] [-2.21106854e-04 -1.48211112e-04 1.16695037e-04] [ 1.35036484e-04 2.89660760e-04 -2.85723249e-04] [-1.35036483e-04 -2.89660760e-04 -2.85723249e-04] [ 4.73239255e-04 -2.46889259e-04 -3.26490607e-05] [-4.73239255e-04 2.46889256e-04 -3.26490619e-05] [-2.29917750e-04 -1.23635648e-04 -6.68699695e-05] [ 2.29917749e-04 1.23635647e-04 -6.68699709e-05] [-3.73017222e-04 -1.75924917e-04 -1.67974042e-04] [ 3.73017221e-04 1.75924916e-04 -1.67974042e-04] [ 6.97032790e-04 -3.35015513e-04 2.06283145e-04] [-6.97032790e-04 3.35015514e-04 2.06283144e-04] [-2.47949606e-04 -1.67061719e-04 2.19797913e-04] [ 2.47949607e-04 1.67061721e-04 2.19797913e-04] [ 1.87124900e-04 9.20269222e-05 -6.53118309e-05] [-1.87124900e-04 -9.20269224e-05 -6.53118336e-05] [ 5.38582108e-04 6.14100039e-04 -6.58316420e-05] [-5.38582109e-04 -6.14100040e-04 -6.58316399e-05] [ 5.68052868e-04 9.00855692e-06 3.63372316e-04] [-5.68052867e-04 -9.00855658e-06 3.63372314e-04] [-1.85332786e-04 -7.59075373e-05 2.42305156e-04] [ 1.85332786e-04 7.59075362e-05 2.42305159e-04]] Final stress: [ 2.06459006e-05 1.33611041e-05 5.31861091e-06 -1.32176278e-15 8.62850565e-16 1.05118983e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 3.86864143e-03 2.15631268e-02 5.31124306e-04] [-3.86864143e-03 -2.15631273e-02 5.31124396e-04] [ 3.50366631e-03 -5.65858070e-03 4.71537927e-04] [-3.50366631e-03 5.65858072e-03 4.71537901e-04] [ 2.75450819e-03 -4.37547243e-03 1.91642272e-03] [-2.75450818e-03 4.37547243e-03 1.91642271e-03] [-6.91055905e-03 -1.57531408e-03 7.87182896e-03] [ 6.91055905e-03 1.57531412e-03 7.87182907e-03] [-6.86010203e-04 -7.39020493e-03 2.24154577e-03] [ 6.86010205e-04 7.39020494e-03 2.24154575e-03] [ 1.29309486e-03 4.87241462e-03 1.40615932e-03] [-1.29309486e-03 -4.87241458e-03 1.40615935e-03] [-5.39017711e-03 -1.54714477e-03 3.70875127e-04] [ 5.39017711e-03 1.54714477e-03 3.70875096e-04] [-5.24969087e-03 -1.26977304e-02 -5.59631615e-04] [ 5.24969087e-03 1.26977305e-02 -5.59631541e-04] [ 3.84008990e-03 -2.28439423e-04 -1.03967715e-04] [-3.84008989e-03 2.28439419e-04 -1.03967717e-04] [-2.46880870e-03 6.00032733e-03 5.52276622e-05] [ 2.46880871e-03 -6.00032738e-03 5.52276478e-05] [ 8.92934695e-03 7.42242349e-03 -4.77085102e-03] [-8.92934695e-03 -7.42242349e-03 -4.77085103e-03] [-9.40569971e-03 1.25387638e-02 6.80418327e-03] [ 9.40569971e-03 -1.25387637e-02 6.80418326e-03] [ 2.57586160e-03 -3.39817693e-03 1.72043654e-03] [-2.57586161e-03 3.39817698e-03 1.72043655e-03] [-2.66839022e-03 1.28373361e-03 1.64725373e-03] [ 2.66839021e-03 -1.28373368e-03 1.64725370e-03] [ 2.35367900e-03 -6.63857624e-03 6.67412789e-03] [-2.35367899e-03 6.63857622e-03 6.67412785e-03] [ 2.45199157e-03 4.45853162e-03 -5.17974028e-03] [-2.45199156e-03 -4.45853163e-03 -5.17974026e-03] [-6.60609945e-03 -2.72562181e-03 -3.14683322e-03] [ 6.60609943e-03 2.72562188e-03 -3.14683323e-03] [-5.03670050e-03 1.09232056e-03 -3.75662133e-03] [ 5.03670051e-03 -1.09232055e-03 -3.75662133e-03] [-4.28700804e-04 2.89723810e-03 2.72154900e-03] [ 4.28700797e-04 -2.89723809e-03 2.72154901e-03] [-2.81537632e-03 -1.07076708e-03 2.70993404e-03] [ 2.81537632e-03 1.07076711e-03 2.70993409e-03] [-1.20661569e-03 -5.74604005e-03 -1.33928429e-02] [ 1.20661567e-03 5.74604006e-03 -1.33928430e-02] [ 9.98270635e-04 -4.17547992e-03 -3.29667864e-03] [-9.98270638e-04 4.17547994e-03 -3.29667864e-03] [ 5.70369147e-03 -7.37382534e-03 6.16794314e-03] [-5.70369148e-03 7.37382537e-03 6.16794313e-03] [-5.78170678e-04 7.37917200e-03 9.32980222e-03] [ 5.78170641e-04 -7.37917204e-03 9.32980226e-03] [ 2.87505822e-03 2.16382277e-04 1.63495663e-03] [-2.87505817e-03 -2.16382328e-04 1.63495660e-03] [-1.34627010e-03 -1.08634413e-03 2.59895423e-04] [ 1.34627010e-03 1.08634411e-03 2.59895429e-04] [-3.74204328e-03 1.27151704e-03 4.89483598e-03] [ 3.74204327e-03 -1.27151705e-03 4.89483598e-03] [-7.42672920e-04 -4.09948240e-03 -3.82811864e-03] [ 7.42672930e-04 4.09948244e-03 -3.82811867e-03] [ 5.67769547e-03 -8.74708057e-04 -7.13549141e-03] [-5.67769548e-03 8.74708096e-04 -7.13549139e-03] [ 7.66729777e-03 1.24633191e-04 -9.06624875e-04] [-7.66729778e-03 -1.24633184e-04 -9.06624885e-04] [-4.06570714e-04 6.61646765e-04 8.03598494e-04] [ 4.06570708e-04 -6.61646780e-04 8.03598489e-04] [ 1.85777912e-03 3.09296994e-03 9.60465750e-03] [-1.85777918e-03 -3.09297002e-03 9.60465745e-03] [-1.22654161e-03 -8.50549058e-04 -1.56930231e-02] [ 1.22654168e-03 8.50548976e-04 -1.56930230e-02] [-3.63306185e-04 -3.57601868e-04 4.80486792e-04] [ 3.63306173e-04 3.57601870e-04 4.80486792e-04] [ 1.61935535e-03 -3.54946828e-03 -2.27007031e-03] [-1.61935534e-03 3.54946829e-03 -2.27007030e-03] [ 1.42545922e-02 3.04712726e-03 5.50786457e-03] [-1.42545922e-02 -3.04712728e-03 5.50786456e-03] [-4.31790289e-03 -5.06514950e-04 4.29173773e-03] [ 4.31790286e-03 5.06514925e-04 4.29173773e-03] [ 6.86349935e-04 1.42618541e-03 -1.73206231e-03] [-6.86349936e-04 -1.42618542e-03 -1.73206228e-03] [-5.32516626e-03 3.60958057e-04 4.92673642e-03] [ 5.32516628e-03 -3.60958061e-04 4.92673639e-03] [ 5.94756618e-03 -3.59921581e-03 2.68498368e-03] [-5.94756616e-03 3.59921579e-03 2.68498368e-03] [-4.15548400e-03 -3.64697516e-04 -5.13262525e-04] [ 4.15548400e-03 3.64697514e-04 -5.13262496e-04] [-2.72001857e-03 -4.00254237e-03 2.41265979e-03] [ 2.72001857e-03 4.00254239e-03 2.41265979e-03] [ 9.47364423e-04 6.59284003e-03 -5.64802855e-03] [-9.47364435e-04 -6.59284007e-03 -5.64802858e-03] [ 2.99979223e-03 -1.56889664e-02 -2.34150502e-03] [-2.99979223e-03 1.56889667e-02 -2.34150505e-03] [ 5.82169634e-03 9.03241601e-04 -5.35791418e-04] [-5.82169634e-03 -9.03241598e-04 -5.35791416e-04] [-8.14866527e-03 5.15749509e-03 -2.68323488e-03] [ 8.14866527e-03 -5.15749510e-03 -2.68323487e-03] [-2.21249121e-03 -1.43362178e-02 -9.24050076e-04] [ 2.21249123e-03 1.43362177e-02 -9.24050072e-04] [-2.00690138e-03 4.19777348e-04 -3.67075766e-03] [ 2.00690134e-03 -4.19777289e-04 -3.67075775e-03] [-2.19525533e-03 -2.95229081e-03 2.37375632e-03] [ 2.19525535e-03 2.95229088e-03 2.37375641e-03] [-8.65103943e-03 -6.75518198e-03 -4.92571616e-03] [ 8.65103942e-03 6.75518196e-03 -4.92571616e-03] [ 5.71484696e-04 2.41285500e-03 -5.50121737e-03] [-5.71484692e-04 -2.41285502e-03 -5.50121736e-03]] Final stress: [-7.45000176e-05 1.36956887e-05 -1.39204380e-04 4.34852504e-14 2.80906232e-14 -1.56265747e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-3.61799959e-03 1.99432077e-02 4.41998483e-04] [ 3.61799959e-03 -1.99432081e-02 4.41998570e-04] [-3.27999304e-03 -5.29966569e-03 5.66457518e-04] [ 3.27999305e-03 5.29966571e-03 5.66457506e-04] [-2.59572208e-03 -4.04708996e-03 1.77659523e-03] [ 2.59572208e-03 4.04708995e-03 1.77659523e-03] [ 6.53520280e-03 -1.57670705e-03 7.46654233e-03] [-6.53520279e-03 1.57670715e-03 7.46654249e-03] [ 6.95532550e-04 -7.02882959e-03 2.08666927e-03] [-6.95532552e-04 7.02882958e-03 2.08666924e-03] [-1.27020796e-03 4.54860785e-03 1.35317728e-03] [ 1.27020796e-03 -4.54860783e-03 1.35317731e-03] [ 5.09930547e-03 -1.47064664e-03 4.26070612e-04] [-5.09930548e-03 1.47064664e-03 4.26070554e-04] [ 4.96093098e-03 -1.19375152e-02 -5.26566000e-04] [-4.96093099e-03 1.19375153e-02 -5.26565921e-04] [-3.66564196e-03 -2.19501438e-04 -2.51634696e-05] [ 3.66564196e-03 2.19501411e-04 -2.51634830e-05] [ 2.29205801e-03 5.66172052e-03 -7.35050051e-06] [-2.29205801e-03 -5.66172057e-03 -7.35050626e-06] [-8.42420047e-03 7.05261918e-03 -4.38883207e-03] [ 8.42420046e-03 -7.05261919e-03 -4.38883208e-03] [ 8.88421548e-03 1.16230152e-02 6.37768632e-03] [-8.88421551e-03 -1.16230152e-02 6.37768634e-03] [-2.45532251e-03 -2.98550238e-03 1.37147462e-03] [ 2.45532252e-03 2.98550245e-03 1.37147467e-03] [ 2.56105227e-03 1.30097286e-03 1.52750047e-03] [-2.56105227e-03 -1.30097290e-03 1.52750045e-03] [-2.25486617e-03 -6.33239227e-03 6.28489277e-03] [ 2.25486616e-03 6.33239226e-03 6.28489274e-03] [-2.32495826e-03 4.23705984e-03 -4.87378891e-03] [ 2.32495825e-03 -4.23705984e-03 -4.87378892e-03] [ 6.20361745e-03 -2.45937518e-03 -2.93607235e-03] [-6.20361745e-03 2.45937525e-03 -2.93607238e-03] [-2.65481324e-04 -2.72036615e-03 2.55161791e-03] [ 2.65481341e-04 2.72036616e-03 2.55161793e-03] [-4.57341117e-03 -1.10116661e-03 -3.54852881e-03] [ 4.57341117e-03 1.10116663e-03 -3.54852880e-03] [-1.16360391e-03 5.40995711e-03 -1.26454175e-02] [ 1.16360394e-03 -5.40995712e-03 -1.26454175e-02] [-2.62912458e-03 1.05499938e-03 2.61663852e-03] [ 2.62912457e-03 -1.05499937e-03 2.61663852e-03] [ 5.40301636e-03 7.07060144e-03 5.66243017e-03] [-5.40301636e-03 -7.07060142e-03 5.66243017e-03] [ 1.03056306e-03 3.85679356e-03 -3.20139116e-03] [-1.03056305e-03 -3.85679355e-03 -3.20139116e-03] [ 2.66003056e-03 -3.08548898e-04 1.51401849e-03] [-2.66003059e-03 3.08548852e-04 1.51401853e-03] [-5.71092877e-04 -6.88889867e-03 8.57759677e-03] [ 5.71092907e-04 6.88889863e-03 8.57759673e-03] [-3.44050423e-03 -1.21941905e-03 4.61789579e-03] [ 3.44050423e-03 1.21941903e-03 4.61789578e-03] [-1.18163951e-03 1.02384360e-03 2.35565195e-04] [ 1.18163950e-03 -1.02384360e-03 2.35565192e-04] [ 5.47577739e-03 9.30136037e-04 -6.72848114e-03] [-5.47577735e-03 -9.30135967e-04 -6.72848117e-03] [-7.77700371e-04 3.81561484e-03 -3.68415692e-03] [ 7.77700338e-04 -3.81561479e-03 -3.68415689e-03] [-3.57874610e-04 -6.43235445e-04 7.96983687e-04] [ 3.57874615e-04 6.43235449e-04 7.96983669e-04] [ 7.22969113e-03 -5.79702418e-05 -8.09573795e-04] [-7.22969111e-03 5.79702459e-05 -8.09573790e-04] [-1.19328020e-03 7.36232425e-04 -1.46239726e-02] [ 1.19328015e-03 -7.36232504e-04 -1.46239726e-02] [ 1.71977051e-03 -2.82348009e-03 9.16489907e-03] [-1.71977044e-03 2.82348001e-03 9.16489915e-03] [ 1.56955937e-03 3.30396724e-03 -2.15595397e-03] [-1.56955937e-03 -3.30396724e-03 -2.15595396e-03] [-4.45643952e-04 3.07015042e-04 4.46067625e-04] [ 4.45643963e-04 -3.07015033e-04 4.46067610e-04] [-3.97377890e-03 3.51980659e-04 4.02663385e-03] [ 3.97377891e-03 -3.51980688e-04 4.02663385e-03] [ 1.34191892e-02 -2.92746934e-03 5.25533937e-03] [-1.34191892e-02 2.92746931e-03 5.25533937e-03] [-5.04111359e-03 -3.79486824e-04 4.61072515e-03] [ 5.04111359e-03 3.79486826e-04 4.61072517e-03] [ 7.08237163e-04 -1.38302920e-03 -1.64402516e-03] [-7.08237169e-04 1.38302920e-03 -1.64402519e-03] [-5.70856113e-03 -3.42578701e-03 2.46668295e-03] [ 5.70856113e-03 3.42578699e-03 2.46668291e-03] [ 3.92014812e-03 -3.57095329e-04 -5.38138166e-04] [-3.92014813e-03 3.57095333e-04 -5.38138159e-04] [ 2.55841490e-03 -3.76265804e-03 2.26687748e-03] [-2.55841491e-03 3.76265805e-03 2.26687747e-03] [-9.77697257e-04 6.15009625e-03 -5.21397861e-03] [ 9.77697265e-04 -6.15009634e-03 -5.21397867e-03] [-2.89143528e-03 -1.41798606e-02 -2.13232864e-03] [ 2.89143526e-03 1.41798609e-02 -2.13232867e-03] [-5.53396884e-03 8.53770348e-04 -4.54661642e-04] [ 5.53396884e-03 -8.53770340e-04 -4.54661634e-04] [ 7.67685260e-03 4.84104158e-03 -2.49999596e-03] [-7.67685260e-03 -4.84104157e-03 -2.49999593e-03] [ 2.11952950e-03 -1.35025632e-02 -8.89118696e-04] [-2.11952950e-03 1.35025631e-02 -8.89118693e-04] [-2.04948037e-03 2.71124768e-03 2.21377951e-03] [ 2.04948033e-03 -2.71124763e-03 2.21377940e-03] [-1.86344596e-03 -4.77536851e-04 -3.51395448e-03] [ 1.86344599e-03 4.77536921e-04 -3.51395437e-03] [ 5.50049598e-04 -2.21239222e-03 -5.14653002e-03] [-5.50049615e-04 2.21239219e-03 -5.14653008e-03] [-8.11775053e-03 6.30523309e-03 -4.51483599e-03] [ 8.11775055e-03 -6.30523311e-03 -4.51483596e-03]] Final stress: [-6.82180011e-05 9.68909015e-06 -1.32479419e-04 1.33258360e-15 2.23802336e-14 1.46973084e-04] Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.48939616e-04 -3.90380752e-05 -8.47599007e-06] [-1.48939617e-04 3.90380541e-05 -8.47598613e-06] [ 1.63517530e-04 -2.46455267e-04 -2.04382992e-05] [-1.63517531e-04 2.46455270e-04 -2.04383005e-05] [ 1.31914277e-04 3.60596513e-05 1.41029666e-04] [-1.31914277e-04 -3.60596512e-05 1.41029667e-04] [-2.17938347e-04 3.16556420e-04 -5.25657905e-05] [ 2.17938347e-04 -3.16556413e-04 -5.25657823e-05] [ 4.10695585e-05 -1.36632359e-04 1.23515802e-04] [-4.10695585e-05 1.36632359e-04 1.23515801e-04] [ 2.96308287e-05 2.11940764e-06 -1.91791173e-04] [-2.96308286e-05 -2.11940693e-06 -1.91791171e-04] [-2.02016057e-04 -5.19560305e-06 1.27177384e-04] [ 2.02016057e-04 5.19560130e-06 1.27177380e-04] [-4.74700423e-04 3.65224025e-04 1.44217458e-04] [ 4.74700423e-04 -3.65224019e-04 1.44217463e-04] [ 1.26059003e-05 -2.24981672e-04 2.28806922e-04] [-1.26059000e-05 2.24981670e-04 2.28806921e-04] [ 1.16640627e-04 -6.52295974e-05 -7.81776375e-05] [-1.16640627e-04 6.52295944e-05 -7.81776395e-05] [ 3.07986924e-04 2.04084146e-04 -2.33420665e-05] [-3.07986924e-04 -2.04084146e-04 -2.33420676e-05] [-1.80317924e-04 1.38965934e-05 -1.06550496e-04] [ 1.80317924e-04 -1.38966024e-05 -1.06550493e-04] [-1.27385156e-05 -8.34031976e-05 -3.77052676e-05] [ 1.27385153e-05 8.34032052e-05 -3.77052590e-05] [-6.06715925e-06 -3.41922446e-04 -2.92519000e-04] [ 6.06715932e-06 3.41922445e-04 -2.92518997e-04] [ 2.15364588e-04 -6.10731833e-05 2.22717262e-04] [-2.15364589e-04 6.10731828e-05 2.22717261e-04] [ 1.44460290e-05 -1.42090756e-04 -1.41076828e-04] [-1.44460298e-05 1.42090756e-04 -1.41076829e-04] [-1.92481178e-04 1.50402556e-04 -1.17289192e-05] [ 1.92481178e-04 -1.50402553e-04 -1.17289208e-05] [-6.75731965e-05 1.47937873e-04 -3.01713380e-05] [ 6.75731969e-05 -1.47937872e-04 -3.01713369e-05] [ 2.74723573e-04 1.79413595e-04 8.48571800e-06] [-2.74723573e-04 -1.79413594e-04 8.48571717e-06] [ 1.37388829e-05 -5.25600706e-05 1.60000532e-04] [-1.37388795e-05 5.25600688e-05 1.60000531e-04] [-9.17990166e-05 1.04849338e-04 -2.06609083e-04] [ 9.17990153e-05 -1.04849339e-04 -2.06609082e-04] [ 4.71251541e-05 -3.07224797e-04 -2.04789152e-04] [-4.71251536e-05 3.07224797e-04 -2.04789153e-04] [ 9.46412315e-05 -5.75395147e-05 1.47405749e-04] [-9.46412319e-05 5.75395155e-05 1.47405748e-04] [ 6.64947774e-05 -5.72515393e-06 2.15993568e-04] [-6.64947792e-05 5.72515069e-06 2.15993571e-04] [ 5.28308016e-05 1.38516756e-04 -6.35207636e-05] [-5.28308007e-05 -1.38516759e-04 -6.35207670e-05] [ 1.78620148e-04 5.70710400e-05 1.58929189e-05] [-1.78620148e-04 -5.70710405e-05 1.58929196e-05] [-2.21674434e-05 -1.87694050e-04 3.16223925e-05] [ 2.21674440e-05 1.87694050e-04 3.16223916e-05] [ 1.90830252e-04 -1.12845659e-04 3.86636942e-05] [-1.90830250e-04 1.12845662e-04 3.86636925e-05] [-4.74790834e-05 -1.07367666e-04 -9.61105300e-05] [ 4.74790816e-05 1.07367670e-04 -9.61105279e-05] [ 1.92982054e-04 -7.27205543e-05 -4.12194824e-05] [-1.92982054e-04 7.27205545e-05 -4.12194830e-05] [-2.25730127e-04 5.91867820e-05 1.45018615e-04] [ 2.25730128e-04 -5.91867819e-05 1.45018615e-04] [ 8.77334671e-05 3.46460764e-04 2.67425187e-04] [-8.77334709e-05 -3.46460768e-04 2.67425184e-04] [-7.42077640e-05 2.89215270e-05 -1.40435611e-04] [ 7.42077678e-05 -2.89215319e-05 -1.40435607e-04] [ 1.99281824e-04 1.12911887e-04 2.34310215e-04] [-1.99281825e-04 -1.12911887e-04 2.34310216e-04] [ 2.26907985e-04 -5.08737195e-05 -1.78066059e-04] [-2.26907984e-04 5.08737200e-05 -1.78066061e-04] [ 2.62585241e-04 1.44107187e-04 -1.02868931e-04] [-2.62585241e-04 -1.44107186e-04 -1.02868932e-04] [-6.77683414e-05 2.15756533e-04 -5.89838947e-05] [ 6.77683418e-05 -2.15756533e-04 -5.89838944e-05] [ 2.02456976e-04 1.80088912e-04 -2.32899592e-04] [-2.02456977e-04 -1.80088912e-04 -2.32899590e-04] [-5.39744645e-05 -1.16766206e-04 -1.20883956e-04] [ 5.39744642e-05 1.16766206e-04 -1.20883958e-04] [ 2.32902989e-04 4.09527740e-05 1.42236616e-05] [-2.32902988e-04 -4.09527772e-05 1.42236583e-05] [ 2.08372515e-04 3.96024511e-04 7.12758917e-06] [-2.08372515e-04 -3.96024511e-04 7.12759102e-06] [ 3.71190076e-05 1.55602478e-04 6.10214693e-05] [-3.71190077e-05 -1.55602477e-04 6.10214698e-05] [ 5.61872211e-06 9.66920019e-06 -7.75661839e-05] [-5.61872152e-06 -9.66920453e-06 -7.75661875e-05] [-1.86863976e-04 -2.73679314e-04 4.31805286e-05] [ 1.86863976e-04 2.73679331e-04 4.31805279e-05] [-7.51092284e-05 -3.55740057e-04 6.51411310e-05] [ 7.51092289e-05 3.55740057e-04 6.51411320e-05] [-2.26655913e-04 8.39213547e-05 -1.16289458e-04] [ 2.26655913e-04 -8.39213548e-05 -1.16289458e-04] [-5.81871413e-06 6.49886640e-05 -1.54471121e-05] [ 5.81871358e-06 -6.49886577e-05 -1.54471124e-05] [ 5.78448200e-05 2.43753489e-04 -1.17832654e-04] [-5.78448203e-05 -2.43753488e-04 -1.17832661e-04] [ 6.35084836e-05 -6.61500437e-05 2.05528143e-04] [-6.35084830e-05 6.61500458e-05 2.05528149e-04] [-1.71336770e-04 -9.37457450e-05 3.33185819e-05] [ 1.71336769e-04 9.37457442e-05 3.33185759e-05] [ 1.82807897e-04 3.64894043e-05 8.62410743e-05] [-1.82807896e-04 -3.64894047e-05 8.62410811e-05]] Final stress: [ 1.15000761e-05 1.96959395e-05 3.10565919e-06 1.73287163e-16 -6.47735466e-16 -5.10420031e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.18876151e-03 3.63685566e-04 1.14521754e-05] [ 1.18876150e-03 -3.63685693e-04 1.14522004e-05] [-1.27027111e-03 -1.88412332e-03 -2.90671076e-04] [ 1.27027111e-03 1.88412332e-03 -2.90671084e-04] [-1.07570209e-03 1.20497651e-04 8.59655583e-04] [ 1.07570209e-03 -1.20497651e-04 8.59655579e-04] [ 1.56280442e-03 2.11835469e-03 -2.46369463e-04] [-1.56280441e-03 -2.11835468e-03 -2.46369432e-04] [-4.35507708e-04 -9.37414380e-04 7.85461995e-04] [ 4.35507707e-04 9.37414381e-04 7.85461991e-04] [-1.29497268e-04 1.02792733e-04 -1.33054885e-03] [ 1.29497270e-04 -1.02792728e-04 -1.33054885e-03] [ 1.74378390e-03 -1.69299456e-04 9.29556951e-04] [-1.74378390e-03 1.69299462e-04 9.29556953e-04] [ 3.81135431e-03 2.22803308e-03 7.22226928e-04] [-3.81135431e-03 -2.22803303e-03 7.22226942e-04] [-4.32701401e-04 -1.53575694e-03 1.41159404e-03] [ 4.32701400e-04 1.53575694e-03 1.41159405e-03] [-6.86691379e-04 -2.14714390e-04 -6.43978783e-04] [ 6.86691382e-04 2.14714380e-04 -6.43978778e-04] [-2.29798270e-03 1.62193717e-03 -2.46387186e-05] [ 2.29798270e-03 -1.62193716e-03 -2.46387108e-05] [ 1.32384889e-03 4.50725958e-04 -7.73530150e-04] [-1.32384889e-03 -4.50725921e-04 -7.73530155e-04] [ 1.98809158e-04 -5.99343364e-04 -1.34216185e-04] [-1.98809160e-04 5.99343353e-04 -1.34216206e-04] [-6.42140808e-05 -2.30737258e-03 -1.81910387e-03] [ 6.42140840e-05 2.30737256e-03 -1.81910388e-03] [-1.47991443e-03 -4.99182634e-04 1.77591085e-03] [ 1.47991443e-03 4.99182628e-04 1.77591084e-03] [-3.78918772e-04 -1.10601839e-03 -1.05391405e-03] [ 3.78918772e-04 1.10601839e-03 -1.05391404e-03] [ 1.47293157e-03 7.65400188e-04 -1.41118677e-04] [-1.47293157e-03 -7.65400167e-04 -1.41118681e-04] [ 1.96378899e-03 -1.25480447e-03 2.68270575e-04] [-1.96378898e-03 1.25480448e-03 2.68270572e-04] [-8.27962795e-04 -9.36110657e-04 -2.49958935e-04] [ 8.27962795e-04 9.36110659e-04 -2.49958934e-04] [-8.91585909e-04 -6.47420677e-04 -1.60735949e-03] [ 8.91585900e-04 6.47420686e-04 -1.60735947e-03] [ 4.17509055e-05 4.07228974e-04 1.36012762e-03] [-4.17509101e-05 -4.07228965e-04 1.36012761e-03] [ 7.00159243e-04 2.68011590e-04 1.26874676e-03] [-7.00159241e-04 -2.68011589e-04 1.26874676e-03] [ 2.05299439e-04 2.68394411e-03 -1.45412170e-03] [-2.05299440e-04 -2.68394410e-03 -1.45412170e-03] [ 2.61797788e-04 -8.89158300e-04 -4.81453863e-04] [-2.61797798e-04 8.89158292e-04 -4.81453853e-04] [ 2.80966108e-04 -2.39307133e-05 1.90501589e-03] [-2.80966097e-04 2.39307054e-05 1.90501588e-03] [-2.96168251e-04 1.35574310e-03 1.40940983e-04] [ 2.96168253e-04 -1.35574310e-03 1.40940977e-04] [ 1.19742186e-03 -5.56213298e-04 6.51390402e-05] [-1.19742186e-03 5.56213298e-04 6.51390400e-05] [ 3.18560880e-04 8.81583422e-04 -6.16558143e-04] [-3.18560882e-04 -8.81583413e-04 -6.16558145e-04] [ 1.22962250e-03 1.45500391e-03 3.01219241e-04] [-1.22962251e-03 -1.45500390e-03 3.01219241e-04] [-1.79119639e-03 -2.07106591e-04 1.11090196e-03] [ 1.79119639e-03 2.07106592e-04 1.11090196e-03] [ 1.32076520e-03 5.18457381e-04 -3.96644476e-04] [-1.32076520e-03 -5.18457384e-04 -3.96644474e-04] [-4.19240361e-04 -1.10223920e-04 -1.33857603e-03] [ 4.19240349e-04 1.10223896e-04 -1.33857605e-03] [ 4.24927120e-04 -2.73326536e-03 1.97707159e-03] [-4.24927112e-04 2.73326534e-03 1.97707161e-03] [ 1.20314525e-03 7.51672609e-04 -1.34503273e-03] [-1.20314525e-03 -7.51672612e-04 -1.34503274e-03] [ 1.68551993e-03 -5.94883118e-04 1.46895718e-03] [-1.68551993e-03 5.94883118e-04 1.46895719e-03] [-2.25889034e-04 -1.50779495e-03 -5.96515248e-04] [ 2.25889037e-04 1.50779493e-03 -5.96515243e-04] [ 1.83092935e-03 -1.27150083e-03 -4.68242241e-04] [-1.83092936e-03 1.27150081e-03 -4.68242244e-04] [-5.58801417e-04 8.92123351e-04 -8.53767642e-04] [ 5.58801413e-04 -8.92123354e-04 -8.53767642e-04] [ 1.11278222e-03 -1.20510746e-03 -1.57084776e-03] [-1.11278221e-03 1.20510746e-03 -1.57084776e-03] [-2.05599409e-03 1.23590454e-04 4.74576538e-04] [ 2.05599409e-03 -1.23590445e-04 4.74576542e-04] [-1.63432000e-03 2.98879296e-03 1.75948659e-04] [ 1.63432000e-03 -2.98879296e-03 1.75948665e-04] [-7.51732250e-05 1.01551675e-03 7.85457835e-04] [ 7.51732257e-05 -1.01551675e-03 7.85457837e-04] [-4.02202564e-04 4.26789196e-04 -1.00856171e-03] [ 4.02202564e-04 -4.26789203e-04 -1.00856171e-03] [ 1.40865086e-03 -2.67584830e-03 1.73552627e-04] [-1.40865086e-03 2.67584839e-03 1.73552622e-04] [ 6.62514722e-04 -2.67345877e-03 3.63179036e-04] [-6.62514722e-04 2.67345877e-03 3.63179041e-04] [ 1.61816719e-03 7.70693664e-04 -1.19058582e-03] [-1.61816719e-03 -7.70693667e-04 -1.19058582e-03] [ 2.78758098e-04 1.95727997e-04 -9.07051369e-05] [-2.78758088e-04 -1.95728027e-04 -9.07051382e-05] [ 6.43042046e-04 5.65378859e-04 1.71183025e-03] [-6.43042059e-04 -5.65378841e-04 1.71183023e-03] [ 2.34492454e-04 -1.85861416e-03 -1.01207191e-03] [-2.34492445e-04 1.85861418e-03 -1.01207188e-03] [ 1.18305176e-03 -2.66939384e-04 6.14483307e-04] [-1.18305176e-03 2.66939380e-04 6.14483313e-04] [-1.37666207e-03 9.49239463e-04 7.78150160e-05] [ 1.37666207e-03 -9.49239470e-04 7.78150067e-05]] Final stress: [ 2.55154892e-06 2.14116158e-05 -4.32002920e-05 -1.13329805e-14 -3.10960827e-15 4.57303731e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 9.68883851e-05 1.19216608e-04 8.52290089e-05] [-9.68883848e-05 -1.19216605e-04 8.52290086e-05] [ 2.77791829e-04 2.61758756e-04 2.47041881e-05] [-2.77791829e-04 -2.61758756e-04 2.47041881e-05] [ 8.93456705e-06 -3.09179673e-04 -2.33201318e-04] [-8.93456690e-06 3.09179672e-04 -2.33201319e-04] [-4.69047190e-04 -4.29912975e-04 -2.45448860e-04] [ 4.69047189e-04 4.29912977e-04 -2.45448857e-04] [-2.99947718e-05 2.25518394e-04 -1.77530921e-04] [ 2.99947709e-05 -2.25518395e-04 -1.77530921e-04] [ 8.71543001e-05 5.20329743e-05 3.55740823e-04] [-8.71542997e-05 -5.20329740e-05 3.55740823e-04] [-3.40024929e-04 -1.27716599e-05 -3.39052425e-04] [ 3.40024930e-04 1.27716613e-05 -3.39052424e-04] [-3.27877374e-04 -2.43692858e-06 -9.94218874e-04] [ 3.27877375e-04 2.43692610e-06 -9.94218873e-04] [-1.44738710e-04 4.38163896e-04 -4.27091377e-04] [ 1.44738711e-04 -4.38163896e-04 -4.27091377e-04] [ 1.79461336e-04 -1.14224031e-04 3.97415566e-04] [-1.79461336e-04 1.14224031e-04 3.97415566e-04] [ 7.15572871e-04 -2.07234199e-04 1.47852317e-04] [-7.15572871e-04 2.07234198e-04 1.47852318e-04] [-6.22627588e-04 2.50632682e-04 1.55103042e-04] [ 6.22627588e-04 -2.50632682e-04 1.55103043e-04] [ 2.67353962e-04 4.52229996e-04 -3.46795187e-04] [-2.67353963e-04 -4.52229998e-04 -3.46795189e-04] [-2.61742773e-06 -6.50058569e-05 1.06176465e-03] [ 2.61742821e-06 6.50058563e-05 1.06176465e-03] [ 2.66750227e-04 1.39569334e-04 -1.72124415e-04] [-2.66750227e-04 -1.39569335e-04 -1.72124415e-04] [-1.34075272e-05 3.18421692e-04 1.69896978e-04] [ 1.34075277e-05 -3.18421693e-04 1.69896979e-04] [-4.52759580e-04 -3.31491754e-04 -7.21224076e-05] [ 4.52759580e-04 3.31491754e-04 -7.21224077e-05] [-2.72340132e-04 -5.35110513e-05 -2.81260376e-05] [ 2.72340132e-04 5.35110507e-05 -2.81260378e-05] [ 1.24970061e-04 3.29959008e-04 3.12795426e-04] [-1.24970062e-04 -3.29959008e-04 3.12795426e-04] [-3.42371516e-04 -6.75626987e-06 5.73851135e-04] [ 3.42371516e-04 6.75626817e-06 5.73851134e-04] [ 2.47220167e-04 7.44541868e-05 -1.14348846e-04] [-2.47220168e-04 -7.44541883e-05 -1.14348845e-04] [-2.46336244e-04 -3.85927763e-04 -4.22926479e-04] [ 2.46336243e-04 3.85927763e-04 -4.22926478e-04] [ 4.47177901e-05 -5.14966242e-04 2.92266207e-04] [-4.47177898e-05 5.14966242e-04 2.92266207e-04] [-1.48838567e-04 6.18394138e-04 1.26726812e-04] [ 1.48838566e-04 -6.18394139e-04 1.26726811e-04] [ 2.64006160e-04 -1.23551853e-05 -3.44584441e-04] [-2.64006158e-04 1.23551852e-05 -3.44584443e-04] [ 3.83838168e-04 -1.35790169e-04 -1.65713643e-04] [-3.83838169e-04 1.35790169e-04 -1.65713643e-04] [-1.58711736e-04 -1.18167171e-04 -1.10398998e-04] [ 1.58711737e-04 1.18167169e-04 -1.10398998e-04] [ 4.78500829e-04 -6.39103450e-05 1.17516344e-04] [-4.78500832e-04 6.39103436e-05 1.17516345e-04] [-4.70656362e-04 3.86207677e-04 -4.54091042e-04] [ 4.70656360e-04 -3.86207674e-04 -4.54091041e-04] [ 2.86626804e-04 3.39656806e-04 -1.82341943e-04] [-2.86626804e-04 -3.39656806e-04 -1.82341943e-04] [-2.86815932e-04 -2.68235513e-04 1.88967813e-05] [ 2.86815932e-04 2.68235513e-04 1.88967817e-05] [ 3.21656840e-04 1.82880357e-04 4.58484595e-04] [-3.21656838e-04 -1.82880356e-04 4.58484596e-04] [-1.06669304e-04 1.05901100e-04 -1.20753677e-03] [ 1.06669303e-04 -1.05901100e-04 -1.20753677e-03] [-4.18046722e-04 -1.42809896e-04 1.60253692e-04] [ 4.18046721e-04 1.42809895e-04 1.60253692e-04] [-4.18566924e-05 3.41804759e-04 -4.35218963e-04] [ 4.18566936e-05 -3.41804758e-04 -4.35218962e-04] [ 1.02416797e-03 -1.49184825e-04 -9.06658417e-05] [-1.02416798e-03 1.49184827e-04 -9.06658416e-05] [-1.18082821e-03 -4.98307467e-04 4.83978251e-04] [ 1.18082821e-03 4.98307467e-04 4.83978250e-04] [ 3.49399525e-04 -1.53614938e-04 1.61941360e-04] [-3.49399525e-04 1.53614938e-04 1.61941361e-04] [-3.48667499e-04 2.29344538e-04 7.35807095e-04] [ 3.48667499e-04 -2.29344539e-04 7.35807094e-04] [-1.53147669e-04 -2.70040001e-04 1.39248541e-04] [ 1.53147670e-04 2.70040003e-04 1.39248541e-04] [-8.95923249e-05 -7.14275258e-04 -7.62591341e-05] [ 8.95923254e-05 7.14275259e-04 -7.62591344e-05] [-5.63577380e-05 -1.35097115e-04 -1.12223946e-04] [ 5.63577386e-05 1.35097115e-04 -1.12223947e-04] [-4.05253546e-04 -5.31948405e-05 2.10473641e-05] [ 4.05253548e-04 5.31948391e-05 2.10473619e-05] [ 3.02823876e-04 -2.03852843e-04 3.94303588e-05] [-3.02823878e-04 2.03852842e-04 3.94303592e-05] [ 2.88905897e-04 4.81873210e-04 -1.38731907e-04] [-2.88905897e-04 -4.81873210e-04 -1.38731908e-04] [-5.78897254e-04 -3.93143408e-04 2.88008530e-04] [ 5.78897254e-04 3.93143409e-04 2.88008529e-04] [ 1.94594733e-04 1.75988864e-04 6.01866466e-05] [-1.94594731e-04 -1.75988862e-04 6.01866469e-05] [ 1.94505325e-04 -5.43225479e-04 2.14137026e-04] [-1.94505325e-04 5.43225478e-04 2.14137025e-04] [-9.07054897e-05 -1.42482493e-04 2.99897670e-04] [ 9.07054891e-05 1.42482492e-04 2.99897670e-04] [-3.85600941e-04 -2.13451908e-05 -8.95964495e-05] [ 3.85600942e-04 2.13451931e-05 -8.95964477e-05] [ 2.65899136e-04 6.97778945e-05 7.81698211e-05] [-2.65899136e-04 -6.97778946e-05 7.81698221e-05]] Final stress: [-1.37859172e-05 -2.04930124e-05 -1.37554015e-05 -4.93115688e-15 7.02743637e-16 -6.84579853e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.33993990e-04 1.54711664e-04 1.16349060e-04] [ 1.33993991e-04 -1.54711655e-04 1.16349058e-04] [-3.73056678e-04 3.78928582e-04 3.76225755e-05] [ 3.73056678e-04 -3.78928584e-04 3.76225763e-05] [-2.92088886e-05 -4.27504837e-04 -3.21471280e-04] [ 2.92088879e-05 4.27504837e-04 -3.21471280e-04] [ 6.36036118e-04 -5.96200076e-04 -3.21540694e-04] [-6.36036120e-04 5.96200073e-04 -3.21540697e-04] [ 4.48012433e-05 3.17377560e-04 -2.50603066e-04] [-4.48012427e-05 -3.17377557e-04 -2.50603067e-04] [-9.42381600e-05 8.00983066e-05 4.77775265e-04] [ 9.42381596e-05 -8.00983084e-05 4.77775266e-04] [ 4.34246336e-04 -3.19240860e-05 -4.59256547e-04] [-4.34246335e-04 3.19240853e-05 -4.59256547e-04] [ 4.29313497e-04 -5.43671017e-06 -1.33733121e-03] [-4.29313497e-04 5.43670518e-06 -1.33733121e-03] [ 2.25195491e-04 6.03592856e-04 -5.90210276e-04] [-2.25195489e-04 -6.03592856e-04 -5.90210276e-04] [-2.49359955e-04 -1.42389168e-04 5.34743628e-04] [ 2.49359956e-04 1.42389169e-04 5.34743629e-04] [-9.85187268e-04 -2.98899595e-04 2.07486000e-04] [ 9.85187269e-04 2.98899595e-04 2.07485999e-04] [ 8.54529818e-04 3.04958807e-04 1.96938345e-04] [-8.54529816e-04 -3.04958799e-04 1.96938342e-04] [-3.94148938e-04 6.28310347e-04 -5.09774293e-04] [ 3.94148937e-04 -6.28310348e-04 -5.09774292e-04] [ 2.79291163e-07 -6.35769362e-05 1.42926595e-03] [-2.79292233e-07 6.35769368e-05 1.42926595e-03] [-3.89309305e-04 2.09947279e-04 -2.31373918e-04] [ 3.89309303e-04 -2.09947281e-04 -2.31373917e-04] [ 4.69850332e-05 4.17193830e-04 2.20128130e-04] [-4.69850314e-05 -4.17193829e-04 2.20128130e-04] [ 6.24719121e-04 -4.71166822e-04 -9.16333764e-05] [-6.24719121e-04 4.71166820e-04 -9.16333751e-05] [ 1.48413475e-04 -4.56909844e-04 4.32488241e-04] [-1.48413474e-04 4.56909844e-04 4.32488241e-04] [-3.71067286e-04 4.92039673e-05 -3.50890685e-05] [ 3.71067286e-04 -4.92039679e-05 -3.50890691e-05] [ 3.44667618e-04 -1.13307561e-04 -1.44985868e-04] [-3.44667618e-04 1.13307563e-04 -1.44985868e-04] [-4.87638415e-04 -8.78755174e-06 7.70238681e-04] [ 4.87638420e-04 8.78755554e-06 7.70238678e-04] [ 5.44077090e-05 6.87781787e-04 4.17088556e-04] [-5.44077092e-05 -6.87781786e-04 4.17088555e-04] [-3.38257077e-04 5.33204401e-04 -5.74266038e-04] [ 3.38257077e-04 -5.33204400e-04 -5.74266038e-04] [ 3.32100717e-04 3.07605443e-05 -4.48921813e-04] [-3.32100715e-04 -3.07605423e-05 -4.48921813e-04] [-2.29174519e-04 -8.20745722e-04 1.49104069e-04] [ 2.29174519e-04 8.20745724e-04 1.49104071e-04] [-2.17141735e-04 1.38753749e-04 -1.57627615e-04] [ 2.17141735e-04 -1.38753748e-04 -1.57627615e-04] [ 5.05892569e-04 1.76278739e-04 -2.12716303e-04] [-5.05892568e-04 -1.76278738e-04 -2.12716303e-04] [-6.73950256e-04 -5.41415936e-04 -6.28315457e-04] [ 6.73950257e-04 5.41415937e-04 -6.28315457e-04] [ 6.87017724e-04 4.72772377e-05 1.95216995e-04] [-6.87017724e-04 -4.72772372e-05 1.95216997e-04] [-3.87204245e-04 3.74145502e-04 2.89030959e-05] [ 3.87204243e-04 -3.74145503e-04 2.89030965e-05] [ 3.67917482e-04 -4.64564192e-04 -2.64128817e-04] [-3.67917481e-04 4.64564191e-04 -2.64128818e-04] [-1.56385143e-04 -1.55347535e-04 -1.63126647e-03] [ 1.56385145e-04 1.55347537e-04 -1.63126647e-03] [ 4.34823728e-04 -2.28316626e-04 6.26169087e-04] [-4.34823730e-04 2.28316625e-04 6.26169086e-04] [-4.09538769e-05 -4.88616226e-04 -6.04470603e-04] [ 4.09538766e-05 4.88616224e-04 -6.04470602e-04] [-5.98424626e-04 1.56200473e-04 2.61515843e-04] [ 5.98424626e-04 -1.56200471e-04 2.61515843e-04] [-1.63180288e-03 6.79777741e-04 6.47501498e-04] [ 1.63180288e-03 -6.79777738e-04 6.47501497e-04] [ 1.40737437e-03 2.14649718e-04 -1.33987560e-04] [-1.40737437e-03 -2.14649715e-04 -1.33987560e-04] [-5.01117921e-04 -3.27517820e-04 9.66787368e-04] [ 5.01117920e-04 3.27517820e-04 9.66787369e-04] [ 4.86909939e-04 2.11202317e-04 2.20394253e-04] [-4.86909941e-04 -2.11202316e-04 2.20394253e-04] [ 2.16416167e-04 -3.74978851e-04 2.04596567e-04] [-2.16416166e-04 3.74978850e-04 2.04596567e-04] [ 1.22180701e-04 -9.83280495e-04 -8.94529597e-05] [-1.22180702e-04 9.83280495e-04 -8.94529606e-05] [ 5.59478095e-05 -1.96224047e-04 -1.45730587e-04] [-5.59478095e-05 1.96224047e-04 -1.45730587e-04] [ 5.89687493e-04 -6.70070787e-05 3.00812038e-05] [-5.89687492e-04 6.70070792e-05 3.00812041e-05] [-3.90287766e-04 -2.56262031e-04 3.58976501e-05] [ 3.90287764e-04 2.56262026e-04 3.58976506e-05] [-3.91799899e-04 6.65789703e-04 -2.06792825e-04] [ 3.91799900e-04 -6.65789703e-04 -2.06792824e-04] [ 7.96366232e-04 -5.31848964e-04 3.70418548e-04] [-7.96366232e-04 5.31848964e-04 3.70418548e-04] [-3.04654052e-04 2.39346590e-04 9.10910522e-05] [ 3.04654049e-04 -2.39346600e-04 9.10910520e-05] [-1.36247783e-04 1.64635561e-04 4.04397050e-04] [ 1.36247784e-04 -1.64635563e-04 4.04397049e-04] [ 2.52177949e-04 7.10235176e-04 2.97671560e-04] [-2.52177948e-04 -7.10235179e-04 2.97671556e-04] [ 3.33660920e-04 -1.35836496e-04 1.14647071e-04] [-3.33660921e-04 1.35836494e-04 1.14647072e-04] [-5.34828889e-04 -3.52469979e-05 -9.35706906e-05] [ 5.34828889e-04 3.52469968e-05 -9.35706921e-05]] Final stress: [-1.37615194e-05 -1.89754797e-05 -1.34466329e-05 -2.30064881e-15 -7.37880819e-15 9.71652303e-06] Minimization converged after 21 steps. Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. Minimization converged after 19 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 120 steps. Minimization converged after 118 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.46875477e-04 2.30747348e-03 1.14009486e-03] [ 1.46875477e-04 -2.30747353e-03 1.14009488e-03] [-2.15735006e-04 2.60723886e-04 -9.74186388e-04] [ 2.15735007e-04 -2.60723881e-04 -9.74186394e-04] [ 5.95527900e-04 -1.09568994e-03 -1.50991382e-05] [-5.95527900e-04 1.09568995e-03 -1.50991348e-05] [-1.26227956e-04 -7.99211050e-05 1.19355543e-03] [ 1.26227955e-04 7.99211200e-05 1.19355545e-03] [ 5.05514024e-04 -5.65739157e-04 -1.16194131e-03] [-5.05514023e-04 5.65739155e-04 -1.16194131e-03] [-2.63657996e-04 1.45075853e-04 1.07692547e-04] [ 2.63657995e-04 -1.45075849e-04 1.07692548e-04] [-6.35877281e-04 6.10524952e-04 -3.03820469e-04] [ 6.35877281e-04 -6.10524959e-04 -3.03820476e-04] [-2.48471749e-03 -1.03075013e-03 -1.72140715e-03] [ 2.48471749e-03 1.03075015e-03 -1.72140714e-03] [ 1.12506516e-03 4.35097129e-05 -3.33918876e-04] [-1.12506515e-03 -4.35097146e-05 -3.33918876e-04] [ 7.92394803e-04 -1.22040398e-04 4.11096418e-04] [-7.92394804e-04 1.22040388e-04 4.11096414e-04] [ 3.16620713e-05 6.07942967e-04 2.90409801e-04] [-3.16620717e-05 -6.07942965e-04 2.90409801e-04] [-3.42255832e-04 3.90054374e-03 4.84857062e-04] [ 3.42255833e-04 -3.90054379e-03 4.84857076e-04] [-3.47589110e-04 3.56477972e-04 1.48094873e-04] [ 3.47589112e-04 -3.56477960e-04 1.48094888e-04] [ 2.79701939e-04 -8.13367435e-04 1.69481648e-03] [-2.79701939e-04 8.13367441e-04 1.69481649e-03] [ 2.48365011e-04 -1.37503949e-03 1.62386565e-03] [-2.48365016e-04 1.37503948e-03 1.62386564e-03] [ 7.25160341e-04 1.13552666e-03 3.90713822e-05] [-7.25160341e-04 -1.13552666e-03 3.90713796e-05] [ 9.71975356e-04 -8.98249815e-04 1.57457452e-04] [-9.71975356e-04 8.98249827e-04 1.57457445e-04] [-2.16331123e-04 -5.74660089e-04 6.62609392e-04] [ 2.16331122e-04 5.74660092e-04 6.62609390e-04] [-5.93494817e-04 3.82894116e-04 2.25175427e-04] [ 5.93494817e-04 -3.82894111e-04 2.25175428e-04] [ 6.19647044e-04 2.38593911e-04 -1.11076877e-03] [-6.19647032e-04 -2.38593922e-04 -1.11076878e-03] [-1.92674619e-04 -5.20825163e-05 -3.19154727e-04] [ 1.92674610e-04 5.20825076e-05 -3.19154724e-04] [ 3.40288082e-04 -7.47680932e-04 -1.83866703e-04] [-3.40288081e-04 7.47680936e-04 -1.83866703e-04] [-3.73462671e-04 -1.33122001e-04 -9.25048138e-04] [ 3.73462670e-04 1.33122007e-04 -9.25048138e-04] [ 5.67518164e-04 -2.32174586e-04 -5.95127753e-05] [-5.67518163e-04 2.32174575e-04 -5.95127638e-05] [ 4.20165548e-04 -1.16089349e-03 1.99796681e-03] [-4.20165548e-04 1.16089348e-03 1.99796680e-03] [ 6.39073436e-04 2.29683331e-04 2.83007005e-04] [-6.39073435e-04 -2.29683329e-04 2.83007007e-04] [-2.28996536e-04 3.96411113e-04 -7.44203664e-04] [ 2.28996535e-04 -3.96411112e-04 -7.44203663e-04] [-3.50964175e-04 -2.13896487e-03 -8.59743531e-04] [ 3.50964175e-04 2.13896487e-03 -8.59743534e-04] [ 1.02784006e-03 4.64969941e-04 -5.99726653e-04] [-1.02784005e-03 -4.64969942e-04 -5.99726650e-04] [ 7.18154772e-04 -7.32559434e-05 3.51112766e-04] [-7.18154774e-04 7.32559466e-05 3.51112766e-04] [-4.48926250e-04 -1.36118865e-03 1.14303639e-03] [ 4.48926250e-04 1.36118865e-03 1.14303639e-03] [ 3.66444641e-04 1.05441143e-03 -1.86193441e-03] [-3.66444652e-04 -1.05441144e-03 -1.86193441e-03] [ 1.70172455e-03 -7.27272989e-04 7.68600642e-04] [-1.70172454e-03 7.27272977e-04 7.68600647e-04] [ 6.84919671e-04 2.63701115e-04 -2.25916915e-04] [-6.84919669e-04 -2.63701114e-04 -2.25916915e-04] [-1.75035965e-03 -1.19707390e-03 -1.02991103e-03] [ 1.75035965e-03 1.19707390e-03 -1.02991103e-03] [-6.90516780e-04 2.40115440e-04 2.01382276e-03] [ 6.90516782e-04 -2.40115441e-04 2.01382276e-03] [ 1.22220223e-03 -1.10434115e-03 -1.07247559e-03] [-1.22220223e-03 1.10434115e-03 -1.07247559e-03] [-6.21562089e-04 -5.65802657e-04 5.33417987e-04] [ 6.21562091e-04 5.65802656e-04 5.33417992e-04] [-1.41154307e-03 1.48249530e-04 -6.54360356e-04] [ 1.41154307e-03 -1.48249530e-04 -6.54360361e-04] [ 2.13383431e-03 -2.02703628e-04 4.16482541e-04] [-2.13383431e-03 2.02703625e-04 4.16482534e-04] [ 1.89585296e-03 -8.55276843e-05 -4.45487044e-05] [-1.89585296e-03 8.55276820e-05 -4.45487017e-05] [-2.96312760e-04 5.16232977e-04 1.05262288e-03] [ 2.96312759e-04 -5.16232976e-04 1.05262288e-03] [ 1.63428088e-03 5.07149400e-04 -1.32902937e-03] [-1.63428088e-03 -5.07149406e-04 -1.32902938e-03] [-7.57766764e-04 -2.30676192e-03 3.21820085e-04] [ 7.57766764e-04 2.30676197e-03 3.21820084e-04] [-1.74009410e-03 3.41186527e-05 5.82651579e-04] [ 1.74009410e-03 -3.41186550e-05 5.82651582e-04] [ 9.56528528e-04 4.98993641e-04 -3.57283525e-05] [-9.56528532e-04 -4.98993641e-04 -3.57283477e-05] [-3.44391897e-04 -2.30641632e-03 -2.50374433e-04] [ 3.44391895e-04 2.30641636e-03 -2.50374434e-04] [-7.45100069e-04 1.22039056e-03 -8.73242446e-04] [ 7.45100068e-04 -1.22039056e-03 -8.73242465e-04] [ 1.54978872e-03 9.24273190e-04 -2.06740996e-04] [-1.54978872e-03 -9.24273185e-04 -2.06740980e-04] [ 9.14007273e-05 -5.79581019e-04 -7.07777232e-04] [-9.14007268e-05 5.79581024e-04 -7.07777248e-04] [ 3.74752882e-05 1.09459879e-03 -3.89001113e-05] [-3.74752904e-05 -1.09459878e-03 -3.89000978e-05]] Final stress: [-1.19365453e-05 -3.40880239e-06 -6.60729951e-05 -4.28936550e-15 3.63084213e-15 -5.33423577e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 2.05257969e-04 6.83182340e-04 8.71758812e-04] [-2.05257968e-04 -6.83182367e-04 8.71758814e-04] [ 2.52231844e-04 5.79850449e-04 -8.58926214e-04] [-2.52231843e-04 -5.79850458e-04 -8.58926210e-04] [-7.98976496e-04 -1.29681393e-03 -2.56359923e-04] [ 7.98976496e-04 1.29681393e-03 -2.56359929e-04] [ 1.86589813e-04 2.35088603e-04 8.21430357e-04] [-1.86589811e-04 -2.35088610e-04 8.21430359e-04] [-6.62901861e-04 -7.05264235e-04 -1.26888090e-03] [ 6.62901860e-04 7.05264230e-04 -1.26888089e-03] [ 4.10932938e-04 2.89786689e-04 -1.02247370e-04] [-4.10932938e-04 -2.89786689e-04 -1.02247365e-04] [ 7.22805411e-04 6.44744602e-04 -7.28560119e-04] [-7.22805409e-04 -6.44744593e-04 -7.28560117e-04] [ 3.15665746e-03 -6.45461357e-04 -2.37079918e-03] [-3.15665746e-03 6.45461372e-04 -2.37079917e-03] [-1.18976504e-03 5.46045841e-06 -4.08343703e-04] [ 1.18976503e-03 -5.46045774e-06 -4.08343701e-04] [-1.12348707e-03 -3.72886354e-04 5.89243012e-04] [ 1.12348707e-03 3.72886357e-04 5.89243020e-04] [-1.50811931e-04 7.96935160e-04 5.68669720e-04] [ 1.50811932e-04 -7.96935157e-04 5.68669721e-04] [ 4.41649523e-04 2.19991091e-03 8.47306563e-05] [-4.41649522e-04 -2.19991082e-03 8.47306393e-05] [ 4.00508458e-04 3.67074836e-04 -5.97708694e-04] [-4.00508458e-04 -3.67074849e-04 -5.97708718e-04] [-3.88177536e-04 -2.80280092e-04 1.99303093e-03] [ 3.88177534e-04 2.80280070e-04 1.99303092e-03] [-4.20915015e-04 -1.55525956e-03 1.97921142e-03] [ 4.20915018e-04 1.55525956e-03 1.97921142e-03] [-7.49393634e-04 1.41206066e-03 -2.17525621e-04] [ 7.49393632e-04 -1.41206066e-03 -2.17525615e-04] [-1.14252376e-03 -7.55685415e-04 3.95568715e-04] [ 1.14252376e-03 7.55685417e-04 3.95568718e-04] [-6.46466396e-04 -5.49314863e-04 3.13463964e-04] [ 6.46466398e-04 5.49314864e-04 3.13463962e-04] [-1.54728908e-04 6.32009882e-04 8.55357541e-04] [ 1.54728907e-04 -6.32009879e-04 8.55357543e-04] [-7.02903705e-05 -5.33551921e-04 1.79143144e-04] [ 7.02903570e-05 5.33551939e-04 1.79143160e-04] [ 8.90711068e-04 1.95170182e-04 -8.70630776e-04] [-8.90711059e-04 -1.95170164e-04 -8.70630792e-04] [-3.91651428e-04 4.34589477e-05 -1.06860398e-03] [ 3.91651427e-04 -4.34589455e-05 -1.06860398e-03] [ 5.23271577e-04 1.17574891e-03 -2.47200527e-04] [-5.23271578e-04 -1.17574891e-03 -2.47200529e-04] [ 4.88735801e-04 1.03419432e-03 1.72738356e-03] [-4.88735810e-04 -1.03419431e-03 1.72738355e-03] [ 7.25834106e-04 7.87609589e-04 -6.29696510e-04] [-7.25834097e-04 -7.87609582e-04 -6.29696504e-04] [-3.48297476e-04 -2.47961835e-04 -9.35787922e-04] [ 3.48297476e-04 2.47961831e-04 -9.35787924e-04] [ 7.77415654e-04 -4.54330635e-04 3.82312501e-04] [-7.77415656e-04 4.54330633e-04 3.82312505e-04] [ 1.26085039e-03 -1.58505727e-05 -6.90423460e-04] [-1.26085038e-03 1.58505776e-05 -6.90423459e-04] [ 1.66129297e-04 1.98870696e-03 -7.96466837e-04] [-1.66129296e-04 -1.98870695e-03 -7.96466836e-04] [-6.04129258e-04 1.73565645e-03 1.48365689e-03] [ 6.04129259e-04 -1.73565646e-03 1.48365689e-03] [ 9.69988573e-04 7.71353858e-05 4.10435385e-04] [-9.69988574e-04 -7.71353914e-05 4.10435384e-04] [ 1.81604768e-03 3.59690517e-04 1.59037482e-03] [-1.81604768e-03 -3.59690523e-04 1.59037481e-03] [ 2.99636673e-04 -7.65289849e-04 -1.70689011e-03] [-2.99636673e-04 7.65289845e-04 -1.70689010e-03] [-2.20231433e-03 1.39727798e-03 -1.59017316e-03] [ 2.20231432e-03 -1.39727797e-03 -1.59017317e-03] [ 8.05403321e-04 -4.65227960e-04 -1.82635078e-04] [-8.05403321e-04 4.65227959e-04 -1.82635076e-04] [ 1.30253064e-03 1.69131755e-03 -1.26500321e-03] [-1.30253063e-03 -1.69131756e-03 -1.26500320e-03] [-4.64521659e-04 -1.54379450e-04 2.36813265e-03] [ 4.64521658e-04 1.54379442e-04 2.36813265e-03] [-1.70279189e-03 -1.46329056e-04 -1.08599530e-03] [ 1.70279189e-03 1.46329058e-04 -1.08599531e-03] [-5.68677018e-04 7.36612023e-04 4.39392815e-04] [ 5.68677017e-04 -7.36612023e-04 4.39392811e-04] [-2.48727831e-03 -3.55775552e-04 6.90878155e-04] [ 2.48727831e-03 3.55775558e-04 6.90878162e-04] [-2.48352443e-03 -1.95632452e-04 2.69451973e-05] [ 2.48352444e-03 1.95632454e-04 2.69451975e-05] [ 2.90372675e-04 6.39626533e-04 1.14605434e-03] [-2.90372676e-04 -6.39626534e-04 1.14605434e-03] [-1.79742996e-03 2.25818545e-04 -1.33147013e-03] [ 1.79742996e-03 -2.25818545e-04 -1.33147013e-03] [ 1.14970238e-03 -1.19084400e-03 4.40431291e-04] [-1.14970238e-03 1.19084402e-03 4.40431289e-04] [ 2.19393590e-03 -8.22513039e-05 7.02272171e-04] [-2.19393590e-03 8.22513064e-05 7.02272166e-04] [-1.16433649e-03 5.69438686e-04 -9.87808269e-05] [ 1.16433649e-03 -5.69438689e-04 -9.87808274e-05] [ 2.88240308e-04 -8.57193368e-04 -1.44812509e-04] [-2.88240307e-04 8.57193297e-04 -1.44812510e-04] [ 1.78562067e-03 -8.10436888e-04 1.49780628e-04] [-1.78562067e-03 8.10436895e-04 1.49780633e-04] [-9.93399317e-04 -1.76334378e-03 -6.13089622e-04] [ 9.93399318e-04 1.76334379e-03 -6.13089625e-04] [ 2.53396958e-04 -9.31967988e-04 3.87295655e-04] [-2.53396961e-04 9.31967981e-04 3.87295672e-04] [ 2.07755691e-04 7.87272514e-05 -5.29942644e-04] [-2.07755688e-04 -7.87272605e-05 -5.29942661e-04]] Final stress: [-1.37227197e-05 9.48735564e-07 -8.09144990e-05 -4.09455732e-15 -2.10584063e-15 7.09038869e-05] Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-5.42520667e-05 6.58481072e-04 -7.25777621e-04] [ 2.94898534e-04 -8.07834517e-04 -3.15126169e-04] [ 1.21364230e-03 -1.06932178e-03 -2.53670631e-04] [-1.31059091e-03 -1.78660809e-03 -2.65792830e-04] [ 2.07776193e-03 -3.67378674e-04 -5.32137340e-03] [-2.30984498e-03 1.01684222e-03 4.96515091e-03] [-1.90064847e-03 2.75452901e-03 1.12744393e-03] [ 1.81203167e-03 1.47767342e-03 -2.15082930e-03] [-4.55171989e-04 -3.52808708e-03 1.15279228e-03] [ 5.14332341e-04 -4.05113411e-03 -1.20746138e-03] [ 1.46994465e-03 -1.00725792e-03 5.37110389e-03] [-1.49277424e-03 -1.77717574e-03 -5.77699859e-03] [-1.19647903e-03 2.59698090e-03 1.37841931e-03] [ 1.16189275e-03 2.69738866e-03 -1.99083419e-03] [-4.38729426e-03 -1.07936581e-03 2.92034112e-03] [ 4.43404340e-03 -1.38726547e-03 -1.03816460e-03] [-5.71582214e-05 2.01246283e-04 1.00685336e-03] [ 2.40063960e-04 -2.00373989e-04 -1.81026043e-03] [ 5.76651885e-05 -3.37831460e-03 -4.42943660e-04] [-3.06569520e-05 -2.55057595e-03 1.40435290e-03] [ 4.23456530e-03 2.79714069e-03 1.32789381e-03] [-4.23195809e-03 2.81940792e-03 -1.45918883e-03] [-2.00971159e-03 -1.38975891e-03 -3.36065600e-04] [ 1.96210348e-03 -1.55155262e-03 1.34554887e-03] [-6.81853781e-05 -5.82332113e-03 -2.84279413e-03] [ 1.39158840e-04 -3.01406533e-03 3.35076065e-03] [-6.48356516e-04 -7.69936966e-04 -5.64907733e-03] [ 6.26128614e-04 -2.06018250e-04 3.61404447e-03] [ 1.87686020e-03 4.00223912e-03 6.79263652e-03] [-1.52865576e-03 2.89999852e-03 -4.00182269e-03] [ 1.23310420e-03 -2.44880516e-03 1.40028214e-03] [-1.19859078e-03 -1.65741393e-03 -3.08272061e-03] [-2.89298681e-03 -3.09617936e-03 -1.03687558e-03] [ 2.93251938e-03 -9.46546933e-04 7.39652890e-04] [-3.10009530e-03 4.83813799e-03 9.09840919e-04] [ 2.07720777e-03 1.17730276e-03 1.25745811e-03] [ 1.72320546e-03 5.27644266e-03 3.75479821e-04] [ 4.14832175e-05 2.40274519e-04 -4.09535524e-05] [ 3.00900800e-03 2.25014298e-03 2.20629562e-03] [ 2.29673145e-03 1.24682451e-03 3.72522306e-04] [-3.77280416e-03 2.68751487e-03 -1.28117732e-03] [-1.67129629e-03 6.64471086e-04 6.83138704e-04] [ 1.33731250e-03 -8.00607959e-04 -3.89924200e-03] [ 4.04791663e-03 3.46289857e-03 -5.12293460e-03] [-1.43102481e-03 2.19178061e-03 4.29736123e-03] [-4.22397413e-03 4.55039018e-04 5.52413807e-03] [-2.27118417e-03 1.00750001e-04 3.17935821e-04] [ 8.29778948e-04 -3.11040305e-03 -6.13534255e-04] [ 2.35477280e-03 -8.75631649e-04 4.35207939e-04] [-1.29301189e-03 -2.09991248e-03 1.36463890e-03] [ 1.67580769e-03 1.16261303e-03 2.85988261e-03] [ 4.63176841e-04 7.83799548e-05 -3.47865124e-03] [-3.21448616e-03 7.90930057e-04 -3.54357853e-03] [ 6.34236292e-04 2.99194821e-04 2.54842131e-03] [ 5.38162032e-03 -1.25869612e-03 -1.91096340e-03] [ 9.02092508e-04 1.23033918e-03 1.47203741e-03] [-6.11804542e-03 -8.38548541e-04 2.00552660e-03] [ 3.14820716e-04 9.00094392e-04 -1.37300069e-03] [ 7.42957072e-03 1.24605354e-03 -1.77990619e-03] [ 5.24318672e-04 -4.32038334e-03 -3.43925011e-03] [-7.35340763e-03 -5.39136330e-04 1.76520827e-03] [-6.80267034e-04 -2.49016520e-03 3.51283910e-03] [ 2.47804313e-04 1.68330514e-03 1.69920305e-03] [ 1.74004618e-03 -2.74097537e-03 3.98911614e-03] [-9.55022595e-04 1.40512404e-03 -3.11216151e-03] [-1.02266010e-03 -2.56715911e-03 -5.28864265e-03] [ 6.74995812e-04 9.72308499e-04 1.57627266e-03] [-1.78646010e-03 -4.36845332e-03 2.67482490e-03] [ 6.44151986e-05 1.01579871e-03 -6.48141150e-04] [ 8.63331506e-04 -4.53363707e-03 -1.76679142e-03] [ 9.11124504e-03 1.44964445e-03 -1.61538520e-03] [-2.61900124e-03 3.78558020e-03 -5.83734390e-03] [-9.67168072e-03 6.11972856e-04 1.08116260e-03] [ 2.86346060e-03 4.11727207e-03 5.35731140e-03] [ 1.95749829e-03 2.22971296e-03 -7.88248944e-04] [-1.18261291e-03 3.05009463e-04 -3.91784186e-03] [-1.31023570e-03 2.30082126e-03 -3.20415350e-04] [ 4.97708917e-04 3.33318637e-04 2.80995129e-03] [ 2.76456844e-03 -1.57691963e-03 3.68583342e-03] [-2.84165908e-03 -2.22191691e-03 -3.38342247e-03] [-2.17408334e-04 -1.65870837e-05 -5.02285235e-04] [ 1.58318108e-04 -8.32375766e-04 1.46559457e-03] [ 1.49868101e-03 9.53162256e-05 -3.68716744e-03] [-1.50240101e-03 -3.96808038e-04 2.38687436e-03] [-2.07375161e-03 2.94330834e-03 -4.58212230e-03] [ 2.12280967e-03 2.80216929e-03 3.76291533e-03] [ 7.41597207e-05 -2.90118568e-03 1.59328937e-03] [ 2.82682917e-04 1.32594896e-03 -2.85028634e-03] [ 8.82675869e-04 -1.85195860e-03 2.34384671e-04] [-9.00682988e-04 -6.57148614e-04 -1.32275028e-03] [-3.50697048e-03 2.69091514e-03 3.78843546e-03] [ 3.34818236e-03 3.23274895e-03 -3.64595474e-03] [ 2.02940221e-03 -8.10495137e-04 -4.55522957e-03] [-1.75431228e-03 -2.58427543e-03 5.52998414e-03] [ 9.58270119e-04 2.29807811e-03 2.44131136e-03] [ 8.01487875e-06 2.47471200e-03 -3.80314834e-03] [-7.21977278e-04 1.39513926e-03 -1.27384956e-03] [-3.41464772e-04 3.45219185e-03 5.28697119e-03] [-1.66220179e-03 -2.91091510e-03 -2.45764944e-03] [ 1.89498218e-03 -1.46726428e-03 2.89881770e-04] [ 1.38696995e-03 -2.15979691e-03 2.53279496e-03] [-1.78058455e-03 -2.31585972e-03 -4.41515214e-04]] Final stress: [-2.53158745e-05 2.21695627e-05 -4.69823833e-05 2.03884783e-05 2.86387212e-07 -1.10468849e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-7.85356108e-06 1.24263161e-03 1.22995252e-04] [ 6.27562004e-07 5.13240569e-04 -1.10485180e-04] [-2.16307856e-04 -2.73817239e-04 -3.72883943e-05] [ 2.18699384e-04 -3.56279715e-04 8.14077559e-05] [-2.97594945e-04 -2.47456186e-05 -7.43581083e-04] [ 3.03112677e-04 4.16177817e-05 7.15728039e-04] [ 2.92583133e-04 5.44074046e-06 6.04493047e-04] [-2.89634900e-04 7.58983539e-05 -3.59874232e-04] [ 2.24490108e-05 -4.13803039e-04 1.62424546e-04] [-2.26380365e-05 -4.43130678e-04 -2.46818054e-04] [-2.08381460e-04 -2.22078216e-04 8.91362971e-04] [ 2.07935615e-04 -2.34254673e-04 -8.58865721e-04] [ 1.24760132e-04 4.17965449e-04 2.07282942e-04] [-1.23153452e-04 4.32381971e-04 -2.15813802e-04] [ 6.86532092e-04 -4.08972574e-04 6.62402690e-04] [-6.86708500e-04 -2.78575753e-04 -3.07459246e-04] [ 1.05905914e-04 8.72668817e-05 1.19567184e-04] [-1.09024575e-04 -3.89849489e-05 -1.81215178e-04] [-5.65805030e-05 -3.38488858e-04 -1.58900403e-04] [ 5.56939802e-05 -2.80707778e-04 2.67624580e-04] [-5.77194612e-04 2.90852727e-04 1.48415235e-04] [ 5.75573653e-04 2.54181850e-04 -7.55993571e-05] [ 2.97560361e-04 1.47149060e-04 1.51903064e-04] [-2.96246099e-04 1.79755118e-04 1.29580539e-05] [-6.86862514e-06 -8.25320165e-04 -2.30910584e-04] [ 4.67565986e-06 -7.07581079e-04 4.66604810e-05] [ 4.04563459e-06 -1.38533986e-04 -7.81700156e-04] [-4.50781561e-06 -9.19250090e-05 4.96021516e-04] [-2.94821059e-04 4.70788218e-04 9.72031242e-04] [ 2.88218054e-04 4.65002596e-04 -4.83390267e-04] [-8.58972572e-05 -2.52790991e-04 1.42278366e-04] [ 8.56621635e-05 -1.91624832e-04 -3.56701005e-04] [ 4.38211814e-04 -5.59319299e-04 -2.48649467e-04] [-4.38377961e-04 -2.79018504e-04 1.54634495e-04] [ 1.17996495e-04 4.23500520e-05 -2.41466466e-05] [-3.06085257e-04 7.25120340e-04 1.49068837e-05] [-1.72725546e-04 1.05665831e-04 2.00347702e-04] [ 3.42064147e-04 6.70548812e-04 1.56773548e-04] [ 2.10833815e-04 8.90046509e-05 1.29003260e-04] [ 3.46391942e-04 5.23497255e-04 -8.72463994e-05] [-2.52288119e-04 1.41195890e-04 -8.74861606e-05] [-3.01016076e-04 4.73395941e-04 1.25886968e-04] [ 5.38651458e-04 1.20899271e-04 6.81544791e-04] [ 1.68499513e-04 2.15849854e-04 5.08565666e-04] [-4.83760348e-04 3.71950878e-04 -7.88098624e-04] [-2.17487883e-04 -3.72382772e-05 -6.14344189e-04] [ 1.86627830e-04 -1.18740378e-04 2.55306270e-04] [-2.73373972e-04 -2.87315066e-05 -9.60606149e-05] [-1.54912892e-04 -2.66607067e-04 -1.30240112e-04] [ 2.49292759e-04 1.20027050e-04 2.20269528e-04] [-2.23356352e-05 8.38983274e-05 3.81303778e-04] [ 4.04731299e-04 1.16165264e-04 -5.55671057e-04] [ 1.68256560e-05 9.88679898e-05 -5.01491090e-04] [-3.89456121e-04 1.04362641e-04 4.37029592e-04] [-2.28174714e-04 -7.36356618e-05 -3.36183237e-04] [ 1.10925691e-03 -1.80593057e-05 2.25420497e-04] [ 1.55618142e-04 -4.43139316e-05 3.04329633e-04] [-1.04490268e-03 -4.64849155e-05 -2.57071205e-04] [ 8.79619130e-05 -4.28142006e-04 4.67944071e-04] [ 1.03130281e-03 -8.77514528e-05 2.78855451e-04] [-4.81324328e-05 -6.52036983e-04 -4.27761699e-04] [-1.06978069e-03 1.34045035e-04 -2.40695578e-04] [ 2.69528196e-04 -2.19503050e-04 -7.04753002e-04] [ 2.77520142e-04 3.76442713e-04 -2.41079985e-04] [-2.96123234e-04 -3.59206029e-04 5.30617895e-04] [-2.51122088e-04 5.19750137e-04 6.53102705e-05] [-1.78706839e-04 -6.22971563e-04 -2.39755448e-04] [ 1.98339723e-05 1.84161527e-04 -1.41848453e-04] [ 2.37849885e-04 -6.08478297e-04 3.82780602e-04] [-7.63613166e-05 1.70574172e-04 2.84425726e-04] [-3.31093991e-04 4.50306142e-04 7.89734860e-04] [ 1.28220378e-03 1.54784578e-04 1.96123480e-04] [ 4.00270907e-04 5.37301597e-04 -8.42564836e-04] [-1.34599646e-03 8.04387666e-05 -2.51494692e-04] [-1.24666520e-04 8.06407097e-05 4.94924880e-04] [ 1.91358301e-04 3.12259303e-04 -6.89623800e-05] [ 1.69453834e-04 8.18986720e-05 -6.20414411e-04] [-2.35087042e-04 3.09460999e-04 -5.64913570e-05] [-3.30033218e-04 -9.61839827e-05 4.40588840e-04] [ 3.30138574e-04 -1.81292603e-04 -5.10477762e-04] [-7.20973429e-05 2.33288106e-05 -4.71095887e-05] [ 7.38313713e-05 -6.98174055e-05 1.43892125e-04] [-2.57566703e-04 -1.64577974e-06 -5.31239003e-04] [ 2.57309866e-04 -9.18762184e-05 3.74592089e-04] [ 4.23087849e-04 5.04970611e-04 -7.94842573e-04] [-4.22306034e-04 4.69424315e-04 6.83838935e-04] [ 1.10893211e-04 -1.14820347e-03 2.34443210e-04] [-1.16397709e-04 -5.47799318e-04 -3.29510132e-04] [-2.16911523e-05 -2.42574963e-04 3.45818582e-05] [ 2.02841539e-05 -1.31353935e-04 -1.89300414e-04] [ 4.97323326e-04 3.45303005e-04 5.68669346e-04] [-4.93653991e-04 4.53199268e-04 -5.57395184e-04] [-3.89561451e-04 -4.02755090e-04 -6.99682321e-04] [ 3.83225248e-04 -5.50690297e-04 7.82657398e-04] [ 6.13274254e-05 3.44748850e-04 3.62564388e-04] [ 9.84833983e-05 2.47995422e-04 -1.10102083e-04] [ 5.95018896e-05 3.79098339e-04 -4.17911671e-04] [-2.15644716e-04 2.14025589e-04 4.81097798e-05] [ 2.66004173e-04 -4.61717507e-04 -1.90173042e-04] [-2.26661970e-04 -3.21604454e-04 6.32162239e-04] [-2.88383214e-04 -4.03169311e-04 2.54546668e-04] [ 2.51647549e-04 -3.78593824e-04 -5.63386609e-04]] Final stress: [-2.45848003e-06 1.53374780e-07 -9.52570472e-06 1.39703816e-05 -1.04936692e-08 1.42573503e-05] Minimization converged after 146 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-5.29318489e-07 -5.45135810e-04 -1.19027827e-04] [ 8.63437842e-06 -1.32618178e-03 1.32805262e-04] [-2.32539695e-04 3.80459185e-04 8.69675858e-05] [ 2.29880257e-04 2.92847453e-04 -4.13294557e-05] [-3.21686014e-04 -4.30536645e-05 7.57615415e-04] [ 3.15543819e-04 2.85362497e-05 -7.87969998e-04] [ 3.06482739e-04 -7.98565705e-05 -3.80702911e-04] [-3.09778826e-04 -5.37639921e-06 6.40842367e-04] [ 2.42092831e-05 4.68444108e-04 -2.62345567e-04] [-2.39367291e-05 4.37075390e-04 1.72217305e-04] [-2.19857883e-04 2.47638032e-04 -9.09716465e-04] [ 2.20270875e-04 2.34412151e-04 9.44409554e-04] [ 1.29698023e-04 -4.59552930e-04 -2.27180889e-04] [-1.31442787e-04 -4.43412365e-04 2.17745040e-04] [ 7.30009732e-04 2.93595204e-04 -3.25257073e-04] [-7.29743427e-04 4.36052458e-04 7.01795725e-04] [ 1.15944983e-04 4.17301594e-05 -1.92680548e-04] [-1.12402799e-04 -9.18855076e-05 1.26515717e-04] [-5.91445591e-05 2.97097030e-04 2.84127584e-04] [ 6.01291855e-05 3.57412249e-04 -1.68836072e-04] [-6.11573178e-04 -2.66374955e-04 -7.88452376e-05] [ 6.13260734e-04 -3.05218100e-04 1.55748646e-04] [ 3.13598816e-04 -1.99361369e-04 1.26136539e-05] [-3.15061134e-04 -1.61457104e-04 1.61869356e-04] [-6.93767182e-06 7.54668376e-04 4.14756726e-05] [ 9.41186111e-06 8.80763630e-04 -2.36855522e-04] [ 2.01556543e-06 1.01061179e-04 5.23377422e-04] [-1.55503835e-06 1.47493148e-04 -8.26431179e-04] [-3.06112617e-04 -4.94616840e-04 -5.14036660e-04] [ 3.13595327e-04 -5.01562218e-04 1.03294144e-03] [-9.06973247e-05 2.04501752e-04 -3.77363455e-04] [ 9.09771365e-05 2.69704452e-04 1.49137605e-04] [ 4.65820235e-04 2.95215183e-04 1.63849305e-04] [-4.65559818e-04 5.94038973e-04 -2.63973322e-04] [ 3.23919926e-04 -7.71600514e-04 1.44316964e-05] [-1.24666509e-04 -4.57147478e-05 -2.29396129e-05] [-3.63938572e-04 -7.12992585e-04 1.68190724e-04] [ 1.85521568e-04 -1.14248296e-04 2.10223527e-04] [-3.64886600e-04 -5.57988152e-04 -9.14792683e-05] [-2.24965670e-04 -9.44622968e-05 1.38954523e-04] [ 3.17559147e-04 -5.04447682e-04 1.32835708e-04] [ 2.68012041e-04 -1.50426829e-04 -9.43769090e-05] [-1.80006316e-04 -2.28518090e-04 5.38835212e-04] [-5.72495216e-04 -1.29842193e-04 7.23873641e-04] [ 2.31796255e-04 4.12703507e-05 -6.49387393e-04] [ 5.14106074e-04 -3.97445860e-04 -8.35261476e-04] [ 2.89142670e-04 2.97647226e-05 -1.00415459e-04] [-1.98649857e-04 1.24388128e-04 2.73360156e-04] [-2.62606112e-04 -1.28856275e-04 2.33308689e-04] [ 1.63458982e-04 2.82078832e-04 -1.39524894e-04] [-4.30629929e-04 -1.23068702e-04 -5.89557536e-04] [ 2.40633382e-05 -8.61610253e-05 4.03021987e-04] [ 4.12588923e-04 -1.11454894e-04 4.63693726e-04] [-1.69233364e-05 -1.01349958e-04 -5.30896911e-04] [-1.17647796e-03 1.46116891e-05 2.38301655e-04] [ 2.44946037e-04 7.68209593e-05 -3.57407628e-04] [ 1.10883227e-03 4.51530656e-05 -2.71850717e-04] [-1.67940514e-04 4.54785961e-05 3.23650398e-04] [-1.09419171e-03 9.64581076e-05 2.96012853e-04] [-9.69954721e-05 4.52739112e-04 4.95033917e-04] [ 1.13513026e-03 -1.39168811e-04 -2.56040588e-04] [ 5.45185415e-05 6.90643665e-04 -4.52819615e-04] [-2.96202422e-04 -3.99571837e-04 -2.54507479e-04] [-2.87753356e-04 2.31975783e-04 -7.47852613e-04] [ 2.69291713e-04 -5.52785394e-04 6.63785491e-05] [ 3.14826760e-04 3.81214859e-04 5.61526104e-04] [-2.19744784e-05 -1.97026273e-04 -1.53057267e-04] [ 1.89384349e-04 6.61078551e-04 -2.52037226e-04] [ 8.13397475e-05 -1.82923733e-04 3.04050625e-04] [-2.51734931e-04 6.45869359e-04 4.03438325e-04] [-1.35908447e-03 -1.61743800e-04 2.09180813e-04] [ 3.52036600e-04 -4.73445148e-04 8.36451258e-04] [ 1.42622436e-03 -8.43716640e-05 -2.67717999e-04] [-4.25366475e-04 -5.64869208e-04 -8.92246457e-04] [-2.03869701e-04 -3.31770282e-04 -7.20423380e-05] [ 1.33481206e-04 -8.51437122e-05 5.23795919e-04] [ 2.49486516e-04 -3.28462521e-04 -6.09569741e-05] [-1.80258777e-04 -8.66934354e-05 -6.56853036e-04] [-3.48718682e-04 1.87118562e-04 -5.36659250e-04] [ 3.48477530e-04 9.74604910e-05 4.65089235e-04] [-7.73543934e-05 7.34995528e-05 1.51989084e-04] [ 7.54178970e-05 -2.58997521e-05 -4.86860860e-05] [-2.74104594e-04 9.80209116e-05 3.95681791e-04] [ 2.74362976e-04 2.94051754e-06 -5.61990599e-04] [ 4.47918267e-04 -4.95967520e-04 7.21698490e-04] [-4.48672723e-04 -5.34803024e-04 -8.41817413e-04] [ 1.25907997e-04 5.82363348e-04 -3.51279428e-04] [-1.19620533e-04 1.22857028e-03 2.48990923e-04] [-2.27902176e-05 1.39749349e-04 -2.00631117e-04] [ 2.42542979e-05 2.58360163e-04 3.62596264e-05] [ 5.24952099e-04 -4.79854263e-04 -5.89867252e-04] [-5.29045304e-04 -3.66753267e-04 6.01801055e-04] [-4.06645682e-04 5.88618728e-04 8.32331440e-04] [ 4.13739387e-04 4.27865233e-04 -7.43635560e-04] [-1.04413511e-04 -2.63975269e-04 -1.14445362e-04] [-6.69574833e-05 -3.65133006e-04 3.83891077e-04] [ 2.28533134e-04 -2.28125362e-04 4.82212895e-05] [-6.11677780e-05 -4.01346914e-04 -4.42817706e-04] [ 2.37800140e-04 3.40631963e-04 6.74789596e-04] [-2.82652656e-04 4.92548473e-04 -2.05345180e-04] [-2.64468879e-04 4.01222437e-04 -6.00718054e-04] [ 3.06275676e-04 4.30195765e-04 2.74326314e-04]] Final stress: [-2.56891531e-06 3.07769308e-07 -9.95644364e-06 -1.40915444e-05 1.12470344e-08 1.50579787e-05] Minimization converged after 31 steps. Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 6.93118797e-04 -2.10229591e-04 -4.36852326e-05] [ 5.64131597e-04 2.11654545e-04 -5.91649798e-05] [ 7.38858335e-04 8.32287067e-05 -5.38274869e-06] [ 1.15234667e-04 -8.06844537e-05 -2.97252123e-05] [ 5.91685591e-04 -2.31602149e-04 6.78995644e-05] [ 8.27811693e-04 1.94345219e-04 6.76859652e-05] [-6.41155098e-04 -3.49381803e-04 4.09771563e-04] [-2.90835244e-04 3.20241037e-04 3.79764633e-04] [ 1.04127060e-03 -1.72855991e-04 -2.39734126e-04] [-2.19855893e-05 1.58573748e-04 -2.30747771e-04] [-2.17052829e-05 1.59377115e-04 -2.29616736e-05] [-1.27572563e-03 -1.82021402e-04 -3.72090018e-05] [-3.56177543e-04 -3.72049379e-05 2.68657129e-04] [ 9.81046634e-04 1.84389093e-05 2.31048429e-04] [-9.41500239e-04 3.04656267e-04 1.53804347e-04] [ 1.33098704e-03 -3.11685927e-04 1.51088576e-04] [ 2.46996163e-04 -1.68553176e-05 7.18931308e-05] [-5.81922695e-04 2.48276460e-05 7.94200160e-05] [ 5.29243316e-04 -4.30402187e-05 -9.66924125e-05] [-2.39120083e-04 4.18266296e-05 -1.01300115e-04] [-3.95847761e-04 6.26186269e-05 1.50282981e-04] [-4.99220175e-04 -7.66555632e-05 1.50982065e-04] [-5.34846846e-04 3.52722078e-04 6.01046535e-05] [ 3.50206400e-04 -3.23289043e-04 6.54171409e-05] [-2.27298387e-04 4.11363539e-04 -6.19415463e-04] [ 4.19994789e-04 -3.91013138e-04 -5.54277950e-04] [-1.89024698e-04 -4.29075893e-04 -2.94930212e-04] [-2.14977009e-08 4.15766954e-04 -2.46100259e-04] [ 6.49571882e-04 1.77684022e-05 3.20264013e-04] [-3.08708130e-04 1.24441515e-05 3.19661399e-04] [ 1.51851630e-03 2.00813861e-05 -1.67164372e-04] [ 4.63356611e-04 -3.82668334e-06 -1.94481126e-04] [-3.00023038e-05 -5.94073727e-05 -1.29672757e-05] [ 1.67457163e-04 7.27513200e-05 -1.11197892e-05] [-5.89637134e-04 1.50062263e-05 -9.20309905e-05] [ 7.41487328e-04 -2.65921075e-04 1.74470920e-04] [ 4.15731246e-04 2.80784501e-04 1.59312555e-04] [-3.91157977e-04 -1.13999892e-05 4.10349928e-04] [ 6.19092191e-04 2.58474652e-04 5.42603044e-04] [ 6.81074543e-05 -2.74408067e-04 -5.44468686e-04] [ 1.63924808e-04 4.14541610e-04 7.13115996e-04] [ 5.24992948e-04 -3.79696881e-04 -3.76238919e-04] [-8.21046938e-04 -4.12428741e-04 4.33026936e-04] [-5.86959049e-04 1.25666935e-03 -8.26713492e-04] [-5.01958033e-04 -1.03614425e-03 6.97865835e-04] [-8.75674921e-04 1.40046119e-04 -4.74991786e-04] [-3.37509914e-04 2.47823798e-04 -6.54456502e-04] [ 2.10770584e-04 -1.58949898e-04 -3.79438527e-04] [ 2.09705950e-04 9.99205835e-05 5.03678373e-04] [-3.20389365e-04 -1.98512139e-04 7.50966339e-04] [ 6.21870267e-04 2.25353297e-04 -2.21551882e-04] [-4.32976031e-04 1.06726016e-04 1.11576324e-04] [-4.89619620e-04 -1.83902483e-05 -3.91143355e-04] [ 7.54753301e-04 -2.94263890e-04 -6.37650076e-05] [ 1.84550233e-04 1.68491320e-04 1.74160258e-04] [ 5.74860688e-04 1.31838433e-03 -1.09028412e-03] [-3.76209771e-05 -3.17564389e-04 5.19137569e-04] [ 7.26431153e-04 -1.06585318e-03 -7.19752084e-04] [ 6.15749117e-04 4.42716901e-04 2.97508760e-04] [-6.39455284e-04 1.03620609e-03 -4.46987366e-04] [-6.06912601e-04 -1.27595131e-03 4.42414970e-04] [ 5.70554289e-04 -2.17711974e-04 -2.63474816e-04] [-5.34622018e-04 1.15518583e-03 3.58489373e-04] [ 4.49560894e-04 6.77831891e-05 -6.11292604e-04] [ 6.53090238e-04 -2.51730027e-04 2.86096820e-04] [-6.88192691e-04 -9.88376925e-04 -6.43980126e-04] [ 8.87748538e-04 -2.51775916e-05 5.97046243e-04] [-7.77034196e-04 -4.19617937e-04 3.98885364e-04] [-7.82395685e-04 5.44199606e-04 -3.93189580e-04] [ 8.97558773e-04 -8.68470058e-05 -6.62406430e-04] [-3.93143429e-04 1.05803677e-03 6.25032336e-04] [-1.09558756e-04 -4.02931036e-04 -3.23326560e-04] [-3.71810322e-04 -2.02488153e-04 5.84615896e-04] [-1.04656605e-04 -3.48738975e-04 -3.47247294e-04] [ 6.60005591e-04 2.35763134e-04 3.75265342e-04] [ 2.69878635e-04 -6.60713549e-04 8.41953287e-05] [ 2.61432911e-04 4.70741719e-04 4.92845822e-05] [ 6.95519706e-04 -5.76358112e-05 -2.91366895e-04] [ 3.81643739e-04 -2.63756037e-04 2.35340546e-04] [-7.49060708e-04 2.36471131e-04 1.70689161e-04] [ 1.23360122e-03 2.92033247e-05 3.64419140e-06] [-1.43618325e-03 -3.52701785e-05 6.73460887e-06] [-3.19900709e-04 1.44495176e-04 -1.13709872e-04] [-2.67975152e-04 -1.51683674e-04 -1.19083151e-04] [ 1.13782943e-03 3.79810645e-04 -3.09393562e-04] [-1.01172633e-03 -3.98464244e-04 -3.37026558e-04] [-7.69763165e-04 8.42162651e-05 9.56730381e-06] [-3.40548824e-04 -6.14764119e-06 -1.02179838e-05] [-1.91693206e-03 -6.68926113e-05 3.70732636e-06] [ 7.60488459e-04 4.43012290e-05 1.81907974e-05] [-3.25200655e-04 -6.76478661e-05 1.02718742e-04] [ 1.34561444e-04 7.15390554e-05 8.60948065e-05] [ 2.02651643e-04 -1.52257996e-04 1.49491370e-05] [-8.66146313e-04 1.50205342e-04 7.46527165e-06] [-3.58387485e-04 1.33808252e-03 -6.52085653e-04] [ 7.05925810e-04 -1.97288392e-04 -2.71107157e-04] [ 5.22500501e-04 -2.99407868e-04 3.51316989e-05] [-2.09997082e-04 -8.90802105e-04 4.22868826e-04] [-9.25105559e-04 -3.19779355e-04 -3.89281550e-04] [-3.97695995e-04 6.78175029e-05 7.93198267e-04] [-7.22238381e-04 5.45070676e-04 -2.45005778e-04] [-5.21776242e-04 -3.77073697e-04 1.08493263e-03]] Final stress: [-5.41404490e-07 -1.72756414e-06 -1.07608364e-05 -1.19493336e-08 -7.07185538e-07 -9.71815959e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.35890194e-03 -1.16845169e-04 -2.65211061e-04] [ 2.18127922e-03 2.33215043e-04 -2.22672436e-04] [ 6.18496768e-04 -1.04310597e-04 4.85950008e-05] [ 1.89018008e-03 8.00388521e-05 1.82611634e-04] [ 1.84411114e-03 -1.96717114e-04 -1.58679931e-04] [ 1.21135560e-03 3.26504420e-04 -1.80005942e-04] [-5.98957883e-04 8.95053191e-04 -8.57774650e-04] [-1.14323286e-03 -7.30080959e-04 -7.30942365e-04] [-1.17175454e-04 3.67921919e-05 -6.77709943e-05] [ 2.34998712e-03 -1.83770845e-05 -8.64165886e-05] [-2.59081360e-03 1.30417785e-04 -2.55546333e-04] [-9.51457236e-05 -5.37336287e-05 -1.80770928e-04] [ 1.83564432e-03 -1.55332337e-04 -8.48962168e-04] [-6.00336786e-04 1.92055432e-04 -9.05814725e-04] [ 2.19517112e-03 -5.65919589e-04 -7.72328936e-04] [-2.01208727e-03 5.22146040e-04 -7.97738391e-04] [-6.60869151e-04 2.48043203e-05 -1.97633332e-04] [ 4.38587641e-05 -1.23379978e-04 -2.80461573e-04] [-1.10584461e-03 3.23261832e-05 5.03589089e-04] [ 1.08837747e-03 -3.96771022e-05 4.99073507e-04] [-1.15971176e-03 -8.42784186e-05 -8.90425084e-06] [ 7.47165148e-05 1.37813799e-04 -1.27779935e-04] [-2.11890392e-04 -8.66506279e-04 1.09490666e-04] [-2.13852453e-03 9.35651049e-04 9.95120674e-05] [ 2.06721647e-03 -7.41873597e-04 4.68536888e-04] [ 1.42435586e-03 1.10748622e-03 7.90377863e-04] [ 5.65339283e-04 8.82442471e-04 9.25543983e-04] [ 1.51985918e-04 -9.57437501e-04 9.61297871e-04] [-3.69638052e-04 -5.03833498e-05 4.68131538e-04] [ 1.61451500e-03 -9.95349967e-05 4.70542065e-04] [ 1.57367479e-03 -1.06156725e-05 -2.71409074e-04] [ 2.83788071e-03 -4.62719136e-05 -2.09575540e-04] [ 7.04917197e-04 1.51099154e-04 -7.03238586e-05] [-5.10166035e-04 -2.49042594e-04 -5.61780489e-05] [ 6.53190868e-04 -1.19544201e-03 4.32094232e-05] [-1.22410185e-03 3.58425530e-04 8.53720348e-04] [-1.21752329e-03 1.51475060e-04 -7.44069162e-04] [ 1.20396186e-03 5.36481700e-04 -2.21882344e-05] [-3.43858483e-04 -2.72575492e-04 6.96656562e-04] [ 5.21634554e-04 1.14834458e-03 -6.36412582e-04] [ 4.58834740e-04 -7.91620858e-04 9.04947002e-04] [-2.41496449e-04 -5.76290524e-05 -4.81496040e-04] [-1.16370313e-03 2.23414887e-03 1.38942090e-03] [-1.98924704e-03 -6.03414945e-04 -9.53919020e-04] [-1.73575941e-03 1.40158186e-03 1.17759951e-03] [-1.58227775e-03 -2.76540746e-03 -1.56842777e-03] [-1.36470954e-03 -5.08116684e-04 5.90304233e-04] [-4.10509238e-04 5.47773839e-04 8.37740757e-04] [-4.74808192e-04 -3.81307795e-04 -1.09804056e-03] [-1.35532410e-03 4.90656289e-04 -6.35167515e-04] [-1.04480445e-03 -4.11950200e-05 -7.03554221e-04] [ 1.42710261e-03 -2.00346011e-04 7.06355157e-04] [ 1.24497264e-03 -4.15860450e-04 -5.48433256e-04] [-1.19500476e-03 5.45541790e-04 8.32788672e-04] [ 2.65622496e-04 1.07845065e-03 1.18468661e-03] [ 1.20459314e-04 6.52683127e-05 -5.63358365e-04] [ 1.97721634e-03 -1.45256771e-03 8.70431646e-04] [-1.60559631e-03 1.91700035e-04 -7.93438781e-04] [-7.39386540e-04 2.55705697e-03 9.06100025e-04] [ 1.59241951e-03 -1.21702779e-04 -4.81725616e-04] [ 1.91584909e-03 -4.34828899e-04 7.01365990e-04] [-1.02545092e-03 -1.94665116e-03 -7.77581092e-04] [ 1.06606076e-04 6.82897414e-05 1.45253269e-03] [-5.17788229e-04 2.19727141e-03 -8.44824226e-04] [-9.89169653e-04 -1.88759500e-03 1.31353139e-03] [ 5.62321778e-04 -3.65665510e-04 -1.07599408e-03] [-1.98442127e-03 -9.63590912e-04 -1.51363270e-03] [ 8.72414896e-04 4.40813101e-04 -1.54632916e-03] [ 6.34220034e-04 -8.65194331e-04 1.45094393e-03] [-1.60762573e-03 1.36816488e-03 1.40388547e-03] [-1.69287292e-04 -3.65432955e-04 1.00331417e-03] [ 3.45469921e-04 9.29472327e-04 -3.58898827e-04] [ 1.36687382e-03 -9.50040141e-04 5.61743067e-04] [-1.28838431e-03 2.09121307e-04 -8.21556941e-04] [ 2.43265512e-04 -8.51137575e-04 1.31775980e-04] [ 1.80034911e-03 7.64106775e-04 -1.19924006e-03] [ 1.48296745e-03 -4.41361868e-04 5.21920719e-04] [ 4.13046078e-04 5.63528578e-04 -6.89594743e-04] [-7.96858278e-04 3.14771948e-04 1.54534955e-04] [ 5.09897695e-04 -4.58228376e-04 2.08931970e-04] [-2.84364889e-03 3.27918385e-05 1.50094134e-04] [ 2.68102770e-03 -2.12678777e-05 1.42204631e-04] [-5.88335747e-04 -6.10847843e-05 -5.99127576e-05] [-5.77868898e-04 1.29457221e-04 -3.50189276e-05] [-2.75347682e-04 -7.37946709e-04 1.75827652e-04] [ 2.40728375e-03 7.13309074e-04 2.31160111e-04] [ 1.28014693e-03 1.59665877e-05 -2.75176569e-04] [-2.88298836e-03 -4.20754201e-04 -1.52572871e-04] [ 1.05493289e-03 -1.06185557e-04 -6.19868668e-05] [-3.60022427e-03 1.66011168e-04 -1.27064827e-04] [ 3.85478340e-04 2.50517618e-04 -1.54988455e-04] [-9.73503329e-04 -2.52961229e-04 -1.23861719e-04] [-1.15544202e-04 4.49684976e-04 2.16629924e-04] [ 1.70672392e-03 -6.58340758e-04 2.51733863e-04] [ 1.03717685e-03 8.08831292e-04 6.14149453e-04] [-1.00992410e-03 2.72000359e-03 2.01752482e-03] [-6.73812672e-04 -2.71091157e-03 -9.19110930e-04] [ 8.31546985e-04 -7.00286836e-04 4.11464476e-04] [-9.10033144e-04 5.59509143e-04 -1.12610206e-03] [-1.96196881e-03 5.95850385e-04 1.93500181e-04] [-1.51827030e-03 -1.47267476e-03 -1.23255361e-03] [-1.42201833e-03 3.97420565e-04 4.91010022e-05]] Final stress: [-6.65648770e-06 5.65223220e-06 -2.26716301e-05 2.66004026e-07 -1.30696512e-05 2.20236148e-05] Minimization converged after 152 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-7.02520330e-04 -2.11121136e-04 -4.42347600e-05] [-5.70468126e-04 2.10840308e-04 -5.98608476e-05] [-7.50032801e-04 8.41382540e-05 -5.31604929e-06] [-1.16928624e-04 -8.12816374e-05 -3.06473854e-05] [-6.00187621e-04 -2.35125919e-04 6.84109160e-05] [-8.41251722e-04 1.96934732e-04 6.83523671e-05] [ 6.51569256e-04 -3.51293182e-04 4.12456404e-04] [ 2.93357633e-04 3.20886409e-04 3.81388410e-04] [-1.05594014e-03 -1.74177769e-04 -2.42044198e-04] [ 2.28644896e-05 1.59721929e-04 -2.32781362e-04] [ 2.19357211e-05 1.61144341e-04 -2.37057854e-05] [ 1.29384782e-03 -1.84324886e-04 -3.83773077e-05] [ 3.60702735e-04 -3.78911437e-05 2.69453372e-04] [-9.93210030e-04 1.87691081e-05 2.31686368e-04] [ 9.54251495e-04 3.06569648e-04 1.54803309e-04] [-1.34887240e-03 -3.13030169e-04 1.52131001e-04] [-2.49786714e-04 -1.66540091e-05 7.18123722e-05] [ 5.89279549e-04 2.52399349e-05 7.98439494e-05] [-5.35957374e-04 -4.34704866e-05 -9.66691763e-05] [ 2.43587114e-04 4.21576813e-05 -1.01186827e-04] [ 3.98914488e-04 6.29042444e-05 1.50912223e-04] [ 5.07896869e-04 -7.72585699e-05 1.52083311e-04] [ 5.47670601e-04 3.53830229e-04 6.07435465e-05] [-3.52690219e-04 -3.25091452e-04 6.63443119e-05] [ 2.23618364e-04 4.11537627e-04 -6.22554685e-04] [-4.26853499e-04 -3.92599363e-04 -5.57904105e-04] [ 1.90903055e-04 -4.31544372e-04 -2.96993135e-04] [-1.37253662e-06 4.18551440e-04 -2.47721275e-04] [-6.59434391e-04 1.85339494e-05 3.24936110e-04] [ 3.14112276e-04 1.26323339e-05 3.24319002e-04] [-1.53327846e-03 2.03052437e-05 -1.69400185e-04] [-4.67889934e-04 -3.55845538e-06 -1.97392039e-04] [ 3.31946366e-05 -6.00096686e-05 -1.29533365e-05] [-1.70132668e-04 7.41382752e-05 -1.12627832e-05] [ 3.97166861e-04 -1.22364304e-05 4.16176867e-04] [-4.19703640e-04 2.85061263e-04 1.61753610e-04] [-7.52217998e-04 -2.68007904e-04 1.75217556e-04] [ 5.98430152e-04 1.46217310e-05 -9.43897870e-05] [-5.29374179e-04 -3.86849227e-04 -3.82007845e-04] [-1.66556761e-04 4.18335862e-04 7.20961193e-04] [-7.01420261e-05 -2.76205297e-04 -5.50153032e-04] [-6.24382755e-04 2.63556020e-04 5.50781650e-04] [ 8.87818242e-04 1.41432700e-04 -4.80748879e-04] [ 5.08769207e-04 -1.05270512e-03 7.08553922e-04] [ 5.95208453e-04 1.27702121e-03 -8.39138141e-04] [ 8.32842484e-04 -4.19290829e-04 4.39813938e-04] [ 3.24462070e-04 -2.01634617e-04 7.60254733e-04] [-2.11671556e-04 1.02533786e-04 5.11868032e-04] [-2.11945823e-04 -1.63303901e-04 -3.85360170e-04] [ 3.41300899e-04 2.51453212e-04 -6.63129743e-04] [-7.66160379e-04 -2.96374510e-04 -6.32214624e-05] [ 4.97201884e-04 -1.91786532e-05 -3.95658937e-04] [ 4.39783459e-04 1.07529737e-04 1.13546742e-04] [-6.30051641e-04 2.28261991e-04 -2.24496795e-04] [-7.36443906e-04 -1.07544683e-03 -7.28509845e-04] [ 4.03359407e-05 -3.19620747e-04 5.25636508e-04] [-5.75577994e-04 1.32788275e-03 -1.10120036e-03] [-1.91810609e-04 1.71936270e-04 1.78327601e-04] [-5.80353689e-04 -2.19755364e-04 -2.66560872e-04] [ 6.14305668e-04 -1.29443143e-03 4.49170407e-04] [ 6.47657614e-04 1.05057009e-03 -4.53708449e-04] [-6.26683693e-04 4.48400411e-04 3.01556332e-04] [ 6.96267407e-04 -1.00234529e-03 -6.53799000e-04] [-6.55323277e-04 -2.54545047e-04 2.90143104e-04] [-4.50214824e-04 6.84561842e-05 -6.18997020e-04] [ 5.41971634e-04 1.17075370e-03 3.65679649e-04] [-9.07622913e-04 -8.89482304e-05 -6.71717317e-04] [ 7.93550354e-04 5.51302025e-04 -3.98409602e-04] [ 7.87896141e-04 -4.26287368e-04 4.04943711e-04] [-8.98098501e-04 -2.32733992e-05 6.06551746e-04] [ 1.02595713e-04 -3.52096996e-04 -3.51892300e-04] [ 3.78483668e-04 -2.04823736e-04 5.92582554e-04] [ 1.15148665e-04 -4.05890497e-04 -3.28864748e-04] [ 3.92610515e-04 1.06838476e-03 6.32331203e-04] [-7.06662079e-04 -5.95844377e-05 -2.96917122e-04] [-2.64110118e-04 4.77109731e-04 5.11055352e-05] [-2.72619249e-04 -6.68367031e-04 8.18328099e-05] [-6.69932114e-04 2.38681809e-04 3.79429930e-04] [-3.86088157e-04 -2.64670640e-04 2.37890815e-04] [ 7.59855568e-04 2.37740496e-04 1.72277184e-04] [-1.24918794e-03 2.97097024e-05 3.92963488e-06] [ 1.45505831e-03 -3.58882669e-05 7.17444597e-06] [ 3.24587731e-04 1.45818735e-04 -1.15249399e-04] [ 2.71841787e-04 -1.53389266e-04 -1.20773526e-04] [-1.15450444e-03 3.82179617e-04 -3.12089404e-04] [ 1.01833851e-03 -4.00739603e-04 -3.40144595e-04] [ 7.81272322e-04 8.43269765e-05 9.21686876e-06] [ 3.39816445e-04 -2.63004883e-06 -1.13891306e-05] [ 1.94001057e-03 -6.82521005e-05 3.15525054e-06] [-7.69062899e-04 4.51294572e-05 1.81017889e-05] [ 3.30469080e-04 -6.79738313e-05 1.03803211e-04] [-1.37899929e-04 7.18295963e-05 8.69078841e-05] [-2.08399077e-04 -1.51359064e-04 1.58038343e-05] [ 8.74992236e-04 1.50739618e-04 7.99271529e-06] [ 2.13358961e-04 -9.04579031e-04 4.31027845e-04] [-5.30544861e-04 -3.04791246e-04 3.49160716e-05] [-7.15101318e-04 -1.96696884e-04 -2.71580648e-04] [ 3.62158833e-04 1.35598852e-03 -6.60422066e-04] [ 5.28691206e-04 -3.84855344e-04 1.09646833e-03] [ 7.27295266e-04 5.48169341e-04 -2.50581277e-04] [ 4.00874993e-04 6.90936601e-05 8.01448273e-04] [ 9.35120994e-04 -3.17386214e-04 -3.95893744e-04]] Final stress: [-5.64017903e-07 -1.69728601e-06 -1.08930069e-05 -1.33430126e-08 8.86070458e-07 9.88268927e-06] Minimization converged after 116 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.34631756e-04 -5.21138824e-04 -1.02064856e-04] [ 4.34631756e-04 5.21138814e-04 -1.02064854e-04] [-4.60199002e-04 1.46825477e-04 5.15262886e-05] [ 4.60199001e-04 -1.46825477e-04 5.15262872e-05] [-6.58542503e-04 -1.37563085e-04 9.76816506e-05] [ 6.58542502e-04 1.37563086e-04 9.76816503e-05] [ 1.29447027e-03 -3.64149934e-04 3.15093428e-04] [-1.29447027e-03 3.64149931e-04 3.15093424e-04] [ 4.42100301e-04 -3.09192056e-05 -3.76997778e-05] [-4.42100300e-04 3.09192031e-05 -3.76997758e-05] [-2.58613708e-04 1.79066470e-04 -9.20821826e-05] [ 2.58613708e-04 -1.79066469e-04 -9.20821829e-05] [-1.18433194e-04 7.25283616e-05 3.71687913e-04] [ 1.18433193e-04 -7.25283607e-05 3.71687914e-04] [ 1.17469240e-03 6.23496063e-04 5.72778417e-04] [-1.17469240e-03 -6.23496059e-04 5.72778414e-04] [ 1.04265271e-04 2.04264540e-05 7.58533897e-05] [-1.04265272e-04 -2.04264541e-05 7.58533884e-05] [ 2.94083307e-04 -1.86883876e-04 -1.66801162e-04] [-2.94083306e-04 1.86883874e-04 -1.66801158e-04] [-9.85797392e-04 1.01771851e-04 1.48762299e-04] [ 9.85797391e-04 -1.01771852e-04 1.48762299e-04] [ 3.97776804e-04 1.28171964e-04 -3.86205012e-05] [-3.97776806e-04 -1.28171970e-04 -3.86205004e-05] [ 2.70835704e-04 3.17451781e-04 -6.34678181e-04] [-2.70835703e-04 -3.17451780e-04 -6.34678179e-04] [ 4.09331260e-04 -5.79249283e-04 -7.58453259e-04] [-4.09331260e-04 5.79249285e-04 -7.58453255e-04] [-1.06477216e-03 1.27272904e-04 2.19041754e-04] [ 1.06477216e-03 -1.27272905e-04 2.19041754e-04] [ 3.49585208e-04 -8.80443512e-05 -1.89564064e-04] [-3.49585207e-04 8.80443517e-05 -1.89564065e-04] [ 7.87515231e-04 -1.51764801e-04 1.15085731e-05] [-7.87515231e-04 1.51764801e-04 1.15085719e-05] [ 5.16872003e-04 -8.66004274e-04 1.17444034e-04] [-5.16872004e-04 8.66004274e-04 1.17444035e-04] [-7.67178059e-04 -1.01822850e-03 2.29227504e-04] [ 7.67178059e-04 1.01822850e-03 2.29227504e-04] [-3.84981241e-04 1.57532677e-05 -5.62749492e-04] [ 3.84981241e-04 -1.57532680e-05 -5.62749492e-04] [ 3.10819693e-04 1.86218774e-04 9.42436985e-04] [-3.10819694e-04 -1.86218775e-04 9.42436985e-04] [ 3.55222048e-04 2.84005671e-04 8.02695636e-04] [-3.55222049e-04 -2.84005671e-04 8.02695637e-04] [-4.33407814e-04 6.68450355e-04 -8.51223858e-04] [ 4.33407815e-04 -6.68450355e-04 -8.51223859e-04] [ 9.78573990e-04 -6.24591360e-04 -6.88941402e-04] [-9.78573991e-04 6.24591360e-04 -6.88941399e-04] [-1.07934543e-03 -6.70667200e-04 5.75671958e-04] [ 1.07934543e-03 6.70667199e-04 5.75671956e-04] [ 9.94546731e-05 4.52720284e-04 4.80917985e-04] [-9.94546727e-05 -4.52720283e-04 4.80917983e-04] [-3.31644653e-04 6.17152060e-04 -8.41378986e-04] [ 3.31644654e-04 -6.17152061e-04 -8.41378986e-04] [-1.38609152e-03 3.16268527e-04 -3.40911124e-04] [ 1.38609152e-03 -3.16268530e-04 -3.40911123e-04] [ 2.49505408e-04 1.08453729e-03 3.32888381e-05] [-2.49505408e-04 -1.08453729e-03 3.32888362e-05] [-9.97419726e-04 -1.89786005e-04 -2.93427713e-05] [ 9.97419728e-04 1.89786005e-04 -2.93427721e-05] [ 9.02652595e-04 -3.98686604e-04 -2.72666214e-05] [-9.02652595e-04 3.98686606e-04 -2.72666208e-05] [-5.16664371e-04 -4.41973241e-04 -1.47917711e-03] [ 5.16664372e-04 4.41973239e-04 -1.47917712e-03] [ 4.41324190e-04 -3.81138609e-04 1.26222715e-03] [-4.41324189e-04 3.81138609e-04 1.26222715e-03] [ 1.26074450e-04 -3.52051910e-04 -1.02398824e-04] [-1.26074450e-04 3.52051910e-04 -1.02398823e-04] [ 1.40983662e-04 -6.53114791e-05 3.13353276e-04] [-1.40983663e-04 6.53114799e-05 3.13353276e-04] [-1.35510424e-03 -4.01586965e-04 7.31986977e-04] [ 1.35510425e-03 4.01586963e-04 7.31986978e-04] [ 7.04228245e-04 -7.79732712e-04 -7.84384604e-04] [-7.04228248e-04 7.79732712e-04 -7.84384605e-04] [ 1.83003431e-04 -5.96199890e-05 5.82498135e-04] [-1.83003432e-04 5.96199896e-05 5.82498133e-04] [ 9.13476696e-05 -3.02361254e-04 -5.65158610e-04] [-9.13476694e-05 3.02361254e-04 -5.65158608e-04] [-5.83902266e-04 -1.97882970e-04 2.20358050e-05] [ 5.83902266e-04 1.97882969e-04 2.20358048e-05] [ 6.11738084e-04 -1.86344022e-06 7.84882973e-06] [-6.11738084e-04 1.86344206e-06 7.84883014e-06] [-5.75307191e-04 1.85293993e-04 -2.48254473e-04] [ 5.75307190e-04 -1.85293993e-04 -2.48254472e-04] [ 3.74381632e-04 3.78794233e-04 -1.93441740e-04] [-3.74381632e-04 -3.78794230e-04 -1.93441738e-04] [-4.51613816e-04 2.58763763e-04 1.68961358e-05] [ 4.51613816e-04 -2.58763755e-04 1.68961344e-05] [-1.00586011e-03 -4.56447541e-05 -5.93022075e-05] [ 1.00586010e-03 4.56447550e-05 -5.93022094e-05] [ 1.36148571e-03 -2.38912755e-04 1.46685594e-04] [-1.36148571e-03 2.38912755e-04 1.46685592e-04] [-1.92729460e-04 5.98753211e-05 1.82464062e-05] [ 1.92729460e-04 -5.98753180e-05 1.82464062e-05] [-7.92261853e-04 5.02334730e-04 1.54074371e-04] [ 7.92261851e-04 -5.02334726e-04 1.54074373e-04] [ 6.26442332e-04 5.70602530e-05 -3.19572924e-04] [-6.26442329e-04 -5.70602504e-05 -3.19572925e-04] [ 7.82855345e-04 5.04508605e-04 5.97355114e-04] [-7.82855344e-04 -5.04508603e-04 5.97355113e-04] [-1.13414832e-03 1.10959833e-03 2.14644287e-04] [ 1.13414832e-03 -1.10959833e-03 2.14644288e-04]] Final stress: [-1.57805432e-06 -1.99622199e-06 -7.11582078e-06 1.09591868e-15 -3.22680527e-16 1.75558175e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 8 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 7.15847387e-04 7.42513827e-03 -4.24188032e-04] [-7.15847384e-04 -7.42513826e-03 -4.24188030e-04] [ 1.45571457e-03 7.17741557e-04 -1.46901188e-03] [-1.45571458e-03 -7.17741566e-04 -1.46901188e-03] [ 1.97304928e-03 2.39629216e-04 -6.55367674e-04] [-1.97304929e-03 -2.39629221e-04 -6.55367674e-04] [-2.43955831e-03 1.69614806e-03 -1.59794417e-03] [ 2.43955832e-03 -1.69614804e-03 -1.59794416e-03] [ 1.99358296e-04 5.11976193e-03 -5.71683282e-05] [-1.99358295e-04 -5.11976195e-03 -5.71683237e-05] [-1.47559852e-03 -1.39466435e-03 -7.67023740e-04] [ 1.47559852e-03 1.39466436e-03 -7.67023754e-04] [-2.42316180e-03 1.62736799e-03 -3.44698384e-04] [ 2.42316181e-03 -1.62736799e-03 -3.44698366e-04] [-2.30665840e-03 -7.74360811e-04 8.01190685e-03] [ 2.30665840e-03 7.74360798e-04 8.01190684e-03] [-1.50539738e-03 2.08317668e-03 -1.65842381e-03] [ 1.50539738e-03 -2.08317668e-03 -1.65842381e-03] [ 1.11009261e-03 -3.28469686e-03 2.15747375e-03] [-1.11009260e-03 3.28469685e-03 2.15747375e-03] [ 4.78912953e-03 -3.88816644e-03 1.38405640e-03] [-4.78912953e-03 3.88816645e-03 1.38405640e-03] [-2.76336226e-03 -4.33331281e-04 1.95110220e-03] [ 2.76336225e-03 4.33331286e-04 1.95110221e-03] [ 8.79820499e-04 -3.68134238e-03 -6.61558126e-04] [-8.79820498e-04 3.68134236e-03 -6.61558146e-04] [-5.14620689e-04 4.67250993e-04 -6.67805541e-03] [ 5.14620695e-04 -4.67250987e-04 -6.67805541e-03] [ 2.21434561e-03 5.22786333e-03 1.47690891e-03] [-2.21434560e-03 -5.22786333e-03 1.47690891e-03] [-3.97941624e-04 -5.27916773e-03 6.87878574e-04] [ 3.97941621e-04 5.27916772e-03 6.87878568e-04] [-2.85097403e-03 -2.43860270e-03 1.22692333e-04] [ 2.85097403e-03 2.43860269e-03 1.22692322e-04] [-4.29173231e-03 2.26884092e-03 2.02700441e-03] [ 4.29173230e-03 -2.26884092e-03 2.02700439e-03] [-7.52477355e-04 1.45778996e-03 3.28235688e-03] [ 7.52477354e-04 -1.45778997e-03 3.28235687e-03] [-1.02863644e-03 2.49364878e-03 2.10655046e-03] [ 1.02863645e-03 -2.49364879e-03 2.10655045e-03] [ 1.41443582e-06 3.51669158e-05 -2.19480905e-03] [-1.41445858e-06 -3.51669305e-05 -2.19480904e-03] [-2.70917798e-03 -5.51096270e-03 -3.48695058e-03] [ 2.70917798e-03 5.51096269e-03 -3.48695057e-03] [-1.78746849e-03 1.47658580e-03 3.04421649e-03] [ 1.78746848e-03 -1.47658579e-03 3.04421649e-03] [-2.39224716e-03 2.52923792e-03 2.62403539e-03] [ 2.39224715e-03 -2.52923792e-03 2.62403540e-03] [ 5.94356991e-04 -7.90412732e-04 -1.77011645e-03] [-5.94356975e-04 7.90412737e-04 -1.77011645e-03] [ 9.90178548e-05 -1.33314059e-03 -2.19477197e-03] [-9.90178651e-05 1.33314059e-03 -2.19477198e-03] [-3.27321007e-03 -2.16332514e-04 -2.65522383e-03] [ 3.27321007e-03 2.16332520e-04 -2.65522382e-03] [ 4.91821144e-04 -4.31483906e-04 5.34671456e-03] [-4.91821165e-04 4.31483881e-04 5.34671457e-03] [-5.81910148e-03 -3.43608226e-04 3.34044944e-04] [ 5.81910147e-03 3.43608223e-04 3.34044943e-04] [-2.55802417e-04 4.00684066e-03 -2.56690055e-03] [ 2.55802416e-04 -4.00684065e-03 -2.56690055e-03] [-4.33675886e-03 -1.90319112e-03 3.69856039e-04] [ 4.33675887e-03 1.90319113e-03 3.69856032e-04] [-3.45997840e-04 2.12666062e-03 4.60030569e-03] [ 3.45997835e-04 -2.12666062e-03 4.60030569e-03] [-1.21810390e-03 2.47908205e-03 -5.87140223e-03] [ 1.21810391e-03 -2.47908205e-03 -5.87140223e-03] [-1.39926448e-03 -6.09121764e-04 4.90024475e-03] [ 1.39926448e-03 6.09121761e-04 4.90024476e-03] [ 2.30016666e-04 1.66902954e-03 -7.26022153e-04] [-2.30016662e-04 -1.66902954e-03 -7.26022150e-04] [ 5.55103693e-03 -5.07656680e-03 -4.38275683e-03] [-5.55103693e-03 5.07656679e-03 -4.38275683e-03] [-8.67773090e-03 -8.03037731e-04 -9.41882896e-04] [ 8.67773090e-03 8.03037751e-04 -9.41882894e-04] [ 2.51438064e-03 1.56675630e-04 -2.11237407e-03] [-2.51438064e-03 -1.56675622e-04 -2.11237407e-03] [-1.57107219e-03 4.10956042e-04 -2.13840257e-04] [ 1.57107219e-03 -4.10956026e-04 -2.13840259e-04] [-2.23336393e-04 1.78844639e-03 -1.33561982e-03] [ 2.23336377e-04 -1.78844638e-03 -1.33561981e-03] [ 1.47122140e-03 3.35694005e-04 4.67429664e-04] [-1.47122140e-03 -3.35694013e-04 4.67429678e-04] [-3.76855964e-05 2.86058569e-03 -2.77125462e-03] [ 3.76856024e-05 -2.86058571e-03 -2.77125461e-03] [-3.24524743e-03 -1.26171842e-03 8.91153185e-04] [ 3.24524745e-03 1.26171842e-03 8.91153180e-04] [ 1.31778191e-03 -3.68275302e-03 -2.52581304e-03] [-1.31778191e-03 3.68275302e-03 -2.52581304e-03] [-2.35160154e-04 -3.11977906e-04 -1.24115819e-03] [ 2.35160163e-04 3.11977914e-04 -1.24115819e-03] [-3.78422650e-03 -3.04474275e-03 4.76152620e-04] [ 3.78422650e-03 3.04474275e-03 4.76152623e-04] [ 1.53822543e-03 9.50614102e-04 2.59251645e-03] [-1.53822542e-03 -9.50614095e-04 2.59251647e-03] [ 3.87939560e-03 -3.89329335e-03 -3.78497665e-04] [-3.87939559e-03 3.89329334e-03 -3.78497672e-04] [ 2.05505656e-03 3.90692558e-04 -4.79103949e-04] [-2.05505657e-03 -3.90692572e-04 -4.79103931e-04] [-1.28739603e-03 6.32508121e-04 1.13912859e-03] [ 1.28739604e-03 -6.32508101e-04 1.13912860e-03] [ 3.19851724e-03 8.00872946e-04 2.16820854e-03] [-3.19851725e-03 -8.00872943e-04 2.16820853e-03]] Final stress: [ 1.18363497e-06 2.39270194e-05 -3.11687442e-05 -3.21552214e-14 -1.29285358e-14 -8.03227600e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.94501722e-03 1.79902623e-03 2.31349667e-04] [ 1.94501722e-03 -1.79902626e-03 2.31349667e-04] [-1.92828108e-03 5.53950833e-04 -8.56833108e-04] [ 1.92828108e-03 -5.53950828e-04 -8.56833099e-04] [-1.27658121e-03 -6.18574302e-04 -7.42847019e-04] [ 1.27658121e-03 6.18574295e-04 -7.42847030e-04] [ 3.94055513e-03 8.65203840e-05 -1.64072675e-03] [-3.94055514e-03 -8.65204046e-05 -1.64072679e-03] [ 5.58775121e-05 6.27042400e-03 -2.18371120e-03] [-5.58775109e-05 -6.27042399e-03 -2.18371121e-03] [-1.91352117e-04 -1.25350110e-03 -1.21474888e-03] [ 1.91352113e-04 1.25350110e-03 -1.21474887e-03] [ 2.13413498e-03 -1.85187977e-04 -1.21738625e-04] [-2.13413499e-03 1.85187974e-04 -1.21738634e-04] [ 2.46386384e-03 1.76410605e-04 4.34838025e-03] [-2.46386384e-03 -1.76410602e-04 4.34838026e-03] [ 4.45637657e-04 1.46504214e-03 -1.30619934e-03] [-4.45637649e-04 -1.46504213e-03 -1.30619932e-03] [ 1.42892511e-04 -2.49789532e-03 8.00620133e-04] [-1.42892517e-04 2.49789531e-03 8.00620152e-04] [-5.32957550e-03 -5.09453095e-03 2.83251369e-03] [ 5.32957550e-03 5.09453094e-03 2.83251370e-03] [ 5.65338438e-03 9.27190561e-04 -1.36023143e-04] [-5.65338438e-03 -9.27190565e-04 -1.36023133e-04] [-2.06687438e-03 -1.44363730e-04 -1.22313254e-03] [ 2.06687437e-03 1.44363735e-04 -1.22313254e-03] [ 5.96552213e-05 4.35927609e-04 -3.45556669e-03] [-5.96552245e-05 -4.35927611e-04 -3.45556669e-03] [-2.37653649e-03 5.20612319e-03 7.78931467e-04] [ 2.37653649e-03 -5.20612320e-03 7.78931472e-04] [ 2.22037037e-04 -4.39461489e-03 1.14908558e-03] [-2.22037042e-04 4.39461489e-03 1.14908558e-03] [ 4.28158691e-03 -1.09611134e-03 -1.16425542e-03] [-4.28158691e-03 1.09611132e-03 -1.16425541e-03] [-3.32204751e-04 -2.68647728e-03 5.20374331e-03] [ 3.32204754e-04 2.68647728e-03 5.20374331e-03] [-2.78943715e-03 -4.46690398e-04 8.83492908e-04] [ 2.78943715e-03 4.46690400e-04 8.83492907e-04] [ 9.20685839e-04 1.24131552e-03 -1.23112411e-03] [-9.20685835e-04 -1.24131553e-03 -1.23112412e-03] [-2.37953039e-03 -7.44863545e-04 4.51440575e-03] [ 2.37953042e-03 7.44863549e-04 4.51440576e-03] [-4.46502400e-04 -5.81142494e-05 2.62469692e-03] [ 4.46502411e-04 5.81142505e-05 2.62469693e-03] [-3.28022752e-03 8.66664875e-03 -2.23028927e-03] [ 3.28022751e-03 -8.66664874e-03 -2.23028927e-03] [ 8.60892210e-05 -5.07042749e-04 -2.63818426e-03] [-8.60892397e-05 5.07042744e-04 -2.63818425e-03] [-2.31689731e-03 -3.77400054e-03 3.13883079e-03] [ 2.31689732e-03 3.77400054e-03 3.13883078e-03] [-1.47558731e-03 1.44846459e-03 -2.22279193e-03] [ 1.47558732e-03 -1.44846459e-03 -2.22279194e-03] [ 9.87746780e-04 -5.82994620e-04 -4.67782708e-03] [-9.87746780e-04 5.82994617e-04 -4.67782707e-03] [-5.83225285e-03 -2.01546546e-03 5.82737935e-04] [ 5.83225287e-03 2.01546548e-03 5.82737927e-04] [ 1.25363834e-03 -5.62271244e-04 5.76674388e-03] [-1.25363834e-03 5.62271227e-04 5.76674389e-03] [-4.45746960e-03 2.87764924e-03 -8.06410153e-04] [ 4.45746959e-03 -2.87764924e-03 -8.06410154e-04] [ 9.31137660e-04 -3.09056239e-03 -4.85120166e-04] [-9.31137646e-04 3.09056239e-03 -4.85120155e-04] [-2.29138992e-03 -1.31421631e-03 -8.18169838e-03] [ 2.29138992e-03 1.31421630e-03 -8.18169839e-03] [ 5.30165249e-04 -1.30915205e-03 5.10490867e-03] [-5.30165246e-04 1.30915204e-03 5.10490868e-03] [-8.53966489e-04 -7.20383294e-04 -1.12173163e-03] [ 8.53966485e-04 7.20383302e-04 -1.12173164e-03] [-1.12931324e-03 7.96486430e-04 3.36925086e-03] [ 1.12931324e-03 -7.96486422e-04 3.36925085e-03] [-1.05747871e-02 6.71122993e-04 -1.37688317e-03] [ 1.05747870e-02 -6.71122982e-04 -1.37688317e-03] [ 5.82781602e-03 2.28284429e-03 -4.42155851e-03] [-5.82781603e-03 -2.28284429e-03 -4.42155851e-03] [-1.89378806e-03 -1.12857625e-03 1.47253917e-03] [ 1.89378805e-03 1.12857626e-03 1.47253916e-03] [ 1.84058069e-03 7.09972189e-04 -2.82454057e-03] [-1.84058068e-03 -7.09972187e-04 -2.82454056e-03] [-1.62499164e-04 1.12474749e-03 7.08930991e-04] [ 1.62499165e-04 -1.12474749e-03 7.08930994e-04] [ 9.44122736e-04 8.49845540e-04 1.31132466e-03] [-9.44122745e-04 -8.49845542e-04 1.31132465e-03] [ 8.37301334e-04 2.19199328e-03 -2.74954121e-03] [-8.37301340e-04 -2.19199328e-03 -2.74954122e-03] [ 3.35777014e-03 -1.44460806e-03 -1.28577832e-03] [-3.35777015e-03 1.44460807e-03 -1.28577830e-03] [-4.08804378e-04 -1.26053703e-03 -1.51775195e-03] [ 4.08804392e-04 1.26053705e-03 -1.51775193e-03] [-2.62362082e-03 -1.29397524e-03 -1.53400810e-03] [ 2.62362082e-03 1.29397525e-03 -1.53400810e-03] [ 5.25833173e-03 -2.12881778e-03 1.38132420e-03] [-5.25833173e-03 2.12881777e-03 1.38132419e-03] [-2.36401424e-03 -1.42536109e-05 2.58650140e-03] [ 2.36401424e-03 1.42535967e-05 2.58650140e-03] [ 1.71953941e-03 4.24039817e-04 5.41561357e-04] [-1.71953942e-03 -4.24039813e-04 5.41561353e-04] [ 3.81746777e-03 3.45077392e-03 -3.90206952e-04] [-3.81746776e-03 -3.45077391e-03 -3.90206961e-04] [ 4.72715343e-03 -7.99496798e-05 2.54327935e-03] [-4.72715343e-03 7.99496698e-05 2.54327934e-03] [-1.13224199e-03 -7.72910020e-04 1.86607552e-03] [ 1.13224198e-03 7.72910039e-04 1.86607553e-03]] Final stress: [-6.43008522e-06 4.03461452e-05 -4.69872119e-05 -7.90674737e-15 1.04977130e-14 1.00840723e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.59473799e-04 -1.17523306e-06 1.59022715e-06] [-1.59473799e-04 1.17522093e-06 1.59022964e-06] [ 1.37224571e-04 1.09060650e-05 3.55189950e-05] [-1.37224572e-04 -1.09060657e-05 3.55189955e-05] [ 1.66520593e-04 -2.16258131e-04 1.50372691e-04] [-1.66520593e-04 2.16258131e-04 1.50372691e-04] [-2.17670694e-04 8.80443877e-05 -2.00164635e-05] [ 2.17670693e-04 -8.80443872e-05 -2.00164628e-05] [ 3.27720329e-05 -2.86241586e-04 1.65923234e-04] [-3.27720328e-05 2.86241586e-04 1.65923235e-04] [ 3.88270722e-05 1.98692291e-04 -6.12233381e-05] [-3.88270724e-05 -1.98692291e-04 -6.12233372e-05] [-1.49029428e-04 -1.11276722e-04 2.57665544e-05] [ 1.49029429e-04 1.11276722e-04 2.57665533e-05] [-4.16930160e-04 2.28910683e-04 -2.04624293e-04] [ 4.16930161e-04 -2.28910679e-04 -2.04624291e-04] [ 4.21234498e-05 -1.31508608e-04 1.75331413e-04] [-4.21234497e-05 1.31508609e-04 1.75331414e-04] [ 3.36576795e-05 8.40654787e-05 2.93116918e-05] [-3.36576794e-05 -8.40654794e-05 2.93116917e-05] [ 2.67950338e-04 1.83506511e-04 -2.60646247e-04] [-2.67950338e-04 -1.83506511e-04 -2.60646247e-04] [-1.83956784e-04 -5.37195624e-05 -4.72378656e-05] [ 1.83956784e-04 5.37195690e-05 -4.72378666e-05] [-3.10667850e-05 1.62151673e-04 -9.55377036e-05] [ 3.10667846e-05 -1.62151671e-04 -9.55377031e-05] [-3.77604330e-06 -2.85155249e-04 5.26768350e-05] [ 3.77604332e-06 2.85155247e-04 5.26768348e-05] [ 1.83188124e-04 -2.28544862e-04 2.29404260e-04] [-1.83188124e-04 2.28544861e-04 2.29404260e-04] [ 1.40188083e-05 2.23540569e-04 -2.16673546e-04] [-1.40188081e-05 -2.23540569e-04 -2.16673545e-04] [-2.04860632e-04 -5.11527657e-05 -8.61031638e-06] [ 2.04860631e-04 5.11527680e-05 -8.61031658e-06] [-1.41479610e-04 8.96758197e-05 -1.52003123e-04] [ 1.41479610e-04 -8.96758191e-05 -1.52003123e-04] [ 1.25037612e-04 2.55497455e-04 -4.02926465e-05] [-1.25037612e-04 -2.55497455e-04 -4.02926469e-05] [ 6.00132868e-05 -1.28405453e-04 1.39715497e-04] [-6.00132865e-05 1.28405455e-04 1.39715498e-04] [-1.35890452e-04 1.01160695e-04 -1.93786884e-04] [ 1.35890453e-04 -1.01160693e-04 -1.93786887e-04] [ 9.94497418e-05 -1.11448427e-04 -1.76628781e-04] [-9.94497417e-05 1.11448427e-04 -1.76628781e-04] [ 1.81156881e-04 -2.84470612e-04 1.27812598e-04] [-1.81156882e-04 2.84470612e-04 1.27812598e-04] [ 6.28533855e-06 8.62308642e-05 2.37399429e-04] [-6.28534020e-06 -8.62308645e-05 2.37399430e-04] [-5.16244678e-06 5.61273733e-05 -8.78313082e-05] [ 5.16244875e-06 -5.61273736e-05 -8.78313076e-05] [ 3.88951728e-05 2.15949556e-05 6.98219135e-05] [-3.88951724e-05 -2.15949559e-05 6.98219131e-05] [-5.56403604e-05 -8.72394276e-05 2.09527951e-04] [ 5.56403597e-05 8.72394275e-05 2.09527950e-04] [ 1.25244567e-04 -2.75816877e-05 -1.84204121e-04] [-1.25244567e-04 2.75816892e-05 -1.84204122e-04] [-5.08589787e-05 -1.87962436e-04 -2.90793128e-04] [ 5.08589774e-05 1.87962437e-04 -2.90793127e-04] [ 3.53885452e-04 -5.81933798e-05 -6.19641982e-07] [-3.53885451e-04 5.81933787e-05 -6.19642501e-07] [-6.86264126e-05 3.65948884e-05 8.31098998e-05] [ 6.86264122e-05 -3.65948890e-05 8.31098999e-05] [ 8.90514135e-05 2.61935143e-04 1.50855673e-04] [-8.90514145e-05 -2.61935145e-04 1.50855671e-04] [ 2.21005139e-05 4.71352624e-05 -2.55730948e-04] [-2.21005123e-05 -4.71352649e-05 -2.55730946e-04] [ 2.12207569e-04 6.45404490e-05 2.44913649e-04] [-2.12207569e-04 -6.45404487e-05 2.44913650e-04] [ 9.56759994e-05 -3.61648265e-05 -8.47222535e-05] [-9.56759986e-05 3.61648270e-05 -8.47222534e-05] [ 2.88889019e-04 1.67207391e-04 5.87954632e-05] [-2.88889019e-04 -1.67207392e-04 5.87954630e-05] [-9.88891561e-05 1.53380602e-04 1.25822129e-04] [ 9.88891558e-05 -1.53380604e-04 1.25822128e-04] [ 1.72272300e-04 7.97491452e-05 -1.73802280e-04] [-1.72272300e-04 -7.97491452e-05 -1.73802280e-04] [ 3.92456372e-05 -3.37224524e-05 -2.65929921e-05] [-3.92456370e-05 3.37224524e-05 -2.65929921e-05] [ 2.42876634e-04 -1.92989251e-05 -3.48471272e-05] [-2.42876634e-04 1.92989249e-05 -3.48471277e-05] [ 1.39624330e-04 2.65685985e-05 3.88762352e-06] [-1.39624330e-04 -2.65685992e-05 3.88762415e-06] [ 2.23735552e-05 -4.95076968e-05 1.71443537e-05] [-2.23735546e-05 4.95076963e-05 1.71443528e-05] [-1.44847030e-05 -2.97599095e-06 8.24527129e-05] [ 1.44847028e-05 2.97599067e-06 8.24527131e-05] [-2.26270168e-04 -2.24497795e-04 1.28252007e-04] [ 2.26270168e-04 2.24497802e-04 1.28252006e-04] [-2.79397115e-05 -7.66936765e-05 -5.84243614e-05] [ 2.79397111e-05 7.66936767e-05 -5.84243620e-05] [-2.36587328e-04 1.41306036e-05 3.28418789e-05] [ 2.36587328e-04 -1.41306036e-05 3.28418792e-05] [ 3.43951890e-05 9.04850062e-06 -1.01277314e-04] [-3.43951907e-05 -9.04850626e-06 -1.01277314e-04] [-7.04761934e-05 2.11238400e-04 -1.21933592e-05] [ 7.04761921e-05 -2.11238398e-04 -1.21933607e-05] [-9.21515108e-05 -7.17855957e-05 2.72790700e-04] [ 9.21515122e-05 7.17855979e-05 2.72790701e-04] [-2.92889077e-04 -1.05434853e-04 -5.67310200e-05] [ 2.92889076e-04 1.05434852e-04 -5.67310203e-05] [ 6.07533829e-05 6.87226287e-06 -5.98831969e-06] [-6.07533814e-05 -6.87226454e-06 -5.98831861e-06]] Final stress: [-1.57465000e-05 -9.86087714e-06 -1.54455144e-05 1.22620471e-15 -2.28748130e-15 -6.09526707e-06] Minimization converged after 118 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.73077113e-04 -2.85702901e-05 5.13111542e-06] [-1.73077113e-04 2.85702799e-05 5.13111697e-06] [ 1.78436097e-04 -2.84664420e-04 -8.36405596e-06] [-1.78436097e-04 2.84664417e-04 -8.36405529e-06] [ 1.48605309e-04 -5.12723087e-07 1.15585113e-04] [-1.48605309e-04 5.12721774e-07 1.15585111e-04] [-2.23206038e-04 2.52260849e-04 1.21531668e-05] [ 2.23206037e-04 -2.52260848e-04 1.21531692e-05] [ 8.57647210e-05 -1.46333622e-04 9.47755213e-05] [-8.57647207e-05 1.46333622e-04 9.47755207e-05] [ 3.65720344e-05 6.47424457e-06 -1.80994167e-04] [-3.65720350e-05 -6.47424422e-06 -1.80994167e-04] [-2.11060538e-04 1.56103164e-05 1.08041153e-04] [ 2.11060538e-04 -1.56103144e-05 1.08041153e-04] [-5.54738864e-04 3.95480942e-04 2.49076206e-05] [ 5.54738864e-04 -3.95480937e-04 2.49076227e-05] [ 3.75787938e-05 -1.87195848e-04 1.90115613e-04] [-3.75787937e-05 1.87195848e-04 1.90115613e-04] [ 1.48853143e-04 -1.15205755e-04 -6.52900955e-05] [-1.48853143e-04 1.15205754e-04 -6.52900956e-05] [ 2.67998308e-04 2.47373620e-04 2.96246468e-05] [-2.67998308e-04 -2.47373620e-04 2.96246485e-05] [-1.49567585e-04 1.00462875e-05 -1.13808320e-04] [ 1.49567585e-04 -1.00462656e-05 -1.13808325e-04] [-4.07972894e-05 -1.46351269e-05 -1.66931460e-04] [ 4.07972887e-05 1.46351223e-05 -1.66931469e-04] [ 2.36055466e-06 -3.71831935e-04 -1.94925133e-04] [-2.36055467e-06 3.71831928e-04 -1.94925139e-04] [ 2.52097773e-04 -8.36293294e-05 2.83276420e-04] [-2.52097773e-04 8.36293300e-05 2.83276419e-04] [-1.33472805e-06 -1.13476465e-04 -1.57611653e-04] [ 1.33472723e-06 1.13476466e-04 -1.57611651e-04] [-1.87697998e-04 1.51932669e-04 -3.74784967e-05] [ 1.87697998e-04 -1.51932668e-04 -3.74784958e-05] [-6.70620333e-05 1.19702843e-04 1.15483118e-05] [ 6.70620337e-05 -1.19702843e-04 1.15483110e-05] [ 3.06348169e-04 2.29518721e-04 3.83914605e-05] [-3.06348169e-04 -2.29518720e-04 3.83914600e-05] [ 9.69570068e-05 -6.89534705e-05 1.63476012e-04] [-9.69570099e-05 6.89534752e-05 1.63476016e-04] [-1.60863668e-04 1.81461259e-04 -1.26866682e-04] [ 1.60863669e-04 -1.81461255e-04 -1.26866685e-04] [ 7.55639251e-05 -3.41864727e-04 -2.32199536e-04] [-7.55639250e-05 3.41864727e-04 -2.32199535e-04] [ 6.99615091e-05 1.00833998e-05 1.29796659e-04] [-6.99615087e-05 -1.00833999e-05 1.29796659e-04] [ 8.68555052e-05 -3.02557513e-05 1.99132362e-04] [-8.68555082e-05 3.02557518e-05 1.99132361e-04] [ 5.72644982e-05 7.20269894e-05 -5.67358952e-05] [-5.72644956e-05 -7.20269880e-05 -5.67358946e-05] [ 2.04370621e-04 9.72504967e-05 -1.35030957e-05] [-2.04370620e-04 -9.72504979e-05 -1.35030959e-05] [ 1.28132340e-05 -2.13878239e-04 -2.07575070e-05] [-1.28132343e-05 2.13878237e-04 -2.07575072e-05] [ 1.99132504e-04 -1.71366669e-04 -1.11190458e-06] [-1.99132503e-04 1.71366671e-04 -1.11190394e-06] [ 1.06678032e-05 -1.01873585e-04 -1.12061073e-04] [-1.06678023e-05 1.01873586e-04 -1.12061073e-04] [ 1.88039168e-04 -2.50765137e-05 -6.14694118e-05] [-1.88039168e-04 2.50765124e-05 -6.14694112e-05] [-2.35950252e-04 -1.06244303e-05 1.78091582e-04] [ 2.35950252e-04 1.06244289e-05 1.78091583e-04] [ 3.77096909e-05 4.28370604e-04 1.50981644e-04] [-3.77096903e-05 -4.28370605e-04 1.50981643e-04] [ 1.44443598e-05 -2.76624391e-06 -8.12308795e-05] [-1.44443587e-05 2.76624157e-06 -8.12308770e-05] [ 2.22072480e-04 1.28291059e-04 2.14479771e-04] [-2.22072481e-04 -1.28291060e-04 2.14479770e-04] [ 1.65430738e-04 -3.82091195e-05 -2.48051504e-04] [-1.65430739e-04 3.82091188e-05 -2.48051502e-04] [ 2.04530323e-04 2.08113257e-04 -5.29886901e-05] [-2.04530322e-04 -2.08113260e-04 -5.29886890e-05] [ 7.25468364e-06 2.43575206e-04 -6.59506896e-05] [-7.25468289e-06 -2.43575208e-04 -6.59506904e-05] [ 1.78556622e-04 1.77079235e-04 -1.44312513e-04] [-1.78556622e-04 -1.77079235e-04 -1.44312513e-04] [-7.40670750e-05 -1.10555078e-04 -1.07986950e-04] [ 7.40670749e-05 1.10555079e-04 -1.07986950e-04] [ 3.11949094e-04 -9.20680114e-06 6.28751550e-05] [-3.11949094e-04 9.20680456e-06 6.28751577e-05] [ 3.54027051e-04 3.90970845e-04 3.69885165e-06] [-3.54027051e-04 -3.90970845e-04 3.69885075e-06] [ 5.47793896e-05 1.81214300e-04 7.67792882e-05] [-5.47793900e-05 -1.81214300e-04 7.67792879e-05] [ 6.10057759e-05 4.60606205e-05 -1.56170484e-04] [-6.10057762e-05 -4.60606211e-05 -1.56170485e-04] [-2.68309586e-04 -3.48490481e-04 7.60334531e-05] [ 2.68309584e-04 3.48490490e-04 7.60334525e-05] [-2.25060630e-04 -3.71140785e-04 7.51627636e-05] [ 2.25060630e-04 3.71140785e-04 7.51627638e-05] [-1.85746263e-04 5.32017347e-05 -1.17073000e-04] [ 1.85746263e-04 -5.32017352e-05 -1.17073001e-04] [ 2.91803116e-06 1.47448226e-04 -1.57711653e-05] [-2.91802931e-06 -1.47448242e-04 -1.57711654e-05] [ 5.19841810e-05 3.44617479e-04 -1.23311663e-04] [-5.19841823e-05 -3.44617477e-04 -1.23311664e-04] [ 1.08293447e-04 -1.86944667e-06 2.23719641e-04] [-1.08293446e-04 1.86944754e-06 2.23719641e-04] [-1.76039537e-04 -7.48530745e-05 6.79078620e-05] [ 1.76039537e-04 7.48530720e-05 6.79078686e-05] [ 1.78748625e-04 9.11358258e-05 1.27270844e-04] [-1.78748624e-04 -9.11358277e-05 1.27270837e-04]] Final stress: [ 6.38022421e-06 1.19825506e-05 -3.65405615e-06 -3.78008493e-15 7.62470499e-16 -5.69475158e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.22128404e-04 -9.87265036e-06 6.01523257e-06] [ 2.22128405e-04 9.87262003e-06 6.01523985e-06] [-2.37128107e-04 -4.18845204e-04 -9.09019334e-06] [ 2.37128108e-04 4.18845203e-04 -9.09019475e-06] [-2.36197542e-04 2.44494782e-06 1.64624918e-04] [ 2.36197542e-04 -2.44494913e-06 1.64624919e-04] [ 2.98387319e-04 4.32485101e-04 -3.35195798e-05] [-2.98387318e-04 -4.32485087e-04 -3.35195600e-05] [-8.36603392e-05 -2.03338681e-04 1.67829283e-04] [ 8.36603389e-05 2.03338682e-04 1.67829278e-04] [-3.18740017e-05 3.81910341e-06 -2.73025033e-04] [ 3.18740018e-05 -3.81910358e-06 -2.73025030e-04] [ 3.13593543e-04 2.20827892e-05 1.32814326e-04] [-3.13593543e-04 -2.20827904e-05 1.32814324e-04] [ 8.21907628e-04 5.64535262e-04 6.29280409e-05] [-8.21907628e-04 -5.64535253e-04 6.29280513e-05] [-4.11658289e-05 -2.85829736e-04 2.83586203e-04] [ 4.11658292e-05 2.85829733e-04 2.83586203e-04] [-2.21767961e-04 -1.59940463e-04 -8.45714097e-05] [ 2.21767961e-04 1.59940458e-04 -8.45714128e-05] [-4.48275998e-04 3.55137533e-04 2.56354643e-06] [ 4.48275998e-04 -3.55137533e-04 2.56354877e-06] [ 2.26003943e-04 3.05109784e-05 -1.51123284e-04] [-2.26003944e-04 -3.05109776e-05 -1.51123282e-04] [ 5.14302310e-05 -1.12796436e-04 -1.27086499e-04] [-5.14302313e-05 1.12796440e-04 -1.27086497e-04] [-2.76662054e-05 -5.33911076e-04 -2.83514768e-04] [ 2.76662055e-05 5.33911069e-04 -2.83514768e-04] [-3.39444394e-04 -1.20778888e-04 4.16695337e-04] [ 3.39444395e-04 1.20778888e-04 4.16695334e-04] [-4.42600967e-05 -1.78908347e-04 -2.25263511e-04] [ 4.42600967e-05 1.78908347e-04 -2.25263510e-04] [ 2.50995378e-04 2.20534717e-04 -6.37617542e-05] [-2.50995378e-04 -2.20534713e-04 -6.37617566e-05] [ 4.54694988e-04 -3.46890429e-04 3.54317885e-05] [-4.54694987e-04 3.46890430e-04 3.54317885e-05] [-7.74659564e-05 -1.79966054e-04 1.26114665e-05] [ 7.74659560e-05 1.79966055e-04 1.26114653e-05] [-2.02800086e-04 -2.28665662e-04 -2.26672620e-04] [ 2.02800087e-04 2.28665662e-04 -2.26672620e-04] [ 8.91771299e-05 9.04684680e-05 2.22380253e-04] [-8.91771334e-05 -9.04684686e-05 2.22380254e-04] [ 1.56739680e-04 1.18391512e-05 1.99693269e-04] [-1.56739681e-04 -1.18391507e-05 1.99693269e-04] [ 9.84076827e-05 5.13446855e-04 -3.45986361e-04] [-9.84076841e-05 -5.13446854e-04 -3.45986361e-04] [ 9.10595910e-05 -1.21231158e-04 -3.20899480e-05] [-9.10595946e-05 1.21231154e-04 -3.20899447e-05] [ 1.20078455e-04 2.94114272e-05 2.60092337e-04] [-1.20078452e-04 -2.94114301e-05 2.60092333e-04] [ 2.17194349e-05 2.96700169e-04 -3.84723979e-05] [-2.17194333e-05 -2.96700170e-04 -3.84723961e-05] [ 3.20617256e-04 -1.75159830e-04 1.50914943e-05] [-3.20617258e-04 1.75159829e-04 1.50914922e-05] [ 4.55979231e-05 2.05869142e-04 -1.37402607e-04] [-4.55979215e-05 -2.05869134e-04 -1.37402611e-04] [ 3.24314892e-04 2.37537137e-04 1.40040273e-05] [-3.24314895e-04 -2.37537130e-04 1.40040301e-05] [-3.34199256e-04 8.53222612e-06 2.70302840e-04] [ 3.34199258e-04 -8.53222537e-06 2.70302840e-04] [ 3.13260983e-04 6.27161445e-05 -8.88683192e-05] [-3.13260983e-04 -6.27161436e-05 -8.88683182e-05] [-2.54884111e-05 -4.34795683e-06 -1.31322887e-04] [ 2.54884074e-05 4.34795151e-06 -1.31322891e-04] [ 5.57523155e-05 -5.86950850e-04 2.90573192e-04] [-5.57523122e-05 5.86950845e-04 2.90573196e-04] [ 2.81069170e-04 5.01112798e-05 -3.56748745e-04] [-2.81069170e-04 -5.01112796e-05 -3.56748744e-04] [ 3.46467766e-04 -2.08996983e-04 3.43655075e-04] [-3.46467765e-04 2.08996983e-04 3.43655073e-04] [-1.24494686e-05 -3.30046207e-04 -8.83841838e-05] [ 1.24494667e-05 3.30046208e-04 -8.83841856e-05] [ 3.77197245e-04 -2.26172505e-04 -1.05795753e-04] [-3.77197243e-04 2.26172506e-04 -1.05795752e-04] [-1.07571856e-04 1.66919317e-04 -1.86917072e-04] [ 1.07571857e-04 -1.66919316e-04 -1.86917067e-04] [ 2.93709280e-04 -2.65335154e-04 -2.51648193e-04] [-2.93709282e-04 2.65335155e-04 -2.51648198e-04] [-4.21194169e-04 3.77642054e-05 7.21113096e-05] [ 4.21194169e-04 -3.77642081e-05 7.21113082e-05] [-4.40134482e-04 6.03005911e-04 9.03552690e-06] [ 4.40134482e-04 -6.03005911e-04 9.03552643e-06] [-8.63463505e-05 2.52211591e-04 1.12450587e-04] [ 8.63463512e-05 -2.52211590e-04 1.12450585e-04] [-7.47407187e-05 2.96896774e-05 -2.03295434e-04] [ 7.47407188e-05 -2.96896885e-05 -2.03295446e-04] [ 3.62154364e-04 -5.06739813e-04 7.87682294e-05] [-3.62154364e-04 5.06739836e-04 7.87682278e-05] [ 2.43948171e-04 -5.62033374e-04 1.09471264e-04] [-2.43948171e-04 5.62033372e-04 1.09471264e-04] [ 2.89488394e-04 9.84475562e-05 -1.84112124e-04] [-2.89488395e-04 -9.84475580e-05 -1.84112123e-04] [-4.89206502e-07 1.86167311e-04 4.90309070e-07] [ 4.89209198e-07 -1.86167307e-04 4.90309332e-07] [ 1.79925417e-04 3.49103962e-05 3.69133450e-04] [-1.79925417e-04 -3.49103938e-05 3.69133438e-04] [ 8.37668092e-05 -4.56285937e-04 -1.77338183e-04] [-8.37668097e-05 4.56285940e-04 -1.77338171e-04] [ 2.67012916e-04 -1.02746411e-04 1.29686435e-04] [-2.67012917e-04 1.02746408e-04 1.29686433e-04] [-2.21545495e-04 1.21310060e-04 2.39711114e-05] [ 2.21545497e-04 -1.21310063e-04 2.39711150e-05]] Final stress: [ 5.87816669e-06 1.21174308e-05 -7.90072683e-06 -3.27455982e-15 1.88824983e-16 9.82153985e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.39810669e-04 1.42618777e-03 -7.46614951e-04] [-2.39810666e-04 -1.42618782e-03 -7.46614938e-04] [ 1.07252302e-03 1.14446564e-03 3.41120468e-04] [-1.07252302e-03 -1.14446563e-03 3.41120470e-04] [ 9.69393766e-04 -1.75396871e-03 -1.20671633e-03] [-9.69393763e-04 1.75396871e-03 -1.20671633e-03] [-3.22860020e-04 -3.22008108e-03 8.09511442e-04] [ 3.22860023e-04 3.22008110e-03 8.09511462e-04] [-4.99221430e-04 7.49139087e-04 -1.62130626e-03] [ 4.99221426e-04 -7.49139094e-04 -1.62130627e-03] [ 2.85565375e-04 9.44468753e-04 1.26025856e-03] [-2.85565374e-04 -9.44468751e-04 1.26025857e-03] [-1.19944961e-03 -1.33406439e-04 -4.38457541e-04] [ 1.19944960e-03 1.33406442e-04 -4.38457528e-04] [-3.74807609e-03 -3.71223872e-03 -1.81590597e-03] [ 3.74807609e-03 3.71223875e-03 -1.81590596e-03] [-4.28100073e-04 2.30415214e-03 -2.34702299e-03] [ 4.28100076e-04 -2.30415213e-03 -2.34702297e-03] [ 4.25218367e-04 2.88327255e-06 3.14786249e-04] [-4.25218372e-04 -2.88327870e-06 3.14786243e-04] [ 3.01989904e-03 -8.70408393e-04 8.59593480e-04] [-3.01989904e-03 8.70408388e-04 8.59593488e-04] [-1.27406049e-03 1.16533587e-03 1.91922951e-03] [ 1.27406049e-03 -1.16533585e-03 1.91922951e-03] [-5.11352029e-04 9.37965010e-04 -1.09251039e-03] [ 5.11352026e-04 -9.37965025e-04 -1.09251041e-03] [ 5.26133925e-04 2.47438747e-03 2.74945570e-03] [-5.26133928e-04 -2.47438748e-03 2.74945568e-03] [ 6.47159792e-04 9.17476399e-04 -9.51975794e-05] [-6.47159793e-04 -9.17476409e-04 -9.51975821e-05] [ 1.94291123e-03 7.91645956e-04 5.57550011e-04] [-1.94291123e-03 -7.91645959e-04 5.57550014e-04] [-1.21632310e-03 -1.21820680e-03 -3.44457173e-04] [ 1.21632309e-03 1.21820681e-03 -3.44457173e-04] [-2.36783763e-03 4.01519265e-04 1.38303455e-03] [ 2.36783764e-03 -4.01519265e-04 1.38303455e-03] [ 3.43541676e-04 2.50624247e-03 7.33404386e-04] [-3.43541682e-04 -2.50624247e-03 7.33404382e-04] [-1.13263293e-03 -6.11772226e-04 3.06126197e-03] [ 1.13263293e-03 6.11772240e-04 3.06126198e-03] [ 5.65660859e-04 -3.68969503e-04 2.22559751e-04] [-5.65660862e-04 3.68969498e-04 2.22559747e-04] [-2.03211452e-03 -2.50032856e-03 -1.09379900e-03] [ 2.03211452e-03 2.50032857e-03 -1.09379900e-03] [ 7.38094989e-04 -2.27747556e-03 1.27537094e-03] [-7.38094987e-04 2.27747556e-03 1.27537094e-03] [-4.00803480e-04 2.18291447e-03 2.58028271e-04] [ 4.00803480e-04 -2.18291448e-03 2.58028280e-04] [-1.57423000e-04 -8.59529257e-04 -2.87873329e-04] [ 1.57423001e-04 8.59529264e-04 -2.87873324e-04] [ 6.24443448e-04 -2.42761850e-04 -5.09102343e-04] [-6.24443444e-04 2.42761846e-04 -5.09102342e-04] [-1.82257566e-03 4.02204672e-04 -1.52582602e-03] [ 1.82257566e-03 -4.02204672e-04 -1.52582602e-03] [ 4.02220182e-04 -1.87673511e-03 5.91416818e-05] [-4.02220187e-04 1.87673512e-03 5.91416829e-05] [-1.54266744e-03 -1.38471100e-03 -6.17506078e-04] [ 1.54266744e-03 1.38471102e-03 -6.17506074e-04] [ 2.34315696e-03 7.93516228e-04 -8.18508317e-04] [-2.34315696e-03 -7.93516227e-04 -8.18508317e-04] [-2.43878664e-03 -2.48578168e-03 -2.69086431e-04] [ 2.43878664e-03 2.48578169e-03 -2.69086430e-04] [ 8.66203233e-04 6.88682205e-04 -3.55892639e-04] [-8.66203228e-04 -6.88682208e-04 -3.55892642e-04] [-1.80361193e-03 9.97205540e-04 -4.68460579e-03] [ 1.80361193e-03 -9.97205548e-04 -4.68460579e-03] [-1.22777834e-03 -1.55519697e-04 2.08395563e-03] [ 1.22777834e-03 1.55519698e-04 2.08395562e-03] [-2.64986518e-03 1.14940520e-03 -1.94511403e-03] [ 2.64986517e-03 -1.14940520e-03 -1.94511403e-03] [ 1.37846609e-03 8.51291638e-04 3.27356354e-04] [-1.37846609e-03 -8.51291646e-04 3.27356351e-04] [-2.69831967e-03 3.67418741e-04 1.86299007e-03] [ 2.69831968e-03 -3.67418745e-04 1.86299007e-03] [ 1.37249710e-04 -5.53325747e-04 1.28568114e-03] [-1.37249714e-04 5.53325743e-04 1.28568115e-03] [-2.06929855e-03 1.98093038e-03 1.72542880e-03] [ 2.06929855e-03 -1.98093038e-03 1.72542879e-03] [-8.60021421e-04 -7.89553519e-04 -3.01028162e-04] [ 8.60021421e-04 7.89553524e-04 -3.01028163e-04] [-7.01484221e-04 -3.25786353e-03 1.08926233e-04] [ 7.01484219e-04 3.25786353e-03 1.08926232e-04] [ 8.89453998e-04 -2.91417641e-04 -1.02483513e-03] [-8.89453994e-04 2.91417645e-04 -1.02483513e-03] [ 1.98110755e-03 3.75658305e-04 1.47029318e-04] [-1.98110755e-03 -3.75658315e-04 1.47029304e-04] [ 2.69209559e-04 -1.91203879e-04 8.59691987e-05] [-2.69209559e-04 1.91203910e-04 8.59691921e-05] [ 1.73113637e-03 2.75555758e-03 -1.19088619e-03] [-1.73113637e-03 -2.75555758e-03 -1.19088619e-03] [-2.63411138e-03 -1.36081439e-03 1.08994237e-03] [ 2.63411138e-03 1.36081439e-03 1.08994237e-03] [-1.02403581e-03 -1.76460879e-04 -1.83718757e-04] [ 1.02403581e-03 1.76460854e-04 -1.83718763e-04] [-4.04628505e-04 -7.61744360e-04 -2.17064369e-03] [ 4.04628498e-04 7.61744367e-04 -2.17064370e-03] [ 3.98431501e-04 1.17007953e-04 2.15146004e-03] [-3.98431499e-04 -1.17007950e-04 2.15146006e-03] [-9.86893618e-04 -1.47204345e-03 -8.48497972e-04] [ 9.86893623e-04 1.47204345e-03 -8.48497955e-04] [ 4.25658430e-04 -8.02917516e-04 8.62066909e-04] [-4.25658429e-04 8.02917513e-04 8.62066898e-04]] Final stress: [-1.53692956e-05 -3.67208137e-07 -1.93709011e-05 -2.40711395e-14 9.91241899e-15 -6.14072517e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.11658799e-04 5.72824404e-05 -1.32727203e-05] [ 1.11658799e-04 -5.72824401e-05 -1.32727205e-05] [-1.69390530e-04 1.94478603e-04 7.04491987e-05] [ 1.69390530e-04 -1.94478604e-04 7.04492007e-05] [-7.50714037e-05 -1.60329578e-04 -1.43508061e-04] [ 7.50714038e-05 1.60329577e-04 -1.43508063e-04] [ 2.18370339e-04 -3.04833091e-04 1.19415940e-05] [-2.18370339e-04 3.04833089e-04 1.19415927e-05] [-2.66538313e-05 1.23427443e-04 -1.28924747e-04] [ 2.66538315e-05 -1.23427444e-04 -1.28924746e-04] [-5.53694099e-05 5.12428024e-05 1.67377380e-04] [ 5.53694100e-05 -5.12428022e-05 1.67377379e-04] [ 2.08390148e-04 -9.13933976e-06 -1.81284156e-04] [-2.08390148e-04 9.13934126e-06 -1.81284156e-04] [ 3.75436092e-04 -1.87546946e-04 -2.45060175e-04] [-3.75436091e-04 1.87546947e-04 -2.45060174e-04] [-1.06372914e-05 2.61004071e-04 -2.34434009e-04] [ 1.06372919e-05 -2.61004069e-04 -2.34434008e-04] [-6.85356240e-05 -4.06908894e-05 1.69159813e-04] [ 6.85356229e-05 4.06908894e-05 1.69159813e-04] [-3.22914238e-04 -1.60881256e-04 5.72617982e-05] [ 3.22914238e-04 1.60881256e-04 5.72617990e-05] [ 2.35699645e-04 1.66928933e-05 1.46630502e-04] [-2.35699645e-04 -1.66928794e-05 1.46630498e-04] [-2.35646847e-05 1.19287159e-04 -1.31030637e-04] [ 2.35646848e-05 -1.19287161e-04 -1.31030642e-04] [ 3.39436514e-06 1.60422125e-04 3.62692838e-04] [-3.39436521e-06 -1.60422128e-04 3.62692836e-04] [-1.59817358e-04 8.03617886e-05 2.12335540e-07] [ 1.59817358e-04 -8.03617885e-05 2.12335193e-07] [-4.99100749e-05 1.45605191e-04 4.52055472e-05] [ 4.99100743e-05 -1.45605190e-04 4.52055483e-05] [ 2.24739049e-04 -1.62898755e-04 -6.16292459e-05] [-2.24739049e-04 1.62898754e-04 -6.16292458e-05] [ 9.42610606e-05 -2.03296430e-04 1.62557768e-04] [-9.42610596e-05 2.03296429e-04 1.62557768e-04] [-2.30706829e-04 -2.61073946e-05 7.78233358e-05] [ 2.30706829e-04 2.61073947e-05 7.78233353e-05] [ 2.72844072e-05 -8.09605010e-06 -7.04167876e-05] [-2.72844085e-05 8.09605249e-06 -7.04167856e-05] [-4.67232427e-05 -6.48101719e-06 3.12792456e-04] [ 4.67232443e-05 6.48101996e-06 3.12792453e-04] [ 2.66253996e-05 2.24709932e-04 1.39956495e-04] [-2.66253997e-05 -2.24709932e-04 1.39956495e-04] [-9.27476865e-05 1.95584629e-04 -2.26493095e-04] [ 9.27476867e-05 -1.95584629e-04 -2.26493096e-04] [ 1.90800340e-05 3.85779741e-05 -2.13454657e-04] [-1.90800362e-05 -3.85779721e-05 -2.13454657e-04] [-6.23525970e-05 -2.61776279e-04 9.62295929e-05] [ 6.23525997e-05 2.61776280e-04 9.62295943e-05] [-1.28065977e-04 2.67713179e-05 -9.70749370e-05] [ 1.28065977e-04 -2.67713177e-05 -9.70749372e-05] [ 1.25684321e-04 1.11624302e-04 -1.28923567e-04] [-1.25684322e-04 -1.11624303e-04 -1.28923567e-04] [-1.86885816e-04 2.13989302e-05 -1.34141391e-04] [ 1.86885816e-04 -2.13989297e-05 -1.34141390e-04] [ 1.06453873e-04 9.32058986e-05 4.05518604e-05] [-1.06453873e-04 -9.32058983e-05 4.05518598e-05] [-1.62716510e-04 1.77590585e-04 3.77667101e-05] [ 1.62716510e-04 -1.77590586e-04 3.77667107e-05] [ 2.45024516e-04 -1.83629996e-04 -1.02044364e-04] [-2.45024516e-04 1.83629995e-04 -1.02044364e-04] [-1.31701588e-04 -2.30033444e-04 -4.73468651e-04] [ 1.31701588e-04 2.30033443e-04 -4.73468653e-04] [ 6.98631292e-05 -7.72262330e-05 1.43175900e-04] [-6.98631298e-05 7.72262327e-05 1.43175901e-04] [-1.48840028e-04 -1.19669290e-04 -1.80995493e-04] [ 1.48840027e-04 1.19669290e-04 -1.80995494e-04] [-1.53808630e-04 1.05658477e-04 1.33878589e-04] [ 1.53808630e-04 -1.05658477e-04 1.33878590e-04] [-3.35899444e-04 -1.85728521e-05 1.74991468e-04] [ 3.35899445e-04 1.85728504e-05 1.74991468e-04] [ 2.44072270e-04 -1.32301163e-04 3.89960276e-05] [-2.44072270e-04 1.32301162e-04 3.89960274e-05] [-1.41449431e-04 -1.45425146e-04 2.82847780e-04] [ 1.41449431e-04 1.45425146e-04 2.82847781e-04] [ 1.12874428e-04 8.42126617e-05 7.30092639e-05] [-1.12874429e-04 -8.42126616e-05 7.30092638e-05] [-1.18085002e-04 -7.32289158e-05 -8.79891631e-06] [ 1.18085002e-04 7.32289171e-05 -8.79891481e-06] [-7.88047227e-05 -3.61303940e-04 -1.65190738e-06] [ 7.88047224e-05 3.61303941e-04 -1.65190773e-06] [ 1.62313614e-06 -6.64431431e-05 -1.39173308e-04] [-1.62313689e-06 6.64431432e-05 -1.39173308e-04] [ 2.12951625e-05 -2.14456726e-05 4.09527086e-05] [-2.12951633e-05 2.14456731e-05 4.09527090e-05] [ 2.22236130e-05 1.20660110e-04 -1.73387302e-05] [-2.22236124e-05 -1.20660110e-04 -1.73387304e-05] [-3.73862696e-05 2.77474996e-04 -1.10066596e-04] [ 3.73862692e-05 -2.77474995e-04 -1.10066597e-04] [ 2.69958934e-04 -1.89889044e-04 1.55787154e-04] [-2.69958934e-04 1.89889045e-04 1.55787153e-04] [ 2.44551474e-06 5.82380494e-05 5.21908818e-05] [-2.44551505e-06 -5.82380616e-05 5.21908826e-05] [ 1.07327237e-05 -5.69464755e-05 1.94564046e-04] [-1.07327237e-05 5.69464765e-05 1.94564048e-04] [ 4.56197138e-05 1.17487908e-04 -6.35867534e-05] [-4.56197128e-05 -1.17487908e-04 -6.35867547e-05] [ 1.83478428e-04 5.09455909e-05 6.96368603e-06] [-1.83478430e-04 -5.09455922e-05 6.96368995e-06] [-1.61427447e-04 5.29958094e-05 -8.91938184e-05] [ 1.61427448e-04 -5.29958113e-05 -8.91938222e-05]] Final stress: [-9.26200812e-06 -1.37330476e-05 -1.17093333e-05 -4.39808318e-16 4.06344641e-17 4.57442578e-06] Minimization converged after 16 steps. Minimization converged after 18 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-5.15160715e-05 -2.36223913e-05 -2.55936368e-04] [ 5.15160722e-05 2.36223773e-05 -2.55936365e-04] [ 1.23284283e-05 -2.13586163e-04 -5.54182552e-05] [-1.23284290e-05 2.13586165e-04 -5.54182598e-05] [ 6.82669438e-04 8.88886958e-04 1.33275070e-04] [-6.82669439e-04 -8.88886957e-04 1.33275071e-04] [-2.18258422e-04 5.21394051e-05 -4.39935987e-04] [ 2.18258419e-04 -5.21394106e-05 -4.39935990e-04] [ 4.07008894e-04 4.05783812e-04 5.95420996e-04] [-4.07008893e-04 -4.05783812e-04 5.95420997e-04] [-2.04659971e-04 -2.76548158e-04 2.66420598e-04] [ 2.04659971e-04 2.76548162e-04 2.66420602e-04] [-5.82768534e-04 -2.25591730e-04 3.24367752e-04] [ 5.82768534e-04 2.25591729e-04 3.24367753e-04] [-2.07843963e-03 2.68736563e-04 1.06729545e-03] [ 2.07843963e-03 -2.68736559e-04 1.06729545e-03] [ 7.01477412e-04 -1.50036901e-04 2.86251606e-04] [-7.01477413e-04 1.50036902e-04 2.86251606e-04] [ 5.54873381e-04 3.19433238e-04 -1.71308433e-04] [-5.54873382e-04 -3.19433238e-04 -1.71308430e-04] [ 3.74179349e-04 -3.98138504e-04 -2.81793265e-04] [-3.74179350e-04 3.98138507e-04 -2.81793268e-04] [-5.96445563e-04 -8.17106705e-04 -1.24300743e-04] [ 5.96445561e-04 8.17106686e-04 -1.24300737e-04] [-1.63261854e-04 -1.74203704e-04 1.84231136e-04] [ 1.63261853e-04 1.74203705e-04 1.84231140e-04] [ 4.28681068e-04 2.48074177e-04 -8.62006645e-04] [-4.28681067e-04 -2.48074172e-04 -8.62006641e-04] [ 3.04994406e-04 9.49598749e-04 -1.64090083e-03] [-3.04994407e-04 -9.49598750e-04 -1.64090083e-03] [ 6.34784236e-04 -7.59928201e-04 4.08414955e-04] [-6.34784236e-04 7.59928199e-04 4.08414953e-04] [ 4.33779894e-04 2.64270516e-04 1.68927093e-04] [-4.33779895e-04 -2.64270517e-04 1.68927090e-04] [ 1.91353273e-04 5.64165041e-04 -5.34209224e-04] [-1.91353273e-04 -5.64165040e-04 -5.34209224e-04] [ 1.77502603e-05 -3.12051159e-04 -4.78161185e-04] [-1.77502604e-05 3.12051158e-04 -4.78161185e-04] [ 2.27355833e-04 5.88904903e-04 -4.02386795e-04] [-2.27355833e-04 -5.88904906e-04 -4.02386794e-04] [-2.84583252e-04 -2.22548741e-04 1.63580114e-04] [ 2.84583252e-04 2.22548740e-04 1.63580116e-04] [-1.74889216e-04 9.75209043e-06 5.20036366e-04] [ 1.74889216e-04 -9.75208882e-06 5.20036366e-04] [-3.08127005e-04 -1.34884798e-03 5.85673158e-04] [ 3.08127003e-04 1.34884798e-03 5.85673159e-04] [-1.47530070e-04 -5.34812858e-04 -9.92016658e-04] [ 1.47530072e-04 5.34812855e-04 -9.92016658e-04] [ 3.70879324e-05 -4.53192815e-04 5.73983734e-04] [-3.70879313e-05 4.53192812e-04 5.73983730e-04] [ 2.42596149e-04 2.46662005e-04 7.57960327e-04] [-2.42596149e-04 -2.46662003e-04 7.57960326e-04] [-6.82026990e-04 5.15471600e-04 -3.87729065e-05] [ 6.82026991e-04 -5.15471599e-04 -3.87729070e-05] [-6.71886744e-04 -4.89874230e-05 6.41627425e-04] [ 6.71886739e-04 4.89874172e-05 6.41627425e-04] [-2.78316581e-04 -8.93376025e-04 4.56843524e-04] [ 2.78316582e-04 8.93376022e-04 4.56843526e-04] [ 4.72313060e-04 -1.23340703e-03 -9.03284606e-04] [-4.72313058e-04 1.23340703e-03 -9.03284607e-04] [-8.45457885e-04 1.20778996e-04 -1.69316736e-04] [ 8.45457885e-04 -1.20778995e-04 -1.69316737e-04] [-8.37081001e-04 -2.49203220e-05 -5.49392359e-04] [ 8.37081001e-04 2.49203200e-05 -5.49392358e-04] [ 5.49540201e-04 6.23579266e-04 5.72638959e-04] [-5.49540198e-04 -6.23579267e-04 5.72638959e-04] [ 1.37857789e-03 -7.03772495e-04 1.00953634e-03] [-1.37857789e-03 7.03772495e-04 1.00953634e-03] [-8.39260465e-04 3.79153848e-04 -2.55024089e-04] [ 8.39260464e-04 -3.79153847e-04 -2.55024087e-04] [-1.95674380e-04 -9.25881631e-04 4.95239850e-04] [ 1.95674380e-04 9.25881632e-04 4.95239850e-04] [-2.46516603e-04 -2.43231388e-04 -1.26907142e-03] [ 2.46516603e-04 2.43231387e-04 -1.26907142e-03] [ 9.04722554e-04 7.08908798e-05 6.07766534e-04] [-9.04722557e-04 -7.08908808e-05 6.07766533e-04] [ 1.07283981e-04 -2.13972117e-04 -1.45235463e-04] [-1.07283981e-04 2.13972116e-04 -1.45235463e-04] [ 1.46752445e-03 -5.79101862e-06 -2.93710647e-04] [-1.46752445e-03 5.79101601e-06 -2.93710645e-04] [ 1.48440355e-03 -1.62926853e-04 -1.66795069e-04] [-1.48440355e-03 1.62926852e-04 -1.66795067e-04] [-1.68489363e-04 -4.47439605e-04 -5.08351583e-04] [ 1.68489365e-04 4.47439603e-04 -5.08351582e-04] [ 9.40984761e-04 -1.50522853e-05 7.14310278e-04] [-9.40984759e-04 1.50522882e-05 7.14310280e-04] [-6.11146996e-04 1.25342477e-04 -4.48220073e-04] [ 6.11146994e-04 -1.25342464e-04 -4.48220076e-04] [-1.43211722e-03 2.94934103e-04 -2.21282415e-04] [ 1.43211722e-03 -2.94934102e-04 -2.21282416e-04] [ 3.44311788e-04 -1.46258747e-04 1.61622592e-04] [-3.44311788e-04 1.46258745e-04 1.61622591e-04] [ 2.81148154e-04 1.27867508e-04 9.50510175e-05] [-2.81148151e-04 -1.27867490e-04 9.50510172e-05] [-1.26448973e-03 2.82402692e-04 -3.24219774e-04] [ 1.26448973e-03 -2.82402690e-04 -3.24219776e-04] [ 3.96367515e-04 1.21802745e-03 2.94080553e-04] [-3.96367510e-04 -1.21802745e-03 2.94080551e-04] [-3.07405284e-04 7.85361488e-04 -1.20472678e-04] [ 3.07405287e-04 -7.85361483e-04 -1.20472680e-04] [-2.14718154e-04 1.27343510e-04 5.66968765e-04] [ 2.14718151e-04 -1.27343507e-04 5.66968770e-04]] Final stress: [ 7.64049091e-06 -4.79057152e-06 6.26829559e-05 5.17356550e-15 -1.89542039e-15 -4.74927104e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 6.37969149e-05 -7.67414909e-05 -2.05940537e-04] [-6.37969154e-05 7.67414671e-05 -2.05940531e-04] [-4.65457637e-06 -2.04441878e-04 -4.77355620e-05] [ 4.65457761e-06 2.04441876e-04 -4.77355656e-05] [-6.34879134e-04 7.95773718e-04 1.71850430e-04] [ 6.34879134e-04 -7.95773719e-04 1.71850429e-04] [ 1.81942298e-04 1.28043429e-05 -3.61697187e-04] [-1.81942301e-04 -1.28043455e-05 -3.61697186e-04] [-3.76267213e-04 3.71261177e-04 5.37964433e-04] [ 3.76267212e-04 -3.71261175e-04 5.37964432e-04] [ 2.07405414e-04 -2.32456377e-04 1.85256732e-04] [-2.07405415e-04 2.32456379e-04 1.85256735e-04] [ 5.47947708e-04 -1.95499732e-04 3.02455877e-04] [-5.47947709e-04 1.95499732e-04 3.02455878e-04] [ 1.90173138e-03 2.85250239e-04 9.91195234e-04] [-1.90173138e-03 -2.85250230e-04 9.91195234e-04] [-6.30062275e-04 -1.37976930e-04 2.70780070e-04] [ 6.30062275e-04 1.37976932e-04 2.70780071e-04] [-5.17102437e-04 2.80739059e-04 -1.48449750e-04] [ 5.17102439e-04 -2.80739059e-04 -1.48449744e-04] [-3.70874130e-04 -3.57560110e-04 -2.50890944e-04] [ 3.70874131e-04 3.57560109e-04 -2.50890942e-04] [ 5.54923495e-04 -6.76134894e-04 -1.36303389e-04] [-5.54923497e-04 6.76134893e-04 -1.36303387e-04] [ 1.24451253e-04 -1.25816670e-04 1.26067508e-04] [-1.24451251e-04 1.25816670e-04 1.26067508e-04] [-3.75427720e-04 1.68690862e-04 -8.14109025e-04] [ 3.75427720e-04 -1.68690865e-04 -8.14109028e-04] [-2.85482566e-04 8.87647222e-04 -1.51206190e-03] [ 2.85482563e-04 -8.87647222e-04 -1.51206190e-03] [-5.87399907e-04 -7.10258942e-04 3.75741513e-04] [ 5.87399907e-04 7.10258939e-04 3.75741514e-04] [-3.97139470e-04 2.56286954e-04 1.49365302e-04] [ 3.97139469e-04 -2.56286951e-04 1.49365299e-04] [ 1.02664844e-05 3.03830056e-04 -4.57299437e-04] [-1.02664840e-05 -3.03830055e-04 -4.57299436e-04] [ 1.53526825e-04 -5.26758039e-04 -4.65799896e-04] [-1.53526827e-04 5.26758039e-04 -4.65799894e-04] [-2.42848833e-04 1.82925190e-04 1.32539190e-04] [ 2.42848831e-04 -1.82925192e-04 1.32539192e-04] [ 1.44214828e-04 -5.75768064e-04 -3.78644056e-04] [-1.44214828e-04 5.75768063e-04 -3.78644056e-04] [-2.99672720e-04 1.20512793e-03 5.79331385e-04] [ 2.99672722e-04 -1.20512793e-03 5.79331385e-04] [-1.73744985e-04 -3.55315607e-05 4.44998681e-04] [ 1.73744983e-04 3.55315609e-05 4.44998680e-04] [-3.62517642e-06 4.26198612e-04 5.61976290e-04] [ 3.62517500e-06 -4.26198614e-04 5.61976293e-04] [-1.62318973e-04 4.92518624e-04 -9.40407144e-04] [ 1.62318974e-04 -4.92518626e-04 -9.40407149e-04] [-6.64996654e-04 -4.92496711e-04 -7.60285139e-05] [ 6.64996656e-04 4.92496715e-04 -7.60285151e-05] [ 2.39671382e-04 -2.11907467e-04 7.22498223e-04] [-2.39671381e-04 2.11907468e-04 7.22498226e-04] [-3.17355486e-04 7.83799340e-04 4.10300210e-04] [ 3.17355485e-04 -7.83799343e-04 4.10300211e-04] [-6.02449260e-04 4.43916728e-05 5.99049772e-04] [ 6.02449261e-04 -4.43916735e-05 5.99049773e-04] [-7.91906689e-04 -1.41524503e-04 -1.24363566e-04] [ 7.91906690e-04 1.41524503e-04 -1.24363567e-04] [ 4.25770920e-04 1.10458975e-03 -8.81038723e-04] [-4.25770920e-04 -1.10458975e-03 -8.81038723e-04] [ 4.50509127e-04 -6.00489958e-04 5.19555125e-04] [-4.50509129e-04 6.00489956e-04 5.19555123e-04] [-7.54429053e-04 -1.04463809e-05 -4.82986785e-04] [ 7.54429055e-04 1.04463776e-05 -4.82986781e-04] [-7.21521959e-04 -3.76911757e-04 -2.34340820e-04] [ 7.21521957e-04 3.76911757e-04 -2.34340820e-04] [ 1.25490745e-03 6.37255329e-04 9.51368222e-04] [-1.25490745e-03 -6.37255331e-04 9.51368223e-04] [-2.43867502e-04 2.40137328e-04 -1.17383829e-03] [ 2.43867504e-04 -2.40137331e-04 -1.17383829e-03] [-2.00360957e-04 8.62310325e-04 4.42743687e-04] [ 2.00360957e-04 -8.62310327e-04 4.42743685e-04] [ 9.05544039e-05 1.95991272e-04 -1.32166486e-04] [-9.05544063e-05 -1.95991273e-04 -1.32166489e-04] [ 8.73007167e-04 -8.33778572e-05 5.68550234e-04] [-8.73007163e-04 8.33778553e-05 5.68550235e-04] [-1.37643768e-03 -1.73433748e-05 -2.74013210e-04] [ 1.37643768e-03 1.73433751e-05 -2.74013210e-04] [-1.36277091e-03 -1.62923220e-04 -1.64424573e-04] [ 1.36277091e-03 1.62923223e-04 -1.64424574e-04] [ 1.51870760e-04 -3.87184440e-04 -4.72816751e-04] [-1.51870762e-04 3.87184439e-04 -4.72816749e-04] [-8.23125327e-04 1.22069612e-05 6.54134952e-04] [ 8.23125328e-04 -1.22069599e-05 6.54134955e-04] [ 5.62391694e-04 1.66201230e-04 -4.10783781e-04] [-5.62391695e-04 -1.66201214e-04 -4.10783783e-04] [ 1.31515237e-03 2.90247861e-04 -1.95022263e-04] [-1.31515237e-03 -2.90247861e-04 -1.95022261e-04] [-3.14934625e-04 -1.53730631e-04 1.56155362e-04] [ 3.14934625e-04 1.53730632e-04 1.56155361e-04] [-2.75673778e-04 4.35970830e-05 8.79941014e-05] [ 2.75673780e-04 -4.35970811e-05 8.79941017e-05] [ 3.79227526e-04 -1.13573577e-03 2.53396735e-04] [-3.79227526e-04 1.13573578e-03 2.53396732e-04] [-1.17131303e-03 -2.65586071e-04 -3.17572985e-04] [ 1.17131304e-03 2.65586077e-04 -3.17572981e-04] [-2.10529863e-04 -1.54544532e-04 5.39243294e-04] [ 2.10529863e-04 1.54544536e-04 5.39243293e-04] [-2.75194389e-04 -7.50679465e-04 -7.57769972e-05] [ 2.75194388e-04 7.50679468e-04 -7.57769993e-05]] Final stress: [ 7.82579173e-06 -4.41653339e-06 5.86913726e-05 2.86822758e-16 3.88883856e-15 4.42441023e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-5.40669149e-04 -1.69248951e-04 6.93341601e-04] [ 5.40669147e-04 1.69248937e-04 6.93341605e-04] [-3.85888640e-04 1.18566728e-03 -8.57049793e-04] [ 3.85888641e-04 -1.18566728e-03 -8.57049797e-04] [ 2.55361765e-04 -1.02881194e-03 5.74534591e-04] [-2.55361765e-04 1.02881195e-03 5.74534593e-04] [-3.12249849e-04 9.61058095e-04 -9.00561190e-04] [ 3.12249848e-04 -9.61058093e-04 -9.00561189e-04] [ 1.84567785e-04 -1.05060276e-04 -1.50375201e-04] [-1.84567783e-04 1.05060277e-04 -1.50375198e-04] [-4.12564123e-04 3.61656683e-04 -5.17463467e-04] [ 4.12564123e-04 -3.61656683e-04 -5.17463469e-04] [-1.39931480e-04 5.76384511e-04 1.87675524e-04] [ 1.39931482e-04 -5.76384512e-04 1.87675522e-04] [-1.33514771e-03 -4.85288975e-04 5.26069673e-05] [ 1.33514771e-03 4.85288972e-04 5.26069746e-05] [ 7.94996197e-04 -4.37752370e-04 1.50471041e-04] [-7.94996198e-04 4.37752371e-04 1.50471042e-04] [ 5.36510396e-04 -2.36922332e-04 -2.06378520e-04] [-5.36510394e-04 2.36922333e-04 -2.06378524e-04] [ 3.31558702e-04 -1.81187148e-05 -3.39934118e-04] [-3.31558703e-04 1.81187153e-05 -3.39934119e-04] [-8.67760699e-04 1.79988241e-04 -6.27977511e-04] [ 8.67760704e-04 -1.79988257e-04 -6.27977509e-04] [ 4.94844951e-04 -3.90994114e-04 1.04985765e-03] [-4.94844952e-04 3.90994118e-04 1.04985766e-03] [ 3.17524787e-04 2.79033229e-04 -7.20455246e-04] [-3.17524789e-04 -2.79033221e-04 -7.20455248e-04] [ 2.93413891e-05 -1.27608285e-03 1.45283222e-03] [-2.93413908e-05 1.27608285e-03 1.45283222e-03] [ 3.95416717e-04 1.39544097e-03 -2.32349580e-04] [-3.95416718e-04 -1.39544098e-03 -2.32349579e-04] [ 9.32615329e-04 -6.44048423e-04 1.12191739e-03] [-9.32615326e-04 6.44048423e-04 1.12191739e-03] [-1.19638779e-04 -6.25735103e-04 1.81822815e-04] [ 1.19638777e-04 6.25735104e-04 1.81822808e-04] [-1.42116927e-03 -3.13551643e-04 8.97637723e-05] [ 1.42116927e-03 3.13551642e-04 8.97637738e-05] [-3.05918668e-04 -4.16508469e-04 -2.78620193e-04] [ 3.05918670e-04 4.16508462e-04 -2.78620198e-04] [ 9.40320738e-04 4.55907560e-04 5.57651848e-04] [-9.40320739e-04 -4.55907567e-04 5.57651853e-04] [-1.68833776e-04 -8.65216545e-04 -2.01427605e-04] [ 1.68833779e-04 8.65216544e-04 -2.01427604e-04] [-5.89448245e-04 -3.35378612e-04 -9.67700280e-04] [ 5.89448244e-04 3.35378611e-04 -9.67700277e-04] [ 2.05665741e-04 -7.32724700e-04 -1.29467690e-03] [-2.05665747e-04 7.32724700e-04 -1.29467690e-03] [ 8.77454168e-04 -1.88439537e-04 1.22783810e-03] [-8.77454169e-04 1.88439533e-04 1.22783809e-03] [ 5.35731150e-05 8.00912071e-05 3.44969635e-04] [-5.35731168e-05 -8.00912094e-05 3.44969636e-04] [-9.21646424e-04 4.82545083e-04 -6.23787006e-04] [ 9.21646426e-04 -4.82545082e-04 -6.23787007e-04] [-6.16484230e-04 -5.94980380e-04 -5.82861299e-05] [ 6.16484230e-04 5.94980380e-04 -5.82861313e-05] [-8.14442416e-04 5.02780496e-04 -7.46037371e-04] [ 8.14442414e-04 -5.02780496e-04 -7.46037369e-04] [ 3.19293401e-04 -4.59498994e-04 6.73967133e-04] [-3.19293400e-04 4.59498997e-04 6.73967137e-04] [-4.69887250e-04 -8.43025004e-04 1.23327391e-03] [ 4.69887245e-04 8.43025004e-04 1.23327391e-03] [ 7.88411029e-04 -2.37256147e-04 -5.44439529e-04] [-7.88411031e-04 2.37256147e-04 -5.44439528e-04] [ 9.04694996e-04 -2.80845864e-04 7.26357454e-04] [-9.04694994e-04 2.80845863e-04 7.26357453e-04] [ 4.45355665e-04 4.29860762e-04 4.26908034e-05] [-4.45355660e-04 -4.29860764e-04 4.26908041e-05] [-1.27262668e-03 -1.39225060e-03 -7.48677500e-05] [ 1.27262668e-03 1.39225060e-03 -7.48677518e-05] [-2.22228165e-04 -1.34437207e-03 1.27298286e-03] [ 2.22228161e-04 1.34437208e-03 1.27298286e-03] [-1.22058273e-03 -2.61314522e-03 -1.27762859e-03] [ 1.22058273e-03 2.61314522e-03 -1.27762858e-03] [-2.12077167e-04 -8.74321488e-04 -7.60622698e-04] [ 2.12077167e-04 8.74321486e-04 -7.60622697e-04] [-1.36059086e-03 1.90218610e-04 -1.19992929e-03] [ 1.36059086e-03 -1.90218610e-04 -1.19992929e-03] [ 1.18466643e-03 4.41015085e-04 -4.88263813e-04] [-1.18466643e-03 -4.41015089e-04 -4.88263818e-04] [ 5.27223011e-04 -2.05968487e-04 1.28902752e-04] [-5.27223012e-04 2.05968489e-04 1.28902751e-04] [-4.59189519e-04 6.75684983e-04 5.62390784e-04] [ 4.59189521e-04 -6.75684982e-04 5.62390779e-04] [ 5.54052747e-04 -3.38847732e-04 -9.25444064e-05] [-5.54052744e-04 3.38847729e-04 -9.25444056e-05] [ 3.24637908e-04 -8.37396754e-07 4.69337991e-04] [-3.24637908e-04 8.37408156e-07 4.69337988e-04] [-4.36426863e-04 -1.42230777e-05 5.25746686e-04] [ 4.36426863e-04 1.42230759e-05 5.25746687e-04] [ 7.46001101e-04 2.62711409e-04 4.41226483e-04] [-7.46001099e-04 -2.62711408e-04 4.41226486e-04] [-4.36759930e-05 2.39626217e-04 -1.78112982e-04] [ 4.36759934e-05 -2.39626203e-04 -1.78112979e-04] [-5.46989621e-04 3.94883108e-04 2.54189418e-04] [ 5.46989618e-04 -3.94883108e-04 2.54189413e-04] [ 1.22124173e-03 -2.32560122e-04 -3.79827982e-04] [-1.22124173e-03 2.32560123e-04 -3.79827976e-04] [ 7.98622610e-04 3.13835854e-04 -5.33057514e-04] [-7.98622608e-04 -3.13835854e-04 -5.33057518e-04] [ 7.62596736e-04 7.44479501e-04 2.36025230e-04] [-7.62596736e-04 -7.44479498e-04 2.36025234e-04]] Final stress: [-1.38181729e-05 2.19942571e-06 -5.61133820e-05 -4.86418438e-16 -4.53671841e-15 -5.23638854e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 5.65447825e-04 -1.70263351e-04 7.52438308e-04] [-5.65447823e-04 1.70263359e-04 7.52438307e-04] [ 3.87249476e-04 1.27190735e-03 -9.05034712e-04] [-3.87249477e-04 -1.27190735e-03 -9.05034713e-04] [-3.23170453e-04 -1.18817558e-03 5.08054318e-04] [ 3.23170454e-04 1.18817558e-03 5.08054320e-04] [ 3.14861038e-04 9.84212562e-04 -7.78679295e-04] [-3.14861037e-04 -9.84212560e-04 -7.78679298e-04] [-2.62703305e-04 -2.16914110e-04 -3.00621175e-04] [ 2.62703306e-04 2.16914110e-04 -3.00621176e-04] [ 4.46392040e-04 4.02453798e-04 -5.28454798e-04] [-4.46392040e-04 -4.02453799e-04 -5.28454794e-04] [ 2.48813856e-04 6.89426749e-04 8.26181878e-05] [-2.48813855e-04 -6.89426751e-04 8.26181851e-05] [ 1.68477182e-03 -4.52258367e-04 -1.54308346e-04] [-1.68477182e-03 4.52258369e-04 -1.54308351e-04] [-8.65630423e-04 -4.48017039e-04 1.04625422e-04] [ 8.65630421e-04 4.48017040e-04 1.04625423e-04] [-7.16537970e-04 -3.72352768e-04 -1.16510789e-04] [ 7.16537967e-04 3.72352766e-04 -1.16510782e-04] [-3.39785340e-04 7.18804413e-05 -3.17592226e-04] [ 3.39785339e-04 -7.18804444e-05 -3.17592224e-04] [ 8.90254583e-04 3.76166665e-04 -5.90072771e-04] [-8.90254585e-04 -3.76166665e-04 -5.90072772e-04] [-4.22896280e-04 -4.39544599e-04 1.02539892e-03] [ 4.22896279e-04 4.39544595e-04 1.02539892e-03] [-4.20050691e-04 1.53678210e-04 -5.30823380e-04] [ 4.20050690e-04 -1.53678207e-04 -5.30823377e-04] [-1.00083889e-04 -1.37593334e-03 1.62016975e-03] [ 1.00083887e-04 1.37593334e-03 1.62016975e-03] [-4.77377745e-04 1.50330338e-03 -2.27458485e-04] [ 4.77377743e-04 -1.50330338e-03 -2.27458483e-04] [-1.06188625e-03 -7.36755119e-04 1.09426646e-03] [ 1.06188626e-03 7.36755113e-04 1.09426647e-03] [-1.45604485e-03 2.30663255e-04 1.58700892e-04] [ 1.45604485e-03 -2.30663256e-04 1.58700891e-04] [-1.74442719e-04 6.95058120e-04 2.67185668e-04] [ 1.74442723e-04 -6.95058120e-04 2.67185669e-04] [ 9.37912536e-04 -6.01772574e-04 6.08868547e-04] [-9.37912535e-04 6.01772576e-04 6.08868549e-04] [-1.57159970e-04 4.15095064e-04 -3.94656899e-04] [ 1.57159972e-04 -4.15095063e-04 -3.94656898e-04] [-5.66284245e-04 3.54572180e-04 -1.02324016e-03] [ 5.66284245e-04 -3.54572181e-04 -1.02324015e-03] [-1.01805254e-04 1.00006238e-03 -2.49129377e-04] [ 1.01805252e-04 -1.00006238e-03 -2.49129381e-04] [ 9.90204553e-04 2.97519035e-04 1.43546875e-03] [-9.90204555e-04 -2.97519033e-04 1.43546875e-03] [ 2.46868062e-04 8.35889237e-04 -1.39623103e-03] [-2.46868060e-04 -8.35889234e-04 -1.39623103e-03] [-9.54495482e-04 -5.10851802e-04 -7.66605355e-04] [ 9.54495480e-04 5.10851798e-04 -7.66605352e-04] [ 1.55701263e-04 -1.50914871e-04 4.20329156e-04] [-1.55701264e-04 1.50914872e-04 4.20329157e-04] [-6.76435580e-04 -5.02787323e-04 -8.20117223e-04] [ 6.76435581e-04 5.02787323e-04 -8.20117222e-04] [-5.76895926e-04 7.89650580e-04 -1.60776096e-04] [ 5.76895932e-04 -7.89650584e-04 -1.60776094e-04] [-4.86757295e-04 1.04726988e-03 1.39351375e-03] [ 4.86757295e-04 -1.04726988e-03 1.39351375e-03] [ 4.38049061e-04 4.51515946e-04 6.65882390e-04] [-4.38049056e-04 -4.51515944e-04 6.65882390e-04] [ 1.16750459e-03 3.07110463e-04 8.87399918e-04] [-1.16750459e-03 -3.07110462e-04 8.87399918e-04] [ 6.95350152e-04 1.47373709e-04 -6.66058028e-04] [-6.95350151e-04 -1.47373706e-04 -6.66058029e-04] [-1.46377173e-03 1.46135114e-03 -3.14762222e-04] [ 1.46377174e-03 -1.46135115e-03 -3.14762219e-04] [ 5.55864452e-04 -5.11058286e-04 9.06550543e-05] [-5.55864453e-04 5.11058284e-04 9.06550543e-05] [-1.08159492e-03 2.74598191e-03 -1.32708832e-03] [ 1.08159492e-03 -2.74598191e-03 -1.32708832e-03] [-2.33037517e-04 1.34236376e-03 1.48822416e-03] [ 2.33037511e-04 -1.34236376e-03 1.48822416e-03] [-1.52902199e-03 -1.60473858e-04 -1.33716203e-03] [ 1.52902198e-03 1.60473856e-04 -1.33716203e-03] [-2.41682527e-04 8.84086309e-04 -6.59541574e-04] [ 2.41682528e-04 -8.84086309e-04 -6.59541575e-04] [-1.38564005e-03 4.64212490e-04 -4.69481707e-04] [ 1.38564005e-03 -4.64212487e-04 -4.69481708e-04] [-8.98324270e-04 -2.27590663e-04 1.45736505e-04] [ 8.98324267e-04 2.27590662e-04 1.45736504e-04] [ 4.59488332e-04 8.13327960e-04 6.64804674e-04] [-4.59488331e-04 -8.13327958e-04 6.64804677e-04] [-7.18385599e-04 -3.14851159e-04 -2.10268528e-04] [ 7.18385596e-04 3.14851161e-04 -2.10268533e-04] [-2.31826578e-04 -1.40249210e-04 5.07182351e-04] [ 2.31826578e-04 1.40249208e-04 5.07182349e-04] [ 8.00987878e-04 -9.18986771e-06 5.92616081e-04] [-8.00987880e-04 9.18986963e-06 5.92616077e-04] [-8.90046067e-04 3.15344463e-04 4.19985322e-04] [ 8.90046067e-04 -3.15344465e-04 4.19985320e-04] [-3.58421175e-05 3.08721664e-04 -1.95216851e-04] [ 3.58421159e-05 -3.08721667e-04 -1.95216849e-04] [ 1.41833944e-03 1.78132249e-04 -3.58637827e-04] [-1.41833944e-03 -1.78132242e-04 -3.58637823e-04] [-6.15389880e-04 -6.59818649e-04 1.67307646e-04] [ 6.15389880e-04 6.59818649e-04 1.67307647e-04] [ 7.71724352e-04 -9.26784040e-04 2.89147224e-04] [-7.71724355e-04 9.26784041e-04 2.89147220e-04] [ 8.47213790e-04 -3.29054760e-04 -5.92050264e-04] [-8.47213788e-04 3.29054760e-04 -5.92050264e-04]] Final stress: [-1.41669958e-05 3.51868434e-06 -6.14519256e-05 1.30388825e-15 -3.06431665e-15 5.88159234e-05] Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 22 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.57348046e-04 -3.92509160e-07 3.31367181e-05] [-1.55100535e-04 2.76385563e-04 -2.52153955e-04] [ 2.01504385e-04 -3.14711284e-04 5.96075296e-05] [-2.03613516e-04 -3.63848992e-04 9.15803921e-05] [ 3.19662110e-04 -1.98158952e-04 -5.38916126e-04] [-3.23824667e-04 -8.17865433e-05 4.41883390e-04] [-1.53186514e-04 -1.08316808e-04 4.59641524e-04] [ 1.50132449e-04 -8.28319066e-05 -3.17693119e-04] [ 8.36700821e-05 1.37925765e-04 2.50521166e-04] [-8.41140928e-05 1.62629729e-04 -4.33993779e-04] [ 2.12785514e-04 8.69712959e-06 3.03373239e-04] [-2.12512263e-04 -4.49196556e-05 -3.47129580e-04] [-2.10677303e-04 1.56983505e-04 7.57366252e-05] [ 2.10257211e-04 2.45656410e-04 -2.97747574e-04] [-8.56832926e-04 -6.89286632e-05 1.93288937e-04] [ 8.56367875e-04 1.49164830e-05 -2.73425946e-04] [ 1.43248046e-04 2.95994227e-05 9.67525759e-05] [-1.40902109e-04 -1.20863077e-04 -2.01779785e-04] [-5.72050917e-08 -1.48061771e-04 -1.41911219e-04] [ 3.91914482e-07 -9.26537467e-05 2.99600305e-04] [ 3.69074655e-04 -3.23066709e-04 -1.37477711e-04] [-3.68540323e-04 -3.35291081e-04 3.05732052e-04] [-1.88097143e-04 -7.73811158e-05 3.08426868e-05] [ 1.87980381e-04 -6.96067966e-05 2.01525206e-04] [-1.20105599e-04 -4.77652178e-04 -1.17470489e-04] [ 1.22224858e-04 -3.68280701e-04 -1.78753934e-04] [ 1.96835529e-05 1.06438771e-04 -1.52613286e-04] [-1.94196153e-05 -7.09157462e-05 2.94432838e-04] [ 1.91493014e-04 4.67067396e-04 9.31752666e-04] [-1.87190736e-04 4.95491156e-04 -3.76106291e-04] [ 2.25561596e-04 -2.84457937e-04 2.14785008e-05] [-2.24646229e-04 -2.69567834e-04 -2.82353356e-04] [-3.27211334e-04 -1.90446552e-04 -1.19782526e-04] [ 3.27770643e-04 -1.35312304e-04 2.28632727e-05] [-1.14459589e-04 5.99951918e-04 3.16064909e-04] [ 3.16145169e-04 1.75744746e-04 6.58789774e-05] [ 1.46830391e-04 7.02682381e-04 -1.01014966e-04] [-3.35834714e-04 6.56323264e-05 1.50702048e-04] [ 2.15867976e-04 2.99711504e-04 2.13468670e-04] [-1.65404741e-04 2.42498330e-04 -5.79492558e-05] [-2.89288644e-04 3.84231735e-04 -1.08584190e-04] [ 2.39716144e-04 1.58124712e-04 1.62712741e-04] [ 1.95773279e-04 -7.48013385e-05 -3.65283792e-04] [ 2.99828458e-04 4.59937435e-04 -6.06311785e-04] [-9.30468637e-05 2.53562910e-04 2.36070169e-04] [-4.05334362e-04 1.31801517e-04 4.76823074e-04] [ 2.07655761e-04 -1.43932255e-04 -8.68421472e-05] [ 1.60472097e-04 -1.95135380e-04 1.20763554e-04] [-2.81290236e-04 -1.88395423e-04 9.41284172e-05] [-9.07542119e-05 -1.51671922e-04 -1.11669827e-04] [ 4.25397127e-04 1.62678726e-04 2.64409267e-04] [ 7.35285767e-05 -3.83376210e-05 -3.57839397e-04] [-3.80013765e-04 1.19327875e-04 -3.99064540e-04] [-1.25966643e-04 2.68995040e-06 2.21319767e-04] [ 4.83298418e-04 2.36957487e-05 -2.14578793e-04] [-1.00524638e-04 3.29210118e-04 -6.30713853e-06] [-2.76722677e-04 -3.87088493e-05 1.75334689e-04] [-1.00686150e-04 3.91457997e-04 -3.29573977e-05] [ 9.70705430e-04 4.13253024e-05 -2.05961471e-04] [-2.73917096e-05 -4.96466334e-04 -2.34969476e-04] [-9.03148185e-04 -2.46434383e-04 2.75479849e-04] [-4.14278142e-05 -2.07702641e-04 3.06179440e-04] [-1.00175648e-04 2.29273895e-04 5.50333843e-05] [ 1.65267347e-04 -5.01896313e-04 3.89568448e-05] [-5.87191117e-05 2.78476741e-04 -5.17388047e-05] [-6.54529362e-06 -5.52059132e-04 -3.60605425e-05] [ 1.66284720e-04 2.01960146e-04 4.18528906e-04] [-3.92229430e-04 -2.45541367e-04 4.54923685e-05] [-1.93311388e-04 1.51185503e-04 -3.90703661e-04] [ 4.17115817e-04 -1.95796557e-04 -1.80615445e-05] [ 5.50319052e-04 2.23568009e-04 -8.66830429e-05] [-2.29067585e-05 -3.80035522e-04 -2.34605352e-04] [-3.61662881e-04 1.49886959e-04 1.29823714e-04] [-1.68828264e-04 -3.14316760e-04 2.79437643e-04] [ 3.07866114e-05 1.46236795e-04 -9.43401973e-05] [-1.36390820e-04 -1.62058828e-05 -2.98795123e-04] [-2.00691386e-05 2.06319426e-04 -5.57948914e-05] [ 1.27187800e-04 -7.59948483e-05 1.49183571e-04] [ 5.98457092e-04 1.45342074e-04 3.31123414e-04] [-5.99976365e-04 1.62055671e-04 -2.47249270e-04] [ 2.95346023e-04 2.32337101e-04 2.61797426e-04] [-2.97261442e-04 1.39639787e-04 -1.10926671e-04] [ 1.67009363e-04 -1.45652105e-04 -3.35958753e-04] [-1.66989448e-04 -1.61954604e-04 2.58563057e-04] [ 9.94952544e-05 1.61526208e-04 -3.98048815e-04] [-9.96634264e-05 1.88524506e-04 2.81821088e-04] [-5.09259172e-04 -4.16059590e-05 1.90219874e-04] [ 5.14478838e-04 -3.47728324e-04 -2.68485732e-04] [-1.98089740e-04 -3.99971549e-04 -2.70939635e-04] [ 1.97581947e-04 -2.44836569e-04 1.11755849e-04] [-3.28368534e-04 2.24360469e-04 2.74820093e-04] [ 3.26285538e-04 2.50286084e-04 -3.56777398e-04] [ 8.37832814e-05 -1.10587186e-04 -4.77102376e-04] [-8.20905718e-05 -1.16927094e-04 6.11120193e-04] [-5.88581621e-05 6.51569311e-04 -2.23073509e-04] [ 8.01974775e-05 4.06876408e-05 -3.19042027e-04] [ 1.28061680e-04 5.11234785e-04 3.43775466e-04] [-1.50400468e-04 1.81782043e-04 4.42947587e-04] [-1.24979927e-04 -3.50960419e-04 -3.84784572e-04] [ 2.40873851e-04 -2.79363221e-04 1.09700773e-04] [ 1.37315147e-04 -3.57037056e-04 3.44934521e-04] [-2.56118957e-04 -2.74800236e-04 -1.54306200e-04]] Final stress: [-1.72884274e-06 9.28974937e-08 -1.19604290e-05 9.07528294e-06 5.39041171e-09 -1.44329694e-05] Minimization converged after 142 steps. Minimization converged after 144 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-1.45276820e-04 -1.83399745e-04 -2.21268226e-04] [ 1.46903226e-04 2.98571592e-04 -3.03440729e-05] [-2.02202794e-04 2.79915249e-04 5.34814131e-05] [ 2.00454770e-04 2.23771294e-04 8.86972940e-05] [-2.90230921e-04 4.06038153e-05 3.66174488e-04] [ 2.86564916e-04 1.52856634e-04 -4.56030776e-04] [ 1.68156062e-04 1.66789440e-05 -2.62243085e-04] [-1.70739946e-04 4.35466295e-06 2.99536667e-04] [-7.77571820e-05 -5.88539135e-05 -3.70758697e-04] [ 7.74537314e-05 -4.13644890e-05 2.28695433e-04] [-2.05886506e-04 6.35565258e-05 -2.96289472e-04] [ 2.06221018e-04 5.00170171e-06 2.46040103e-04] [ 2.20836470e-04 -2.02176663e-04 -2.72992948e-04] [-2.21305302e-04 -1.12389230e-04 5.70970925e-05] [ 7.63558368e-04 1.13387753e-06 -1.18812036e-04] [-7.64120722e-04 -4.78154429e-06 9.13054005e-06] [-1.68946621e-04 1.10893806e-04 -2.14250266e-04] [ 1.70920082e-04 -1.92599641e-05 1.25532819e-04] [ 3.32699078e-05 8.45659106e-05 2.50108591e-04] [-3.29926828e-05 1.49132800e-04 -1.07364713e-04] [-3.49151489e-04 2.27188745e-04 2.55365135e-04] [ 3.49742486e-04 2.42968805e-04 -1.18708830e-04] [ 1.95638661e-04 1.78227458e-04 2.32576529e-04] [-1.95784140e-04 1.81387338e-04 -1.88209863e-05] [ 8.45047311e-05 3.04174347e-04 -1.07193827e-04] [-8.26035465e-05 4.16489798e-04 -1.22371127e-04] [ 1.17893353e-05 5.74051912e-05 1.79000725e-04] [-1.16213040e-05 -8.91537741e-05 -3.05307943e-05] [-1.63546846e-04 -4.71230533e-04 -3.75089331e-04] [ 1.67159088e-04 -4.46451586e-04 8.79813256e-04] [-2.04375925e-04 2.78960438e-04 -2.65951371e-04] [ 2.05269660e-04 2.85588187e-04 2.35913950e-05] [ 3.35980246e-04 1.34200870e-04 3.25454818e-05] [-3.35524974e-04 1.56447254e-04 -1.01783509e-04] [ 1.30066703e-04 -6.10787156e-04 -6.59278660e-05] [-3.29375756e-04 -7.49939555e-05 1.38295185e-04] [-9.20222842e-05 -5.18193336e-04 2.64888843e-04] [ 3.02367139e-04 -1.73970581e-04 6.21914175e-05] [-2.97235662e-04 -3.23564637e-04 -1.14047243e-04] [ 1.93987640e-04 -1.25475165e-04 1.11785947e-04] [ 2.09973358e-04 -2.36985526e-04 2.37355798e-04] [-1.05930333e-04 -2.11743514e-04 1.14720582e-05] [-1.03443514e-04 -2.55038914e-04 2.40392153e-04] [-3.58345364e-04 -7.23867862e-05 4.77772436e-04] [ 1.93937220e-04 5.87957554e-05 -3.69265375e-04] [ 2.65265697e-04 -3.86050815e-04 -6.06613517e-04] [-2.33627327e-04 1.73948582e-04 6.55661280e-05] [-4.85204444e-05 2.03093589e-04 -1.58791118e-04] [ 1.45907587e-04 1.58200050e-04 -8.80827676e-05] [ 1.32967580e-04 2.18048376e-04 1.37739623e-04] [-3.58705804e-04 -1.02063070e-04 -3.55409572e-04] [-1.24612749e-04 -1.42632042e-05 2.11983755e-04] [ 4.03582772e-04 -1.45715458e-04 2.30094011e-04] [ 7.36831917e-05 2.72053691e-05 -3.38906985e-04] [-1.84782804e-04 1.27961550e-06 1.30364355e-04] [-1.07962334e-04 -3.86930489e-04 1.17332679e-05] [ 3.74778257e-04 -5.75227790e-05 -1.68480938e-04] [-7.76497223e-05 -3.28279699e-04 -4.98794292e-05] [-7.86139481e-04 1.56558993e-04 2.86098152e-04] [-3.34899872e-05 1.97745470e-04 3.15077577e-04] [ 8.44584024e-04 -1.10187458e-04 -2.14026581e-04] [-2.61106348e-05 4.65408517e-04 -2.41497908e-04] [-5.08423976e-05 -2.50547069e-04 -1.19587581e-04] [ 4.73972528e-05 5.64444663e-04 -4.64321450e-05] [-1.26367203e-04 -1.69804524e-04 1.46450020e-04] [ 1.29654954e-04 4.82844899e-04 7.32185218e-05] [-1.42497778e-04 -1.01305963e-04 -3.24761327e-04] [ 3.44604175e-04 1.68535594e-04 3.37816540e-05] [ 1.28536385e-04 -1.52898066e-04 3.46030975e-04] [-3.32364694e-04 2.19230425e-04 -1.29286528e-05] [-3.41650741e-04 -1.42614225e-04 1.35014109e-04] [-1.45764362e-04 2.85222890e-04 2.26401190e-04] [ 5.02895031e-04 -2.38024723e-04 -9.26883655e-05] [-1.79910793e-05 3.73813966e-04 -1.82524544e-04] [-3.53449505e-05 -1.87950322e-04 6.60697433e-06] [ 8.49459672e-05 6.57117116e-05 1.32761345e-04] [ 6.26313605e-05 -1.30802503e-04 -1.56783013e-04] [-1.11303950e-04 9.07016499e-06 -2.82583871e-04] [-6.25403033e-04 -1.02436700e-04 -2.05257750e-04] [ 6.24114090e-04 -9.00064515e-05 2.77412170e-04] [-2.33208869e-04 -9.42176602e-05 -8.01976439e-05] [ 2.31578446e-04 -1.90201211e-04 2.26588138e-04] [-1.18695212e-04 1.21942617e-04 2.16342373e-04] [ 1.18764919e-04 1.07228610e-04 -2.81002537e-04] [-5.92299964e-05 -1.89265861e-04 2.45533259e-04] [ 5.91793248e-05 -1.37526063e-04 -3.17485805e-04] [ 4.32454508e-04 2.21333002e-04 -2.34367350e-04] [-4.27754049e-04 -2.25645126e-04 1.77559538e-04] [ 1.45570377e-04 1.91947943e-04 7.22122826e-05] [-1.45943108e-04 3.51128206e-04 -2.22126242e-04] [ 3.02600868e-04 -2.52499457e-04 -3.38865728e-04] [-3.04311213e-04 -2.10641380e-04 2.58050602e-04] [-5.48392397e-05 6.46405342e-05 5.46975364e-04] [ 5.62081742e-05 5.67496750e-05 -4.20942084e-04] [ 1.31700103e-04 -4.75171802e-04 2.61694645e-04] [-1.08571232e-04 -2.24286049e-04 5.05416878e-04] [-7.45296233e-05 -6.40088205e-04 -9.29804074e-05] [ 5.05713489e-05 -5.86863861e-05 -3.33661793e-04] [ 1.63654707e-04 3.42636062e-04 2.72164167e-04] [-2.31440860e-04 2.52830200e-04 -1.58345041e-04] [-1.37995021e-04 3.35712890e-04 -3.40819321e-04] [ 2.03484619e-04 2.58450120e-04 8.56626969e-05]] Final stress: [-1.63575859e-06 -9.88715408e-08 -1.14210041e-05 -8.97274118e-06 4.79692877e-09 1.23256810e-05] Minimization converged after 28 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.13284107e-03 -3.96257310e-04 -2.50949962e-04] [ 1.24467368e-03 2.46743029e-04 -3.15102514e-04] [ 1.96963822e-03 -6.17211202e-05 1.97429394e-04] [ 3.90761943e-04 9.33325836e-05 1.58792061e-05] [ 1.10977415e-03 -6.22456905e-04 -1.33004843e-04] [ 1.93913256e-03 4.29139630e-04 -9.66255767e-05] [-9.88536843e-04 7.38044063e-04 -6.41151432e-04] [-3.56515743e-04 -9.79068958e-04 -8.43317553e-04] [ 2.46777552e-03 -1.55751381e-04 -3.71532876e-04] [-4.64129079e-04 1.26911712e-04 -3.33021787e-04] [ 3.69508549e-04 1.87913842e-04 -2.94285984e-04] [-2.90541985e-03 -3.07853545e-04 -3.99441752e-04] [ 1.41392560e-04 -2.87585838e-04 -1.01044681e-03] [ 2.40291488e-03 2.40756309e-04 -9.82718068e-04] [-2.09977331e-03 -4.95700006e-04 -1.01345200e-03] [ 2.71735868e-03 5.55546991e-04 -1.00857814e-03] [ 3.90893920e-04 1.23906173e-04 -2.95119534e-04] [-1.07169199e-03 6.04354528e-06 -1.81566188e-04] [ 9.72454251e-04 6.10293333e-05 5.74005895e-04] [-7.99531485e-04 -5.59955243e-05 5.87012893e-04] [-2.69476676e-04 -8.52837502e-05 -2.71677290e-05] [-7.74863993e-04 1.68609558e-05 1.09025273e-04] [-1.78327771e-03 -8.21980356e-04 1.62424045e-04] [ 5.24625254e-04 7.71342307e-04 1.78010128e-04] [ 2.52447812e-04 -1.13647791e-03 6.20648387e-04] [ 1.02974689e-03 7.30779733e-04 3.23429808e-04] [-7.96548050e-05 8.78154141e-04 1.10496566e-03] [ 4.28662177e-04 -8.10816792e-04 1.12063284e-03] [ 1.86250307e-03 3.54959360e-05 9.67970156e-04] [-3.18940301e-04 1.68266119e-04 9.74030634e-04] [ 3.62377736e-03 1.63318132e-04 -4.26086616e-04] [ 1.93090837e-03 -6.76722695e-05 -5.35910966e-04] [-5.97655635e-04 3.19680553e-04 -4.35623991e-05] [ 7.63169019e-04 -1.87326138e-04 -6.58353214e-05] [-1.04202788e-03 -9.43096314e-05 -6.22539941e-04] [ 1.63015794e-03 -1.79390866e-05 -1.11715298e-05] [ 6.81148523e-04 9.41451839e-04 2.44239241e-04] [-8.80650209e-04 -6.39713495e-04 9.30210878e-04] [ 6.14304303e-04 6.23686641e-04 4.24641741e-04] [-4.01830931e-04 2.20554646e-04 -3.52828208e-04] [-4.48889373e-04 3.18469916e-04 6.88618397e-04] [ 6.24417552e-04 -1.19132848e-03 -3.97786740e-05] [-1.76492553e-03 -1.40287980e-03 1.45163937e-03] [-1.67743204e-03 3.56633937e-03 -1.90051682e-03] [-1.05317316e-03 -2.66839495e-03 1.50157364e-03] [-2.15058572e-03 1.50910929e-04 -1.30268201e-03] [-6.11294549e-04 1.83179044e-04 -1.01244969e-03] [-1.17722315e-03 -3.98818290e-04 -1.14685657e-03] [-1.13304116e-03 3.70331152e-04 1.22671751e-03] [-5.54245026e-04 -3.49280816e-04 8.02927263e-04] [ 1.19294885e-03 9.99401432e-04 -4.36707342e-04] [-1.28390156e-03 -3.64823624e-04 5.25835290e-04] [-1.11637327e-03 -2.62233541e-04 -5.29431249e-04] [ 1.50769669e-03 -2.10610642e-04 4.61968631e-04] [ 1.59769044e-03 1.68560453e-03 8.41645789e-04] [-1.73968441e-03 4.46933962e-04 -1.38783519e-03] [ 2.34145233e-04 -1.30733685e-03 1.40695494e-03] [-4.54167910e-04 -6.15673668e-04 -9.00279703e-04] [ 1.84411292e-03 9.14071600e-04 1.03777800e-03] [-1.66795587e-03 2.45349075e-03 -8.43282484e-04] [-1.24048875e-03 -3.44297690e-03 1.11601067e-03] [ 1.35566918e-03 -4.35985905e-06 -6.04253060e-04] [-1.09752278e-03 2.07689540e-03 6.49099601e-04] [ 9.94558656e-04 4.76846301e-04 -1.10826894e-03] [ 6.16375437e-04 -3.01692732e-04 1.37550403e-03] [-6.54578105e-04 -2.27706671e-03 -2.35518852e-04] [ 1.50180910e-03 9.90116182e-04 1.60919890e-03] [-1.89089236e-03 -1.29296358e-03 1.13577662e-03] [-2.37852911e-03 7.57625711e-04 -1.21394659e-03] [ 1.83702675e-03 -4.21806757e-04 -1.74232765e-03] [ 9.16870491e-04 1.13990485e-03 9.73601509e-04] [-1.33474020e-03 -9.33706958e-04 -5.23868513e-04] [-8.75356843e-05 6.00423978e-04 9.80341393e-04] [-2.01853189e-04 -4.98018511e-04 -4.63139115e-04] [ 1.46476096e-03 4.34882428e-04 4.52227793e-04] [ 6.83273646e-04 -8.16325125e-04 -5.34478371e-04] [ 4.07865995e-04 1.14037124e-03 -1.98169538e-04] [ 1.95192813e-03 -8.04701586e-04 -1.35427686e-03] [ 1.71023877e-04 3.95576679e-04 4.50285824e-04] [-1.69890543e-03 -2.67039654e-04 3.16416215e-04] [ 3.08743530e-03 6.78354772e-05 1.84655373e-04] [-2.98583682e-03 -9.00106382e-05 2.09090271e-04] [-5.88711267e-04 -4.36348169e-05 -1.13350917e-04] [-6.57045586e-04 -4.39143157e-05 -1.48743787e-04] [ 3.46010943e-03 -6.55782967e-04 4.05759069e-05] [-1.03306432e-03 6.76906029e-04 -4.83217861e-05] [-3.19100878e-03 5.80824297e-04 -2.00383627e-04] [ 7.45845639e-04 -9.42019650e-06 -3.62062574e-04] [-4.22226846e-03 -2.92346279e-04 -1.29117106e-04] [ 1.26306807e-03 1.99557922e-04 -4.73735976e-05] [-6.55854718e-04 3.10764127e-04 -4.00738468e-05] [ 6.42288794e-04 -3.07556238e-04 -9.08031021e-05] [ 1.92236861e-03 6.13517269e-04 3.46439817e-04] [ 1.01092852e-04 -3.71635352e-04 2.90408081e-04] [-8.84454388e-04 3.17262869e-03 -1.02054468e-03] [ 1.13548987e-03 1.27520784e-04 4.52783153e-04] [ 1.31839591e-03 -6.00513033e-04 7.11689301e-04] [-1.25053091e-03 -2.88198643e-03 2.25278021e-03] [-1.69299587e-03 9.63554805e-04 -1.83198920e-03] [-1.61642950e-03 -9.55224314e-04 4.64376086e-04] [-1.08915225e-03 1.30490896e-04 -1.60833158e-03] [-2.04957143e-03 -3.15960337e-04 8.83104979e-04]] Final stress: [-7.68642100e-06 8.59793814e-06 -3.86339300e-05 -3.43022498e-07 -2.12413497e-05 -2.64891688e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.44150137e-03 -6.28959334e-04 -4.54595383e-04] [ 2.50605071e-03 8.16579444e-04 -3.75408258e-04] [ 4.49675623e-04 -1.96523436e-04 4.80293798e-05] [ 2.28449026e-03 1.58973801e-04 2.75562619e-04] [ 2.29167093e-03 -4.84772001e-04 -1.61024827e-04] [ 1.18601449e-03 7.27620403e-04 -2.08788632e-04] [-6.16986984e-04 1.34249925e-03 -1.23554364e-03] [-1.20446971e-03 -1.03951655e-03 -9.81675525e-04] [-6.28129091e-04 -9.41960463e-05 -3.45364080e-04] [ 2.83908452e-03 1.26314574e-04 -3.91377636e-04] [-3.37954731e-03 3.45280225e-04 -5.15463438e-04] [ 4.98675009e-04 -1.97277268e-04 -3.82605839e-04] [ 2.85186778e-03 -3.11376610e-04 -1.36477459e-03] [ 2.84132427e-04 3.69989281e-04 -1.40427992e-03] [ 3.01255718e-03 -8.09244038e-04 -1.47433448e-03] [-2.34883887e-03 7.34360017e-04 -1.48199780e-03] [-1.11811836e-03 -2.91239745e-06 -2.66452052e-04] [ 3.47210697e-04 -1.61247765e-04 -4.10883694e-04] [-1.01460466e-03 9.04221893e-05 7.82745937e-04] [ 1.18459410e-03 -9.95766173e-05 7.65666834e-04] [-7.41078947e-04 -6.77866216e-05 1.01421691e-04] [-2.22692022e-04 1.51781364e-04 -7.36299048e-05] [ 6.82859999e-04 -9.06674756e-04 2.31434517e-04] [-1.89344677e-03 9.76874088e-04 2.11744344e-04] [ 1.41599722e-03 -1.02931698e-03 5.92753367e-04] [ 4.82461981e-04 1.54499536e-03 9.79586451e-04] [ 5.17872179e-04 1.22114759e-03 1.65641999e-03] [ 1.86672435e-04 -1.31176546e-03 1.64069949e-03] [-1.03259698e-04 -1.83844089e-04 1.02755158e-03] [ 2.18969940e-03 -7.29826111e-05 1.01926999e-03] [ 2.61837870e-03 6.52153687e-05 -5.75791217e-04] [ 4.46165396e-03 -1.81522847e-04 -4.40478907e-04] [ 1.02878500e-03 3.41670183e-04 -1.06603843e-04] [-6.30606155e-04 -5.08523880e-04 -7.78855329e-05] [ 6.55260909e-04 -1.08001886e-03 3.25374851e-04] [-1.08076016e-03 7.80358696e-04 1.14138495e-03] [-1.17758720e-03 1.46497570e-04 -8.66060521e-04] [ 1.73921056e-03 -8.47575100e-05 -1.46353585e-04] [-6.93130324e-04 -3.38948198e-04 7.17127586e-04] [ 8.45574008e-04 1.21373408e-03 8.37770077e-05] [ 7.05457595e-04 -6.28648812e-04 3.09496721e-04] [-5.07336479e-04 -2.05789251e-04 -3.87977960e-04] [-1.15274761e-03 3.11451454e-03 1.73432798e-03] [-2.47634216e-03 -2.48278681e-04 -1.59083314e-03] [-2.00165658e-03 1.74491844e-03 1.86583156e-03] [-1.93038443e-03 -4.16809439e-03 -2.14397494e-03] [-1.73248366e-03 -4.25238510e-04 1.22216670e-03] [-5.86373574e-04 4.75509281e-04 6.97576454e-04] [-7.78792703e-04 -1.96193473e-04 -1.05549876e-03] [-1.67218763e-03 3.92878290e-04 -1.21310891e-03] [-1.15773951e-03 3.65072757e-04 -5.59751494e-04] [ 1.75516414e-03 2.36218967e-04 6.77027370e-04] [ 1.41275431e-03 -1.27733221e-03 -5.35116096e-04] [-1.41639906e-03 4.72800404e-04 6.64673606e-04] [ 3.72585853e-04 1.61820920e-03 1.70848392e-03] [-9.29702678e-04 4.89366689e-04 -8.37366316e-04] [ 1.99627376e-03 -2.19293212e-03 9.95535042e-04] [-2.46547771e-03 -1.68693418e-04 -1.45488268e-03] [-1.44429069e-03 4.06145653e-03 1.22692650e-03] [ 1.44357123e-03 -4.42788841e-05 -7.80864531e-04] [ 2.05280966e-03 -1.02483159e-03 1.27821264e-03] [-1.97246310e-03 -2.89776533e-03 -9.28408660e-04] [ 6.91508832e-04 2.25529422e-04 1.81337229e-03] [-6.61042959e-04 2.56080308e-03 -3.51821061e-05] [-1.40606915e-03 -2.09235501e-03 7.94630424e-04] [ 1.35651707e-03 -6.57550649e-04 -1.23492927e-03] [-2.84358333e-03 -8.35835706e-04 -1.58727877e-03] [ 2.17446371e-03 5.02954999e-04 -2.08770233e-03] [ 1.71937607e-03 -1.28316200e-03 1.81453966e-03] [-2.19141841e-03 1.57641894e-03 1.37331790e-03] [-2.27827037e-04 -6.41839814e-04 1.10835834e-03] [-1.96131118e-04 4.29233600e-04 -2.72364504e-04] [ 1.35452976e-03 -1.08968121e-03 8.51927078e-04] [-1.94371054e-03 9.20494156e-04 -5.96896304e-04] [ 4.66703947e-04 -1.23394452e-03 -2.54994374e-04] [ 2.21341575e-03 1.00913558e-03 -1.53758907e-03] [ 1.59302696e-03 -4.50421059e-04 4.46283891e-04] [ 8.19763659e-04 7.32463910e-04 -6.26887312e-04] [-1.64563030e-03 3.75082737e-04 3.95002970e-04] [-4.21805673e-05 -5.40978103e-04 5.57453244e-04] [-3.41823762e-03 9.44612639e-05 2.69229769e-04] [ 3.74198024e-03 -6.71935524e-05 2.36012925e-04] [-7.01542828e-04 -3.68412398e-05 -1.06086958e-04] [-6.74801325e-04 1.48080185e-04 -6.12018415e-05] [-9.85134270e-04 -9.88774159e-04 5.05156314e-05] [ 3.91331031e-03 9.59812120e-04 1.57822325e-04] [ 1.15720862e-03 3.34630763e-04 -4.68972406e-04] [-4.00908066e-03 -1.05407858e-03 -2.64491060e-04] [ 1.36080978e-03 -2.26888091e-04 -6.19351482e-05] [-5.02695895e-03 3.43234027e-04 -1.66104758e-04] [ 6.56504103e-04 4.53650438e-04 -1.80868357e-04] [-7.00797803e-04 -4.58056369e-04 -1.17983475e-04] [ 3.55388006e-04 3.11954979e-04 3.82442730e-04] [ 2.53792996e-03 -6.17503701e-04 4.50724372e-04] [ 1.41486393e-03 8.73742962e-04 9.68356099e-04] [-1.51725508e-03 3.30617102e-03 2.75729813e-03] [-1.05114778e-03 -3.60608507e-03 -1.00149923e-03] [ 1.17831263e-03 -3.47488988e-04 7.00936918e-04] [-1.35102493e-03 3.35873887e-05 -2.01425861e-03] [-2.60945546e-03 2.26681125e-04 7.99317066e-04] [-2.04224608e-03 -1.27926029e-03 -2.29074319e-03] [-2.12327128e-03 1.23437738e-03 2.88775044e-04]] Final stress: [-8.92120914e-06 1.05053574e-05 -4.33449637e-05 4.34480456e-07 -2.50419563e-05 2.93910291e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-1.01607188e-03 4.20012516e-04 -1.22134868e-04] [-1.64290568e-03 -3.44733513e-04 -9.02153863e-05] [-1.05644427e-04 3.76087273e-05 -2.03270025e-05] [-1.42168974e-03 -5.37606321e-05 7.29687861e-05] [-1.50808938e-03 -2.35625071e-04 -8.11032322e-05] [-8.44633210e-04 3.35529209e-04 -9.91627654e-05] [ 6.59022064e-05 5.37686648e-04 -3.54838634e-04] [ 7.46747141e-04 -4.16589732e-04 -2.55043796e-04] [ 3.53230808e-04 -1.11193259e-04 -2.33147651e-04] [-1.82035448e-03 1.27736360e-04 -2.54817905e-04] [ 2.15307382e-03 1.46654911e-04 -1.49420384e-04] [-2.17874417e-04 -8.58160062e-05 -9.82713456e-05] [-1.29133975e-03 -1.47771922e-04 -5.73326802e-04] [ 7.80743750e-04 1.71966346e-04 -5.86854348e-04] [-1.63900376e-03 -3.49108910e-04 -4.11068096e-04] [ 1.84015424e-03 3.14753356e-04 -4.16371996e-04] [ 8.83520132e-04 1.17341726e-05 -9.10427440e-05] [-3.64338950e-04 -7.66488990e-05 -1.48132229e-04] [ 4.52423171e-04 3.62325416e-05 3.92394472e-04] [-1.01005657e-03 -3.74487721e-05 3.84474663e-04] [ 6.29026833e-04 5.45989432e-06 7.02668812e-05] [ 2.93337709e-04 3.10428455e-05 2.35378364e-06] [ 2.17298947e-04 -7.46328944e-04 1.23673652e-04] [ 1.63440186e-03 7.69768704e-04 1.15177211e-04] [-8.66616141e-04 -4.47700203e-04 9.42138628e-05] [-2.07943847e-04 6.56050054e-04 2.47589392e-04] [-8.39098160e-04 4.37337038e-04 4.84106249e-04] [ 1.00900892e-04 -4.71004273e-04 4.75363465e-04] [ 2.16455012e-04 -1.50971890e-04 7.76328169e-04] [-1.46368309e-03 4.46965833e-05 7.74871280e-04] [-1.01246957e-03 7.86951725e-05 -4.06811952e-04] [-2.16021097e-03 -1.25776023e-04 -3.49880215e-04] [-5.23348570e-04 -1.89198313e-05 -8.29253761e-06] [ 5.30565437e-04 -4.51575419e-05 4.65689308e-07] [-1.10925789e-03 -1.14293327e-04 1.91296008e-04] [ 1.00616447e-03 -7.91167927e-05 -2.40459502e-04] [ 9.00236373e-04 5.06756636e-04 4.95235345e-04] [-5.99942496e-04 -4.15338880e-04 2.38955832e-05] [ 9.10471077e-04 -8.43103407e-05 -4.10100317e-04] [-3.93606645e-04 -5.83602214e-04 5.82037724e-04] [-2.59306359e-04 1.01479350e-03 -3.68184669e-04] [ 8.02481256e-04 -3.38392601e-04 6.00001598e-04] [ 1.38691031e-03 -1.97921084e-03 -1.58022131e-03] [ 1.20858277e-03 6.31337202e-04 5.16163351e-04] [ 1.48626991e-03 1.35146706e-04 -5.83809822e-04] [ 9.93970127e-04 1.39934970e-03 1.22975795e-03] [ 5.26160419e-04 3.89148644e-04 -7.56333483e-04] [ 3.45975224e-04 8.70600649e-05 -6.22068515e-04] [ 4.93238785e-04 -5.43727148e-05 5.98859538e-04] [ 3.34741518e-04 -3.25300383e-04 8.76425278e-04] [ 8.51845080e-04 -3.24657449e-04 3.07416992e-04] [-1.08244882e-03 -8.39331305e-04 -1.63312918e-05] [-1.21484709e-03 4.25987022e-04 -1.09347746e-06] [ 7.40241142e-04 6.59431099e-04 -3.37440282e-04] [ 2.00067453e-04 -2.95454324e-04 -1.21975017e-03] [-1.22310397e-03 -4.39851781e-04 5.97272133e-04] [-1.14150507e-04 -7.77618170e-05 -7.51664455e-04] [-8.71430288e-04 7.06361302e-04 1.10674547e-03] [ 8.81731319e-04 -1.13880503e-03 -9.14101354e-04] [-1.51510073e-03 -6.72292468e-04 4.04650825e-04] [-1.20762266e-03 5.35974698e-05 -8.58517525e-05] [ 6.01905147e-04 1.79895044e-03 1.15438028e-03] [-1.05281090e-03 -1.57917701e-04 -7.65756992e-04] [ 5.44005119e-04 -1.80402244e-03 4.27330272e-04] [ 4.61684061e-04 1.73127931e-03 -3.10763250e-04] [-1.00433077e-03 2.45381988e-04 8.07173526e-04] [ 9.99204673e-04 8.96614178e-04 6.80357933e-04] [-9.73859797e-04 -6.29736763e-04 1.22126594e-03] [-1.17168460e-03 3.23068847e-04 -1.19550896e-03] [ 1.27302748e-03 -6.10771284e-04 -6.25717687e-04] [ 9.34107434e-04 4.82712935e-04 -6.96522716e-04] [-4.69927709e-04 -8.97316060e-04 9.70949595e-04] [ 2.82236415e-04 5.74017247e-04 -6.44448446e-04] [ 1.19515722e-04 -3.13691060e-04 1.00078543e-03] [-2.65274887e-04 6.66022770e-04 -5.69751574e-04] [-1.06060428e-03 -4.07276235e-04 5.31656888e-04] [-1.35998176e-03 5.65672013e-04 -1.17562318e-03] [-7.06959147e-05 -8.00725384e-04 1.26271159e-05] [ 1.45868245e-03 1.63039619e-04 1.56477779e-04] [-5.37795174e-04 -2.31659904e-04 2.23577583e-04] [ 2.29755764e-03 8.92646688e-05 1.26549393e-04] [-2.66611603e-03 -7.68416258e-05 1.16182275e-04] [ 9.26240271e-04 9.17337976e-05 -1.16646081e-04] [ 8.64302653e-04 -4.97304644e-05 -9.74401912e-05] [ 1.08930988e-03 -3.52571834e-04 -6.21727787e-05] [-2.40073303e-03 3.41180879e-04 -1.55593650e-05] [ 1.82657403e-04 -3.95624008e-04 -2.18593583e-04] [ 1.93815996e-03 1.07996341e-04 -1.36125586e-04] [-1.17797581e-03 -1.55179913e-04 -4.48369187e-05] [ 3.45269133e-03 2.00302613e-04 -8.58827749e-05] [-3.80868769e-04 1.26658828e-04 -4.13606794e-05] [ 3.76641763e-04 -1.25705556e-04 -1.45018576e-05] [-3.56052087e-04 5.11209935e-04 1.75159801e-04] [-1.01188146e-03 -6.33881749e-04 2.02644340e-04] [-6.42295631e-04 1.62782004e-05 2.38992115e-04] [ 5.81034182e-04 -2.09580745e-03 -8.35007143e-04] [ 9.09724803e-04 2.02790548e-03 1.38384108e-03] [-8.76608073e-04 1.44270460e-04 2.74996431e-04] [ 8.34897529e-04 3.59230001e-04 4.45342287e-04] [ 1.09035710e-03 -8.34739836e-04 -1.15381695e-03] [ 1.33490649e-03 4.59676893e-04 7.23573313e-04] [ 5.05968021e-04 1.05445089e-04 -9.74157715e-04]] Final stress: [-5.45588325e-06 5.41783262e-06 -2.89864570e-05 1.77361352e-07 1.22315309e-05 -1.74404752e-05] Minimization converged after 150 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.07040196e-03 -4.38349591e-03 -1.01855491e-03] [-1.07040196e-03 4.38349582e-03 -1.01855489e-03] [ 1.46633201e-03 1.14799958e-03 3.75181097e-04] [-1.46633202e-03 -1.14799956e-03 3.75181095e-04] [ 2.14549376e-03 -5.25200043e-04 1.40818330e-04] [-2.14549376e-03 5.25200043e-04 1.40818328e-04] [-4.53685473e-03 1.74740168e-03 -3.04629123e-03] [ 4.53685473e-03 -1.74740165e-03 -3.04629120e-03] [-1.61687855e-03 1.14861066e-04 9.39167555e-04] [ 1.61687855e-03 -1.14861070e-04 9.39167550e-04] [ 6.61929986e-04 6.70349863e-04 -1.00451871e-03] [-6.61929983e-04 -6.70349857e-04 -1.00451870e-03] [-1.46146286e-04 2.78551871e-04 -2.63971965e-04] [ 1.46146286e-04 -2.78551880e-04 -2.63971978e-04] [-3.84827603e-03 3.43185262e-03 1.31908780e-03] [ 3.84827602e-03 -3.43185261e-03 1.31908783e-03] [ 3.89064440e-04 -1.01427630e-04 4.51667006e-05] [-3.89064441e-04 1.01427622e-04 4.51666937e-05] [-1.52382758e-03 -1.22641331e-03 3.19584472e-04] [ 1.52382758e-03 1.22641330e-03 3.19584467e-04] [ 3.34567113e-03 -1.20199107e-05 -2.59915702e-04] [-3.34567113e-03 1.20199156e-05 -2.59915717e-04] [-2.52993788e-03 -3.61658438e-03 -9.58418391e-04] [ 2.52993787e-03 3.61658432e-03 -9.58418372e-04] [-1.05571781e-03 -1.74984379e-03 5.82741912e-04] [ 1.05571781e-03 1.74984382e-03 5.82741951e-04] [-1.10884749e-03 -1.26069718e-03 -2.26020654e-03] [ 1.10884749e-03 1.26069718e-03 -2.26020654e-03] [ 3.43292965e-03 7.94589745e-04 5.57769482e-04] [-3.43292966e-03 -7.94589746e-04 5.57769472e-04] [-4.36892923e-05 -3.08852810e-04 -8.12399887e-04] [ 4.36892945e-05 3.08852807e-04 -8.12399893e-04] [-2.61865231e-03 -2.97580797e-04 5.46171278e-04] [ 2.61865231e-03 2.97580815e-04 5.46171275e-04] [-2.56855717e-03 2.67579127e-03 -5.58295026e-05] [ 2.56855717e-03 -2.67579127e-03 -5.58295057e-05] [ 1.45295166e-03 2.63886584e-03 5.78686489e-04] [-1.45295166e-03 -2.63886584e-03 5.78686487e-04] [-2.82864359e-04 -1.71655100e-03 4.43743134e-03] [ 2.82864383e-04 1.71655099e-03 4.43743135e-03] [-4.66609059e-04 6.25811236e-04 -1.10215435e-03] [ 4.66609054e-04 -6.25811238e-04 -1.10215435e-03] [-1.69328951e-03 -3.01532712e-03 -2.85530250e-03] [ 1.69328952e-03 3.01532712e-03 -2.85530250e-03] [ 1.44316032e-03 -6.38867278e-04 2.87099943e-03] [-1.44316032e-03 6.38867282e-04 2.87099943e-03] [-4.29379858e-03 1.81614595e-03 8.02497347e-04] [ 4.29379859e-03 -1.81614597e-03 8.02497346e-04] [ 4.54978491e-03 2.79639081e-03 -2.95581394e-03] [-4.54978490e-03 -2.79639082e-03 -2.95581395e-03] [-1.25692021e-03 -1.24782917e-03 -2.29665842e-03] [ 1.25692021e-03 1.24782916e-03 -2.29665841e-03] [ 4.42486617e-05 -1.65388426e-03 1.77984033e-03] [-4.42486674e-05 1.65388426e-03 1.77984032e-03] [ 8.80570955e-04 -1.21348707e-03 1.35752715e-03] [-8.80570958e-04 1.21348708e-03 1.35752715e-03] [-3.04165602e-03 -2.25865835e-03 -6.98009475e-04] [ 3.04165602e-03 2.25865835e-03 -6.98009468e-04] [ 2.44302209e-03 1.36215461e-03 8.74576875e-05] [-2.44302209e-03 -1.36215461e-03 8.74576901e-05] [-2.73366389e-03 4.79871407e-04 4.23465674e-05] [ 2.73366389e-03 -4.79871408e-04 4.23465680e-05] [-6.46539496e-04 -5.25417724e-04 6.70637030e-03] [ 6.46539483e-04 5.25417718e-04 6.70637031e-03] [-1.33824959e-03 1.21397831e-03 -6.05918995e-03] [ 1.33824961e-03 -1.21397832e-03 -6.05918994e-03] [ 9.63353958e-04 -5.55419160e-04 8.54220229e-04] [-9.63353968e-04 5.55419161e-04 8.54220232e-04] [ 1.00801218e-03 2.79511789e-04 5.83313433e-04] [-1.00801218e-03 -2.79511790e-04 5.83313427e-04] [ 2.13895418e-03 2.43782208e-03 -2.13370743e-03] [-2.13895419e-03 -2.43782207e-03 -2.13370744e-03] [-3.97249771e-03 1.85404197e-03 1.09249222e-03] [ 3.97249773e-03 -1.85404196e-03 1.09249222e-03] [ 1.19597917e-03 7.93468307e-04 -3.07366873e-03] [-1.19597916e-03 -7.93468308e-04 -3.07366871e-03] [ 1.16364749e-03 -3.10912272e-06 1.02328975e-03] [-1.16364749e-03 3.10912088e-06 1.02328974e-03] [ 2.79943166e-03 7.61471387e-04 -7.50512863e-04] [-2.79943166e-03 -7.61471410e-04 -7.50512872e-04] [-3.09763233e-03 -7.29206190e-05 2.78730098e-04] [ 3.09763232e-03 7.29206124e-05 2.78730106e-04] [ 1.06172300e-03 7.42577856e-04 -1.20711701e-03] [-1.06172299e-03 -7.42577853e-04 -1.20711701e-03] [-1.32727403e-03 -1.02810301e-03 1.41198549e-03] [ 1.32727403e-03 1.02810299e-03 1.41198546e-03] [ 4.82307671e-03 1.93838826e-03 -2.61832028e-05] [-4.82307673e-03 -1.93838820e-03 -2.61832114e-05] [ 3.67411416e-03 -3.90913958e-04 -3.05095770e-04] [-3.67411416e-03 3.90913956e-04 -3.05095762e-04] [-4.37013359e-03 -1.07780940e-03 5.00156796e-04] [ 4.37013359e-03 1.07780940e-03 5.00156799e-04] [ 1.33327384e-03 4.12452750e-03 3.92587698e-04] [-1.33327386e-03 -4.12452746e-03 3.92587693e-04] [ 2.10898863e-03 3.76983370e-05 7.08427004e-04] [-2.10898862e-03 -3.76983303e-05 7.08426971e-04] [-2.08040321e-03 -1.75000063e-03 2.48560703e-03] [ 2.08040321e-03 1.75000064e-03 2.48560706e-03] [-2.19944848e-03 -2.01088227e-03 -9.13542777e-04] [ 2.19944848e-03 2.01088227e-03 -9.13542801e-04] [ 2.94545405e-03 -2.42094333e-03 1.23740821e-03] [-2.94545406e-03 2.42094333e-03 1.23740823e-03]] Final stress: [-2.13975557e-05 1.40410751e-05 -3.13168657e-05 4.11118894e-15 9.83339028e-15 -6.27705811e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-5.30311329e-04 -1.76701778e-03 -3.81058224e-04] [ 5.30311328e-04 1.76701778e-03 -3.81058228e-04] [-6.58821848e-04 4.49346130e-04 2.14053908e-04] [ 6.58821849e-04 -4.49346135e-04 2.14053907e-04] [-1.00097639e-03 -1.93021941e-04 8.86810990e-05] [ 1.00097639e-03 1.93021939e-04 8.86811040e-05] [ 1.91164179e-03 4.92643816e-04 -9.61609078e-04] [-1.91164179e-03 -4.92643812e-04 -9.61609082e-04] [ 6.35268460e-04 1.83296834e-05 3.07415410e-04] [-6.35268459e-04 -1.83296813e-05 3.07415413e-04] [-3.07564097e-04 2.68665024e-04 -3.85937285e-04] [ 3.07564097e-04 -2.68665025e-04 -3.85937279e-04] [ 9.48603064e-05 1.18969721e-04 4.89718976e-06] [-9.48603041e-05 -1.18969721e-04 4.89718835e-06] [ 1.67630168e-03 1.42465057e-03 6.23090712e-04] [-1.67630168e-03 -1.42465056e-03 6.23090715e-04] [-1.52972120e-04 -1.90312094e-06 4.94731401e-05] [ 1.52972119e-04 1.90312037e-06 4.94731416e-05] [ 6.99060768e-04 -4.90962995e-04 7.22712956e-05] [-6.99060767e-04 4.90962992e-04 7.22712892e-05] [-1.48131538e-03 2.96556288e-05 -2.23388580e-05] [ 1.48131538e-03 -2.96556315e-05 -2.23388563e-05] [ 1.08217446e-03 -1.26534690e-03 -3.40291177e-04] [-1.08217446e-03 1.26534691e-03 -3.40291181e-04] [ 4.60016362e-04 -4.73166107e-04 -2.41013520e-05] [-4.60016364e-04 4.73166109e-04 -2.41013549e-05] [ 5.18016185e-04 -6.20903834e-04 -9.87963743e-04] [-5.18016186e-04 6.20903827e-04 -9.87963746e-04] [-1.43115530e-03 2.64552758e-04 3.24341570e-04] [ 1.43115530e-03 -2.64552758e-04 3.24341572e-04] [ 1.14098777e-05 -1.10651706e-04 -3.47761825e-04] [-1.14098774e-05 1.10651707e-04 -3.47761824e-04] [ 1.22166422e-03 -1.09775307e-04 1.91111314e-04] [-1.22166422e-03 1.09775305e-04 1.91111315e-04] [ 7.48067995e-04 -1.17117893e-03 2.47435728e-04] [-7.48067993e-04 1.17117893e-03 2.47435730e-04] [-1.03493693e-03 -1.24088176e-03 4.59543815e-05] [ 1.03493693e-03 1.24088176e-03 4.59543807e-05] [-2.87916283e-04 -2.35615339e-04 -5.20279065e-04] [ 2.87916277e-04 2.35615341e-04 -5.20279066e-04] [-1.54804198e-05 6.51754325e-04 1.80864426e-03] [ 1.54804224e-05 -6.51754327e-04 1.80864426e-03] [ 6.26066469e-04 3.40955394e-04 1.20188699e-03] [-6.26066467e-04 -3.40955394e-04 1.20188699e-03] [-6.97344769e-04 1.23220746e-03 -1.35069481e-03] [ 6.97344768e-04 -1.23220746e-03 -1.35069481e-03] [ 1.77283009e-03 -1.15461418e-03 -1.31132441e-03] [-1.77283009e-03 1.15461417e-03 -1.31132440e-03] [-1.75802943e-03 -7.87062616e-04 4.59879586e-04] [ 1.75802942e-03 7.87062615e-04 4.59879586e-04] [ 3.93846396e-05 6.48434660e-04 7.40853844e-04] [-3.93846434e-05 -6.48434665e-04 7.40853847e-04] [-4.14853517e-04 5.72186400e-04 -1.05206960e-03] [ 4.14853517e-04 -5.72186399e-04 -1.05206960e-03] [-1.41692147e-03 8.70319821e-04 -3.78372890e-04] [ 1.41692147e-03 -8.70319818e-04 -3.78372890e-04] [ 4.04741697e-04 6.39814513e-04 5.06669677e-04] [-4.04741697e-04 -6.39814511e-04 5.06669680e-04] [-1.27960540e-03 -2.60829139e-04 3.32923921e-05] [ 1.27960540e-03 2.60829138e-04 3.32923929e-05] [ 1.16715602e-03 -6.46172610e-04 5.50698608e-05] [-1.16715602e-03 6.46172610e-04 5.50698623e-05] [-5.81298088e-04 -6.49323530e-04 -2.53566062e-03] [ 5.81298091e-04 6.49323531e-04 -2.53566062e-03] [-1.85841250e-04 -1.30190024e-05 2.76505360e-03] [ 1.85841243e-04 1.30190031e-05 2.76505360e-03] [ 3.01852104e-04 -1.51357093e-04 2.05360652e-04] [-3.01852106e-04 1.51357094e-04 2.05360656e-04] [ 4.60649364e-04 2.14790947e-04 3.99061653e-04] [-4.60649363e-04 -2.14790948e-04 3.99061648e-04] [-1.78623795e-03 -8.00412504e-04 5.82546022e-04] [ 1.78623795e-03 8.00412509e-04 5.82546019e-04] [ 1.04286641e-03 -1.00928255e-03 -9.63610836e-04] [-1.04286641e-03 1.00928255e-03 -9.63610830e-04] [ 4.73570352e-04 -4.82265862e-05 5.25362478e-04] [-4.73570352e-04 4.82265845e-05 5.25362479e-04] [ 4.56993305e-04 -3.85548614e-04 -1.28992229e-03] [-4.56993303e-04 3.85548615e-04 -1.28992229e-03] [-1.17954875e-03 2.36239974e-04 -3.26422936e-04] [ 1.17954874e-03 -2.36239979e-04 -3.26422942e-04] [ 1.23350951e-03 -2.82626381e-05 9.68574257e-05] [-1.23350952e-03 2.82626425e-05 9.68574240e-05] [-4.84735899e-04 3.28800516e-04 -4.98527580e-04] [ 4.84735902e-04 -3.28800512e-04 -4.98527581e-04] [ 5.36382408e-04 -3.04673723e-04 4.93112203e-04] [-5.36382412e-04 3.04673721e-04 4.93112197e-04] [-1.79992519e-03 9.56978270e-04 3.28057493e-05] [ 1.79992519e-03 -9.56978269e-04 3.28057492e-05] [-1.50519930e-03 -1.44735719e-04 -1.36401780e-04] [ 1.50519930e-03 1.44735721e-04 -1.36401780e-04] [ 2.00493332e-03 -4.87980118e-04 2.12540783e-04] [-2.00493332e-03 4.87980116e-04 2.12540785e-04] [-5.24670788e-04 1.43969728e-03 1.38276661e-04] [ 5.24670792e-04 -1.43969729e-03 1.38276662e-04] [-8.83769539e-04 7.39845467e-04 9.30535462e-04] [ 8.83769539e-04 -7.39845471e-04 9.30535462e-04] [ 9.06174486e-04 2.93231986e-05 1.40406946e-04] [-9.06174487e-04 -2.93232026e-05 1.40406946e-04] [ 1.26751952e-03 9.92111813e-04 6.05179749e-04] [-1.26751952e-03 -9.92111816e-04 6.05179753e-04] [-1.07013158e-03 9.58018976e-04 -2.87773370e-04] [ 1.07013158e-03 -9.58018979e-04 -2.87773372e-04]] Final stress: [-6.99347041e-06 2.96574669e-06 -1.61478509e-05 -8.36579144e-16 3.54231512e-15 2.84136817e-05] Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 4 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 20 steps. Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.29933605e-03 1.26343737e-04 -2.54413004e-04] [-1.29933605e-03 -1.26343664e-04 -2.54413022e-04] [ 1.17196057e-03 4.64606330e-04 4.94706403e-04] [-1.17196057e-03 -4.64606338e-04 4.94706415e-04] [ 1.87273340e-03 -2.96864141e-03 1.04776245e-03] [-1.87273340e-03 2.96864141e-03 1.04776245e-03] [-1.82702037e-03 1.17725459e-04 1.11418823e-03] [ 1.82702038e-03 -1.17725482e-04 1.11418819e-03] [ 4.05387823e-04 -2.21441404e-03 1.60204194e-03] [-4.05387816e-04 2.21441404e-03 1.60204194e-03] [ 3.21457535e-04 2.40196291e-03 -1.06990595e-03] [-3.21457534e-04 -2.40196292e-03 -1.06990595e-03] [-1.69167116e-03 -9.30169802e-04 -3.20415022e-05] [ 1.69167117e-03 9.30169794e-04 -3.20414946e-05] [-5.08462751e-03 1.85396765e-03 -9.53669229e-04] [ 5.08462751e-03 -1.85396766e-03 -9.53669243e-04] [ 4.56454529e-04 -9.40064379e-04 1.31296726e-03] [-4.56454525e-04 9.40064373e-04 1.31296725e-03] [ 1.03268928e-03 5.12620335e-04 5.67980537e-05] [-1.03268927e-03 -5.12620332e-04 5.67980562e-05] [ 2.75075435e-03 1.90338360e-03 -2.73440143e-03] [-2.75075436e-03 -1.90338361e-03 -2.73440144e-03] [-1.67751587e-03 -8.21461152e-04 -4.63832591e-04] [ 1.67751588e-03 8.21461158e-04 -4.63832600e-04] [-5.45788661e-04 8.19467954e-04 -4.03931448e-04] [ 5.45788653e-04 -8.19467942e-04 -4.03931426e-04] [ 4.56910238e-04 -2.67128502e-03 -2.98748494e-04] [-4.56910241e-04 2.67128502e-03 -2.98748473e-04] [ 2.00480445e-03 -1.98626709e-03 3.21189433e-03] [-2.00480444e-03 1.98626710e-03 3.21189434e-03] [ 5.27370838e-04 2.03791193e-03 -2.49478162e-03] [-5.27370837e-04 -2.03791193e-03 -2.49478163e-03] [-1.47416813e-03 -1.27484935e-03 -6.48419388e-04] [ 1.47416813e-03 1.27484932e-03 -6.48419386e-04] [-2.06903063e-03 5.19896169e-04 -1.13266100e-03] [ 2.06903064e-03 -5.19896172e-04 -1.13266100e-03] [ 7.02440167e-04 3.13563970e-03 -1.47504018e-04] [-7.02440160e-04 -3.13563970e-03 -1.47504019e-04] [ 6.58207158e-04 -9.90656698e-04 1.01517589e-03] [-6.58207173e-04 9.90656704e-04 1.01517588e-03] [-1.82072994e-03 1.49554640e-03 -1.12525125e-03] [ 1.82072994e-03 -1.49554640e-03 -1.12525124e-03] [ 9.38092090e-04 -2.47426038e-03 -1.60101650e-03] [-9.38092094e-04 2.47426037e-03 -1.60101651e-03] [ 1.94434301e-03 -1.78224021e-03 1.55684580e-03] [-1.94434300e-03 1.78224020e-03 1.55684580e-03] [-4.39962611e-04 8.73663633e-04 1.36381974e-03] [ 4.39962631e-04 -8.73663625e-04 1.36381972e-03] [-1.71894836e-04 -7.52726355e-05 1.73703379e-04] [ 1.71894824e-04 7.52726362e-05 1.73703395e-04] [-1.45257792e-04 9.50705003e-04 7.98742089e-04] [ 1.45257785e-04 -9.50705001e-04 7.98742092e-04] [-1.31701052e-03 -5.65229679e-04 1.18626563e-03] [ 1.31701051e-03 5.65229686e-04 1.18626564e-03] [ 7.54200562e-04 -4.98806288e-06 -1.58863773e-03] [-7.54200561e-04 4.98804992e-06 -1.58863772e-03] [-7.13406864e-04 -2.54050450e-03 -2.11221110e-03] [ 7.13406864e-04 2.54050450e-03 -2.11221109e-03] [ 3.80297700e-03 -1.88702251e-04 -2.13953943e-04] [-3.80297701e-03 1.88702249e-04 -2.13953948e-04] [-4.74538736e-04 -7.30611821e-04 1.24452663e-03] [ 4.74538746e-04 7.30611837e-04 1.24452662e-03] [-6.85692992e-04 2.11943120e-03 1.28061215e-03] [ 6.85692989e-04 -2.11943118e-03 1.28061216e-03] [ 4.37922700e-04 8.69519657e-04 -1.75298183e-03] [-4.37922693e-04 -8.69519644e-04 -1.75298183e-03] [ 2.60411695e-03 1.26171675e-03 3.48864999e-03] [-2.60411695e-03 -1.26171674e-03 3.48864998e-03] [ 7.06954843e-04 4.74665903e-05 -8.86681606e-04] [-7.06954846e-04 -4.74665828e-05 -8.86681606e-04] [ 2.35166683e-03 7.28800742e-04 3.30590686e-04] [-2.35166684e-03 -7.28800729e-04 3.30590684e-04] [-1.33546695e-03 1.88525895e-03 8.69009919e-04] [ 1.33546693e-03 -1.88525895e-03 8.69009920e-04] [ 1.96024576e-03 6.37462002e-04 -1.72286282e-03] [-1.96024576e-03 -6.37461991e-04 -1.72286283e-03] [ 1.52560957e-04 -1.04544291e-04 -1.22575774e-03] [-1.52560960e-04 1.04544295e-04 -1.22575772e-03] [ 2.76862678e-03 6.69060418e-04 -4.25042859e-04] [-2.76862677e-03 -6.69060417e-04 -4.25042841e-04] [ 2.44813756e-03 6.34365621e-04 2.84456703e-04] [-2.44813756e-03 -6.34365625e-04 2.84456693e-04] [ 4.61652960e-04 -4.19098080e-04 -2.23808449e-04] [-4.61652956e-04 4.19098069e-04 -2.23808444e-04] [ 1.75624733e-04 -2.72344337e-05 -5.13610811e-05] [-1.75624736e-04 2.72344380e-05 -5.13610669e-05] [-2.68224315e-03 -2.23234123e-03 1.33682138e-03] [ 2.68224314e-03 2.23234119e-03 1.33682138e-03] [-1.45932934e-03 -1.27846511e-03 -1.05411554e-03] [ 1.45932934e-03 1.27846511e-03 -1.05411554e-03] [-1.89554205e-03 8.84485861e-07 6.91087240e-04] [ 1.89554206e-03 -8.84489077e-07 6.91087209e-04] [ 9.89498926e-04 3.48864085e-04 -9.60173172e-04] [-9.89498929e-04 -3.48864076e-04 -9.60173152e-04] [-8.65417507e-04 2.81647457e-03 -5.97431506e-04] [ 8.65417512e-04 -2.81647458e-03 -5.97431489e-04] [-1.60953264e-04 -3.63555437e-04 2.78683067e-03] [ 1.60953268e-04 3.63555423e-04 2.78683064e-03] [-2.39862163e-03 -4.26022598e-04 -9.29871061e-04] [ 2.39862163e-03 4.26022594e-04 -9.29871068e-04] [ 4.71815964e-04 3.41362647e-04 -1.42028674e-04] [-4.71815975e-04 -3.41362661e-04 -1.42028666e-04]] Final stress: [-3.09320177e-05 8.27782332e-06 -9.75580567e-05 1.34750283e-14 -1.10094865e-14 -7.99006465e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.29893722e-03 1.16002837e-04 -2.22784048e-04] [ 1.29893721e-03 -1.16002817e-04 -2.22784047e-04] [-1.14728732e-03 4.72014325e-04 4.87374710e-04] [ 1.14728731e-03 -4.72014326e-04 4.87374712e-04] [-1.87296164e-03 -2.94721760e-03 1.02991241e-03] [ 1.87296164e-03 2.94721760e-03 1.02991242e-03] [ 1.79303304e-03 4.93562363e-05 1.13684049e-03] [-1.79303303e-03 -4.93562289e-05 1.13684048e-03] [-4.07340115e-04 -2.18012933e-03 1.58258490e-03] [ 4.07340121e-04 2.18012933e-03 1.58258491e-03] [-2.95237569e-04 2.38611864e-03 -1.05279773e-03] [ 2.95237569e-04 -2.38611865e-03 -1.05279772e-03] [ 1.66125595e-03 -8.97938096e-04 -6.16996043e-05] [-1.66125596e-03 8.97938097e-04 -6.16996075e-05] [ 5.00168120e-03 1.87833671e-03 -9.92478076e-04] [-5.00168119e-03 -1.87833673e-03 -9.92478068e-04] [-4.23101530e-04 -9.25159556e-04 1.28261416e-03] [ 4.23101530e-04 9.25159550e-04 1.28261416e-03] [-1.01607225e-03 4.87059735e-04 9.61912879e-05] [ 1.01607226e-03 -4.87059729e-04 9.61912831e-05] [-2.71803526e-03 1.86710278e-03 -2.70160852e-03] [ 2.71803527e-03 -1.86710278e-03 -2.70160851e-03] [ 1.67074618e-03 -8.09889264e-04 -4.76272860e-04] [-1.67074616e-03 8.09889206e-04 -4.76272848e-04] [ 5.72778955e-04 8.65424793e-04 -4.43518924e-04] [-5.72778954e-04 -8.65424781e-04 -4.43518904e-04] [-4.39925091e-04 -2.67694292e-03 -2.54576528e-04] [ 4.39925094e-04 2.67694294e-03 -2.54576506e-04] [-1.99054612e-03 -1.96802116e-03 3.19936652e-03] [ 1.99054612e-03 1.96802115e-03 3.19936652e-03] [-5.28974104e-04 2.02799419e-03 -2.49224298e-03] [ 5.28974105e-04 -2.02799418e-03 -2.49224300e-03] [ 1.44949407e-03 -1.27396241e-03 -6.49003505e-04] [-1.44949407e-03 1.27396240e-03 -6.49003506e-04] [ 6.85666799e-04 -3.11425915e-03 -1.17763848e-04] [-6.85666815e-04 3.11425916e-03 -1.17763845e-04] [-2.05120425e-03 -5.68913038e-04 -1.12860023e-03] [ 2.05120426e-03 5.68913040e-04 -1.12860024e-03] [-1.81384472e-03 -1.45936866e-03 -1.12296581e-03] [ 1.81384471e-03 1.45936864e-03 -1.12296582e-03] [ 6.65623709e-04 9.99216801e-04 1.02204742e-03] [-6.65623711e-04 -9.99216826e-04 1.02204743e-03] [ 1.93069001e-03 1.83336564e-03 1.49045081e-03] [-1.93069001e-03 -1.83336564e-03 1.49045080e-03] [ 8.90699669e-04 2.51189400e-03 -1.55200554e-03] [-8.90699659e-04 -2.51189401e-03 -1.55200555e-03] [-1.89142865e-04 8.25475121e-05 1.58576037e-04] [ 1.89142880e-04 -8.25475101e-05 1.58576045e-04] [-4.59688808e-04 -8.64569057e-04 1.37339224e-03] [ 4.59688796e-04 8.64569057e-04 1.37339224e-03] [-1.28841024e-03 5.35372463e-04 1.19474408e-03] [ 1.28841024e-03 -5.35372459e-04 1.19474409e-03] [-1.38200216e-04 -9.21127646e-04 7.71466337e-04] [ 1.38200212e-04 9.21127650e-04 7.71466335e-04] [-7.04796264e-04 2.52088503e-03 -2.14211838e-03] [ 7.04796270e-04 -2.52088504e-03 -2.14211839e-03] [ 7.47427062e-04 4.75921778e-05 -1.56979629e-03] [-7.47427064e-04 -4.75921841e-05 -1.56979629e-03] [-5.08207852e-04 7.68195621e-04 1.17475235e-03] [ 5.08207857e-04 -7.68195620e-04 1.17475235e-03] [ 3.78351736e-03 2.36577183e-04 -1.56394451e-04] [-3.78351738e-03 -2.36577172e-04 -1.56394452e-04] [ 4.46001459e-04 -8.43978565e-04 -1.76586829e-03] [-4.46001456e-04 8.43978575e-04 -1.76586828e-03] [-6.94380687e-04 -2.07754039e-03 1.27239279e-03] [ 6.94380676e-04 2.07754040e-03 1.27239277e-03] [ 6.66025989e-04 -4.20007308e-05 -9.34830209e-04] [-6.66025978e-04 4.20007326e-05 -9.34830197e-04] [ 2.62618307e-03 -1.23006760e-03 3.49593110e-03] [-2.62618308e-03 1.23006760e-03 3.49593110e-03] [-1.38047974e-03 -1.83540514e-03 8.74217863e-04] [ 1.38047974e-03 1.83540514e-03 8.74217849e-04] [ 2.34473582e-03 -6.95286431e-04 3.56584189e-04] [-2.34473583e-03 6.95286436e-04 3.56584196e-04] [ 1.60296925e-04 1.09284141e-04 -1.23431606e-03] [-1.60296920e-04 -1.09284139e-04 -1.23431605e-03] [ 1.93362068e-03 -6.59914526e-04 -1.65367014e-03] [-1.93362068e-03 6.59914533e-04 -1.65367015e-03] [-2.64984396e-03 6.66976347e-04 -4.11989866e-04] [ 2.64984396e-03 -6.66976345e-04 -4.11989876e-04] [-2.43814042e-03 6.41814968e-04 2.89445800e-04] [ 2.43814042e-03 -6.41814969e-04 2.89445790e-04] [-4.59035059e-04 -3.93856001e-04 -2.23758212e-04] [ 4.59035050e-04 3.93856015e-04 -2.23758223e-04] [-2.32268493e-04 6.81108279e-06 -5.39357998e-05] [ 2.32268491e-04 -6.81107440e-06 -5.39358241e-05] [ 2.65185389e-03 -2.21185639e-03 1.33911158e-03] [-2.65185389e-03 2.21185636e-03 1.33911158e-03] [ 1.45684075e-03 -1.27844522e-03 -1.05663633e-03] [-1.45684074e-03 1.27844522e-03 -1.05663632e-03] [ 1.90766751e-03 -2.45925540e-05 6.74691399e-04] [-1.90766751e-03 2.45925460e-05 6.74691409e-04] [-9.86627903e-04 3.53572341e-04 -9.64849197e-04] [ 9.86627901e-04 -3.53572291e-04 -9.64849198e-04] [-1.70683348e-04 3.89775935e-04 2.74117836e-03] [ 1.70683343e-04 -3.89775940e-04 2.74117836e-03] [-8.62452697e-04 -2.79502905e-03 -6.02409103e-04] [ 8.62452701e-04 2.79502903e-03 -6.02409102e-04] [ 4.42195170e-04 -3.46618402e-04 -1.09245348e-04] [-4.42195161e-04 3.46618423e-04 -1.09245349e-04] [-2.40554046e-03 4.44631892e-04 -8.95730960e-04] [ 2.40554046e-03 -4.44631886e-04 -8.95730945e-04]] Final stress: [-3.07238127e-05 8.04967791e-06 -9.66847178e-05 6.96757560e-16 -8.10294383e-16 8.03378113e-05] Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-2.00562875e-05 -8.19568396e-05 -5.90017148e-05] [ 2.00562877e-05 8.19569521e-05 -5.90017353e-05] [ 1.13116159e-04 -3.61273819e-04 9.93301207e-05] [-1.13116159e-04 3.61273819e-04 9.93301234e-05] [ 1.91346665e-04 -4.34200912e-05 -5.42362815e-05] [-1.91346666e-04 4.34200900e-05 -5.42362795e-05] [-5.49868320e-05 -2.63295467e-04 6.63702877e-04] [ 5.49868322e-05 2.63295467e-04 6.63702865e-04] [ 9.73886814e-05 1.91446035e-05 -5.28142516e-05] [-9.73886820e-05 -1.91446057e-05 -5.28142506e-05] [ 2.53783402e-06 1.93003484e-05 -1.69490182e-04] [-2.53783418e-06 -1.93003551e-05 -1.69490190e-04] [-2.66368466e-04 4.98735009e-05 -1.12911521e-04] [ 2.66368466e-04 -4.98735035e-05 -1.12911525e-04] [-5.53257141e-04 -2.15172811e-04 -1.81641270e-04] [ 5.53257141e-04 2.15172770e-04 -1.81641282e-04] [ 4.21065178e-05 6.24140567e-05 -1.37074688e-04] [-4.21065175e-05 -6.24140609e-05 -1.37074690e-04] [ 1.40228102e-04 -2.77301903e-05 -1.88016543e-04] [-1.40228102e-04 2.77301988e-05 -1.88016550e-04] [ 1.87817070e-04 1.89922977e-04 6.66694732e-05] [-1.87817069e-04 -1.89922979e-04 6.66694680e-05] [-1.89765654e-04 9.96344407e-06 3.82169521e-05] [ 1.89765655e-04 -9.96347150e-06 3.82169569e-05] [-1.60720110e-04 -2.32377069e-04 5.13476594e-05] [ 1.60720111e-04 2.32377083e-04 5.13476887e-05] [ 1.36971915e-04 1.81342567e-04 2.18249668e-04] [-1.36971914e-04 -1.81342555e-04 2.18249684e-04] [ 1.26644265e-04 -1.25266143e-04 4.41765224e-04] [-1.26644265e-04 1.25266146e-04 4.41765230e-04] [ 2.56113442e-04 -4.10762114e-05 -1.29834403e-04] [-2.56113441e-04 4.10762110e-05 -1.29834408e-04] [-5.92595316e-05 2.05741945e-04 -1.33096222e-04] [ 5.92595317e-05 -2.05741961e-04 -1.33096216e-04] [-1.04079055e-05 -9.86162940e-06 5.33461365e-05] [ 1.04079037e-05 9.86162514e-06 5.33461389e-05] [ 2.50770728e-04 2.59854004e-04 7.81773154e-05] [-2.50770727e-04 -2.59854009e-04 7.81773126e-05] [ 1.12769516e-04 4.15882676e-05 -4.32431315e-05] [-1.12769512e-04 -4.15882761e-05 -4.32431428e-05] [-2.49400220e-05 2.37538552e-04 9.72630303e-05] [ 2.49400206e-05 -2.37538559e-04 9.72630405e-05] [-8.16659688e-06 -5.02009055e-04 -2.27482097e-04] [ 8.16659547e-06 5.02009052e-04 -2.27482099e-04] [ 1.26668093e-04 1.01095354e-04 1.55626125e-04] [-1.26668092e-04 -1.01095358e-04 1.55626127e-04] [-2.48435989e-04 -1.28559162e-04 -7.07028184e-05] [ 2.48436000e-04 1.28559172e-04 -7.07028270e-05] [ 7.24714369e-05 8.83784310e-06 4.28303912e-05] [-7.24714470e-05 -8.83783233e-06 4.28304022e-05] [ 2.66715624e-04 2.32053400e-04 3.81112724e-06] [-2.66715626e-04 -2.32053400e-04 3.81113154e-06] [-9.70346199e-05 -7.67615279e-05 -2.35799790e-04] [ 9.70346224e-05 7.67615287e-05 -2.35799794e-04] [ 4.64009409e-04 -7.21496570e-05 7.78073767e-05] [-4.64009405e-04 7.21496595e-05 7.78073754e-05] [ 3.21869946e-04 -1.10936294e-04 -1.95474254e-05] [-3.21869951e-04 1.10936293e-04 -1.95474257e-05] [ 2.37331507e-04 5.44818933e-05 -2.65730913e-05] [-2.37331507e-04 -5.44818919e-05 -2.65730917e-05] [-1.99280873e-04 -1.29452381e-04 2.13541634e-04] [ 1.99280873e-04 1.29452383e-04 2.13541634e-04] [-4.38197022e-04 2.26455036e-04 3.41701002e-04] [ 4.38197027e-04 -2.26455018e-04 3.41701015e-04] [ 2.10252910e-04 9.92074725e-05 5.74526821e-05] [-2.10252919e-04 -9.92074533e-05 5.74526670e-05] [ 2.76318742e-04 2.27654813e-04 1.42864333e-04] [-2.76318743e-04 -2.27654813e-04 1.42864341e-04] [-2.76901381e-04 -1.49333861e-04 -3.80615871e-04] [ 2.76901380e-04 1.49333861e-04 -3.80615879e-04] [ 3.62506328e-04 -1.61364689e-04 5.55658253e-05] [-3.62506337e-04 1.61364707e-04 5.55658208e-05] [-4.17410404e-05 9.59058173e-06 8.52204945e-05] [ 4.17410502e-05 -9.59056308e-06 8.52204989e-05] [-1.22590619e-04 3.89880284e-05 3.76816058e-05] [ 1.22590625e-04 -3.89880270e-05 3.76816086e-05] [-3.47664824e-04 5.44699905e-05 -6.57450177e-05] [ 3.47664818e-04 -5.44699888e-05 -6.57450198e-05] [ 1.65489123e-04 2.23986593e-05 1.88155756e-04] [-1.65489123e-04 -2.23986750e-05 1.88155743e-04] [ 4.10205416e-04 3.70995675e-04 9.60049614e-05] [-4.10205417e-04 -3.70995676e-04 9.60049594e-05] [ 1.99589261e-05 5.04892756e-05 2.29037430e-04] [-1.99589255e-05 -5.04892736e-05 2.29037428e-04] [ 1.73645554e-04 2.83961464e-04 -5.74787302e-04] [-1.73645554e-04 -2.83961466e-04 -5.74787305e-04] [ 1.14937137e-04 1.89878783e-04 3.91585388e-05] [-1.14937135e-04 -1.89878869e-04 3.91585442e-05] [-4.42753734e-04 -3.10601108e-04 6.95238253e-05] [ 4.42753734e-04 3.10601106e-04 6.95238253e-05] [-1.14732817e-04 1.78930600e-04 -2.29417311e-04] [ 1.14732817e-04 -1.78930596e-04 -2.29417313e-04] [ 2.52465989e-04 -4.94753011e-06 2.83664515e-05] [-2.52465990e-04 4.94755142e-06 2.83664526e-05] [-4.57857916e-05 2.78743336e-04 -2.73130142e-04] [ 4.57858016e-05 -2.78743355e-04 -2.73130130e-04] [ 1.88613579e-04 -7.66315705e-05 6.88324925e-06] [-1.88613590e-04 7.66315500e-05 6.88323660e-06] [ 7.71761003e-05 1.00529134e-04 -3.11594322e-04] [-7.71761022e-05 -1.00529134e-04 -3.11594336e-04] [ 1.39893388e-04 9.33907468e-05 -2.54585770e-06] [-1.39893388e-04 -9.33907461e-05 -2.54584457e-06]] Final stress: [ 4.08447574e-06 7.27507861e-06 -1.07197941e-05 5.64446516e-15 -8.34180962e-16 -9.14085586e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 6.48683412e-05 -8.46937048e-05 -7.25473591e-05] [-6.48683387e-05 8.46938408e-05 -7.25473836e-05] [-8.22944404e-05 -3.13847904e-04 1.07693267e-04] [ 8.22944425e-05 3.13847926e-04 1.07693263e-04] [-1.58194688e-04 -3.59077446e-05 -8.54094374e-05] [ 1.58194688e-04 3.59077522e-05 -8.54094264e-05] [ 5.00933638e-06 -3.79145780e-04 7.47958463e-04] [-5.00933714e-06 3.79145766e-04 7.47958420e-04] [-9.50488402e-05 6.83762711e-05 -9.03830435e-05] [ 9.50488405e-05 -6.83762664e-05 -9.03830382e-05] [-2.21555507e-06 2.22184908e-05 -1.37445140e-04] [ 2.21555542e-06 -2.22184969e-05 -1.37445151e-04] [ 2.41370762e-04 3.94975070e-05 -1.38596975e-04] [-2.41370759e-04 -3.94975186e-05 -1.38596975e-04] [ 4.28547235e-04 -3.82303807e-04 -1.87693817e-04] [-4.28547237e-04 3.82303755e-04 -1.87693850e-04] [-3.98752760e-05 1.20524168e-04 -2.05382020e-04] [ 3.98752778e-05 -1.20524168e-04 -2.05382021e-04] [-9.51189535e-05 2.97029178e-05 -2.10212007e-04] [ 9.51189527e-05 -2.97029090e-05 -2.10212010e-04] [-1.24978730e-04 1.28319651e-04 6.82754628e-05] [ 1.24978732e-04 -1.28319651e-04 6.82754572e-05] [ 1.89678294e-04 -1.55226423e-05 6.93201667e-05] [-1.89678296e-04 1.55224655e-05 6.93202025e-05] [ 1.61785865e-04 -2.44036689e-04 1.15322960e-04] [-1.61785866e-04 2.44036704e-04 1.15323009e-04] [-1.33353342e-04 3.35721345e-04 2.72623337e-04] [ 1.33353345e-04 -3.35721289e-04 2.72623375e-04] [-6.82013399e-05 -1.17516639e-04 4.04753477e-04] [ 6.82013395e-05 1.17516643e-04 4.04753490e-04] [-2.84535009e-04 -1.44412874e-05 -1.00933428e-04] [ 2.84535010e-04 1.44412835e-05 -1.00933442e-04] [ 3.05115940e-05 1.87478334e-04 -1.25928804e-04] [-3.05115946e-05 -1.87478348e-04 -1.25928807e-04] [ 1.79991060e-04 -2.02078566e-04 6.93131111e-05] [-1.79991065e-04 2.02078561e-04 6.93131100e-05] [-1.15651156e-05 4.11572392e-05 4.09351688e-05] [ 1.15651205e-05 -4.11572433e-05 4.09351699e-05] [ 3.59976007e-05 -2.11241619e-04 1.45417222e-04] [-3.59975864e-05 2.11241586e-04 1.45417193e-04] [ 8.92094261e-05 -7.08081019e-05 -8.68361326e-05] [-8.92094439e-05 7.08080648e-05 -8.68360958e-05] [ 1.10184905e-04 -1.05577876e-04 1.46505056e-04] [-1.10184906e-04 1.05577870e-04 1.46505055e-04] [-4.39908099e-05 4.58631521e-04 -1.81731291e-04] [ 4.39908105e-05 -4.58631527e-04 -1.81731289e-04] [ 6.64170486e-05 -8.31545182e-06 4.10332348e-05] [-6.64170281e-05 8.31544412e-06 4.10332385e-05] [-3.13582516e-04 1.39539454e-04 -1.24550668e-04] [ 3.13582486e-04 -1.39539460e-04 -1.24550675e-04] [-1.42500990e-04 2.23472811e-05 -2.39543824e-04] [ 1.42500987e-04 -2.23472756e-05 -2.39543823e-04] [ 2.24780221e-04 -2.08648390e-04 7.94099668e-06] [-2.24780215e-04 2.08648396e-04 7.94099503e-06] [ 3.25906757e-04 6.68012441e-05 4.65832311e-07] [-3.25906772e-04 -6.68012738e-05 4.65840467e-07] [ 4.56315237e-04 1.50143706e-05 1.00370838e-04] [-4.56315245e-04 -1.50143846e-05 1.00370840e-04] [-1.69313770e-04 1.18854415e-04 1.77041744e-04] [ 1.69313770e-04 -1.18854408e-04 1.77041746e-04] [ 2.05207380e-04 -6.76874664e-05 -4.13751309e-06] [-2.05207379e-04 6.76874736e-05 -4.13751374e-06] [ 2.25219903e-04 -1.25733334e-04 6.61573152e-05] [-2.25219891e-04 1.25733361e-04 6.61573426e-05] [-4.92875150e-04 -1.30978136e-04 3.57145678e-04] [ 4.92875144e-04 1.30978160e-04 3.57145656e-04] [-3.74738070e-04 1.70816483e-04 -3.38826330e-04] [ 3.74738075e-04 -1.70816481e-04 -3.38826325e-04] [ 2.34021422e-04 -2.05855550e-04 8.89395153e-05] [-2.34021428e-04 2.05855548e-04 8.89395070e-05] [-7.60536439e-05 6.27666596e-05 1.17352092e-04] [ 7.60536429e-05 -6.27666448e-05 1.17352091e-04] [ 3.37504639e-04 2.36497057e-04 7.64896397e-05] [-3.37504631e-04 -2.36497034e-04 7.64896459e-05] [-3.77313220e-04 -1.01965082e-04 -3.72392881e-05] [ 3.77313224e-04 1.01965083e-04 -3.72392979e-05] [-2.05159005e-04 6.88903847e-06 7.09480662e-05] [ 2.05159000e-04 -6.88904193e-06 7.09480711e-05] [-8.55357349e-05 2.25018357e-05 1.92338633e-04] [ 8.55357317e-05 -2.25018486e-05 1.92338624e-04] [-3.49108126e-04 2.97216157e-04 1.11450283e-04] [ 3.49108126e-04 -2.97216155e-04 1.11450282e-04] [ 5.89425179e-06 -3.93402454e-06 2.35116415e-04] [-5.89425154e-06 3.93402494e-06 2.35116418e-04] [-1.76550702e-04 3.17650261e-04 -5.97317890e-04] [ 1.76550714e-04 -3.17650243e-04 -5.97317876e-04] [-2.34472367e-04 3.38647275e-04 2.79041981e-05] [ 2.34472365e-04 -3.38647375e-04 2.79042026e-05] [ 4.29710706e-04 -2.32800514e-04 5.42695850e-05] [-4.29710706e-04 2.32800513e-04 5.42695894e-05] [ 9.20464252e-05 1.93725969e-04 -2.19390332e-04] [-9.20464247e-05 -1.93725964e-04 -2.19390334e-04] [-2.84097497e-04 -6.10433232e-05 2.45133306e-05] [ 2.84097504e-04 6.10434664e-05 2.45133279e-05] [ 1.60466080e-04 9.51790826e-05 -8.49999414e-05] [-1.60466072e-04 -9.51790996e-05 -8.49999144e-05] [-7.22846057e-05 -1.98344405e-04 -2.74367624e-04] [ 7.22845961e-05 1.98344383e-04 -2.74367646e-04] [ 1.08332806e-04 -7.55143282e-05 -3.37725004e-05] [-1.08332795e-04 7.55143571e-05 -3.37725315e-05] [ 1.25750103e-04 -1.40812823e-04 -3.60349748e-04] [-1.25750111e-04 1.40812843e-04 -3.60349708e-04]] Final stress: [ 4.35497132e-06 7.13404287e-06 -9.26117232e-06 1.17096061e-14 2.16791442e-15 8.30552721e-06] Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.26582916e-03 9.42264902e-04 -9.04583640e-05] [ 1.26582919e-03 -9.42264597e-04 -9.04584633e-05] [ 1.15572376e-04 -1.29192479e-03 -1.25325433e-03] [-1.15572355e-04 1.29192464e-03 -1.25325424e-03] [ 2.16168697e-03 2.51878880e-03 3.86846467e-04] [-2.16168696e-03 -2.51878883e-03 3.86846438e-04] [-4.64263258e-04 2.74348739e-03 -4.70525699e-03] [ 4.64263267e-04 -2.74348756e-03 -4.70525710e-03] [ 1.15466319e-03 5.06647727e-04 1.77756124e-03] [-1.15466319e-03 -5.06647702e-04 1.77756123e-03] [-6.05838018e-04 -9.17798860e-04 1.62790781e-03] [ 6.05838023e-04 9.17798849e-04 1.62790779e-03] [-2.51344671e-03 -1.15677130e-03 8.30053295e-04] [ 2.51344673e-03 1.15677143e-03 8.30053480e-04] [-6.10179508e-03 3.66351046e-03 1.87298335e-05] [ 6.10179510e-03 -3.66351039e-03 1.87297861e-05] [ 2.67274594e-03 -1.30104179e-03 1.89392027e-03] [-2.67274591e-03 1.30104185e-03 1.89392032e-03] [ 6.88129907e-04 7.96884304e-04 1.64932366e-03] [-6.88129891e-04 -7.96884257e-04 1.64932373e-03] [ 5.22834426e-04 3.55146920e-05 2.83949180e-04] [-5.22834427e-04 -3.55147264e-05 2.83949298e-04] [-3.47863063e-03 -2.11097476e-04 -8.07742410e-04] [ 3.47863060e-03 2.11098409e-04 -8.07742680e-04] [-8.24220769e-04 1.99052099e-03 -3.53390157e-03] [ 8.24220764e-04 -1.99052149e-03 -3.53390229e-03] [ 2.45353470e-03 -1.49515236e-03 -5.36532637e-04] [-2.45353468e-03 1.49515217e-03 -5.36532930e-04] [ 5.74113282e-04 3.06016816e-03 -5.93115163e-03] [-5.74113228e-04 -3.06016815e-03 -5.93115161e-03] [ 3.93207563e-03 -2.64936808e-03 1.25220368e-03] [-3.93207561e-03 2.64936808e-03 1.25220379e-03] [ 1.64022907e-03 -3.06597686e-07 7.02894669e-04] [-1.64022908e-03 3.06517286e-07 7.02894743e-04] [ 1.00350740e-03 8.79387135e-04 -2.08115733e-03] [-1.00350740e-03 -8.79387103e-04 -2.08115740e-03] [ 7.21106408e-05 -1.46076396e-03 -7.98603550e-04] [-7.21106506e-05 1.46076399e-03 -7.98603504e-04] [-1.60915252e-03 2.94999278e-03 -3.03951025e-03] [ 1.60915234e-03 -2.94999257e-03 -3.03951009e-03] [-1.61433800e-05 -6.69700991e-05 9.58128187e-04] [ 1.61434845e-05 6.69702533e-05 9.58128098e-04] [-1.22740052e-03 1.78150925e-04 9.42315960e-04] [ 1.22740049e-03 -1.78150951e-04 9.42315961e-04] [ 3.40502847e-04 -4.76472593e-03 2.53862236e-03] [-3.40502840e-04 4.76472591e-03 2.53862236e-03] [-2.59354472e-03 -6.49891223e-04 -3.49264154e-03] [ 2.59354466e-03 6.49891352e-04 -3.49264170e-03] [ 3.64301560e-03 -2.28437464e-03 4.24223040e-03] [-3.64301559e-03 2.28437480e-03 4.24223052e-03] [ 2.15747485e-03 2.43377363e-03 3.48059008e-03] [-2.15747484e-03 -2.43377368e-03 3.48059005e-03] [-2.02562776e-03 1.51723330e-03 -8.84768436e-05] [ 2.02562774e-03 -1.51723331e-03 -8.84768050e-05] [-1.48854322e-03 1.01437040e-03 1.77703859e-03] [ 1.48854304e-03 -1.01437048e-03 1.77703870e-03] [-6.97678517e-04 -7.27354095e-04 4.73518773e-04] [ 6.97678519e-04 7.27354115e-04 4.73518744e-04] [ 1.12850702e-03 -3.25221775e-03 -2.99527663e-03] [-1.12850702e-03 3.25221771e-03 -2.99527660e-03] [-2.34733279e-03 4.95997404e-04 -8.21627361e-04] [ 2.34733279e-03 -4.95997432e-04 -8.21627386e-04] [-3.96920887e-03 8.03935252e-04 -6.07164069e-04] [ 3.96920907e-03 -8.03935142e-04 -6.07163997e-04] [ 5.66174584e-03 4.28792869e-04 -1.60877262e-03] [-5.66174598e-03 -4.28792791e-04 -1.60877266e-03] [ 6.42521946e-03 -3.30846664e-03 1.94004312e-03] [-6.42521942e-03 3.30846664e-03 1.94004298e-03] [-3.45572431e-03 1.40097707e-03 -1.16471675e-03] [ 3.45572428e-03 -1.40097706e-03 -1.16471664e-03] [ 7.78431071e-04 -2.56204213e-03 1.04755146e-03] [-7.78431065e-04 2.56204201e-03 1.04755148e-03] [ 2.24751713e-04 -2.45623684e-03 -4.17328055e-03] [-2.24751783e-04 2.45623670e-03 -4.17328057e-03] [ 3.76672312e-03 9.04924676e-04 2.02081700e-03] [-3.76672318e-03 -9.04924678e-04 2.02081694e-03] [ 1.67462858e-03 -8.33873520e-04 -1.33010004e-04] [-1.67462857e-03 8.33873501e-04 -1.33009994e-04] [ 4.42294034e-03 -1.80259609e-03 4.20129532e-04] [-4.42294033e-03 1.80259637e-03 4.20129742e-04] [ 3.80694930e-03 -1.07382244e-03 -1.18636893e-03] [-3.80694929e-03 1.07382246e-03 -1.18636899e-03] [-1.22894694e-03 -1.46916064e-03 -1.83888040e-03] [ 1.22894696e-03 1.46916060e-03 -1.83888040e-03] [ 2.83369240e-03 -8.41653680e-04 2.89743926e-03] [-2.83369231e-03 8.41653761e-04 2.89743931e-03] [ 3.38905672e-03 -4.07319290e-03 -1.72725290e-03] [-3.38905675e-03 4.07319258e-03 -1.72725290e-03] [-5.59012130e-03 7.01767107e-04 -5.92188254e-04] [ 5.59012131e-03 -7.01767075e-04 -5.92188288e-04] [ 9.11852064e-04 -8.13184452e-04 7.80448998e-04] [-9.11852063e-04 8.13184423e-04 7.80449008e-04] [ 4.41008806e-03 -8.40778124e-04 5.44447920e-04] [-4.41008798e-03 8.40777381e-04 5.44447941e-04] [-4.13797802e-03 4.81472949e-04 1.20891293e-03] [ 4.13797798e-03 -4.81472948e-04 1.20891306e-03] [ 1.46926747e-03 3.68566769e-03 2.42671175e-03] [-1.46926747e-03 -3.68566768e-03 2.42671163e-03] [-1.24519033e-03 3.25388070e-03 5.87249476e-04] [ 1.24519039e-03 -3.25388071e-03 5.87249958e-04] [-3.20317142e-03 2.04178011e-03 4.49764029e-03] [ 3.20317138e-03 -2.04178019e-03 4.49763985e-03]] Final stress: [ 5.37441925e-06 -2.18109223e-05 1.86517936e-04 -1.50364106e-13 -5.99941035e-16 -1.49313501e-04] Minimization converged after 18 steps. Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.87843571e-05 4.58740413e-05 2.05458130e-04] [-2.87843575e-05 -4.58740363e-05 2.05458132e-04] [ 1.18314595e-04 1.92990513e-04 -2.63286097e-04] [-1.18314596e-04 -1.92990509e-04 -2.63286096e-04] [-6.04827888e-05 -3.32221310e-04 2.60006263e-04] [ 6.04827895e-05 3.32221308e-04 2.60006266e-04] [ 1.99210866e-04 4.09284329e-04 -2.90087117e-04] [-1.99210864e-04 -4.09284305e-04 -2.90087093e-04] [-2.73664383e-05 2.26066449e-04 1.06109826e-04] [ 2.73664383e-05 -2.26066452e-04 1.06109825e-04] [ 1.42785395e-04 1.12344206e-04 -1.65973142e-04] [-1.42785395e-04 -1.12344209e-04 -1.65973140e-04] [-4.04006807e-05 1.86160762e-04 1.16500734e-04] [ 4.04006818e-05 -1.86160768e-04 1.16500723e-04] [ 4.51790960e-04 -4.81904789e-04 1.80265281e-04] [-4.51790959e-04 4.81904776e-04 1.80265291e-04] [-2.87385716e-04 -2.06106441e-04 1.67234838e-04] [ 2.87385717e-04 2.06106434e-04 1.67234834e-04] [-2.03776782e-04 -6.40507613e-05 -8.83135048e-06] [ 2.03776782e-04 6.40507585e-05 -8.83136085e-06] [-2.39327882e-04 6.45320156e-05 3.10765036e-05] [ 2.39327881e-04 -6.45320175e-05 3.10764999e-05] [ 1.93963498e-04 1.77385257e-04 -1.33018280e-04] [-1.93963497e-04 -1.77385273e-04 -1.33018273e-04] [-3.70261469e-04 9.66044937e-05 -3.54454944e-04] [ 3.70261468e-04 -9.66044671e-05 -3.54454913e-04] [-3.85963995e-06 5.68437428e-04 -4.28700746e-04] [ 3.85964020e-06 -5.68437429e-04 -4.28700733e-04] [-3.31368219e-05 -4.05560883e-04 4.84688947e-04] [ 3.31368237e-05 4.05560884e-04 4.84688945e-04] [ 1.03038364e-04 3.84425986e-04 -1.70017976e-04] [-1.03038366e-04 -3.84425985e-04 -1.70017980e-04] [-2.80146612e-04 -2.14010632e-04 3.72167663e-04] [ 2.80146611e-04 2.14010632e-04 3.72167661e-04] [-4.88420613e-04 1.56098795e-04 1.10704301e-05] [ 4.88420614e-04 -1.56098797e-04 1.10704360e-05] [-3.44558935e-05 1.32166871e-04 1.17375570e-04] [ 3.44558934e-05 -1.32166874e-04 1.17375563e-04] [ 1.34648098e-04 1.50635502e-04 -2.09048940e-04] [-1.34648094e-04 -1.50635506e-04 -2.09048945e-04] [-1.68923225e-04 3.82794202e-05 -1.02362159e-04] [ 1.68923217e-04 -3.82794255e-05 -1.02362151e-04] [-2.53561481e-04 1.12563263e-04 -3.56089312e-04] [ 2.53561484e-04 -1.12563261e-04 -3.56089314e-04] [ 2.21617964e-05 2.38338474e-04 -3.73265240e-05] [-2.21617992e-05 -2.38338473e-04 -3.73265224e-05] [-1.03923655e-04 1.44058963e-04 3.90889322e-04] [ 1.03923658e-04 -1.44058963e-04 3.90889325e-04] [ 1.91207835e-04 9.69999730e-05 -3.97133569e-04] [-1.91207836e-04 -9.69999728e-05 -3.97133575e-04] [-2.78412556e-04 -4.64186618e-05 -9.11656544e-05] [ 2.78412556e-04 4.64186598e-05 -9.11656521e-05] [-6.29042340e-05 2.28518903e-05 1.25332097e-04] [ 6.29042346e-05 -2.28518929e-05 1.25332092e-04] [-2.28267855e-04 3.01588861e-04 -1.34609353e-04] [ 2.28267862e-04 -3.01588846e-04 -1.34609359e-04] [-1.93827173e-04 -3.32282295e-05 6.23550909e-05] [ 1.93827163e-04 3.32282428e-05 6.23550965e-05] [-2.26354845e-04 3.24775475e-04 4.15307708e-04] [ 2.26354845e-04 -3.24775473e-04 4.15307705e-04] [ 1.13738148e-04 1.44219210e-04 1.50847237e-04] [-1.13738148e-04 -1.44219210e-04 1.50847240e-04] [-5.20757641e-05 -1.18626660e-04 5.48689586e-04] [ 5.20757610e-05 1.18626659e-04 5.48689585e-04] [ 7.79973916e-04 1.05292632e-04 -2.07758713e-04] [-7.79973907e-04 -1.05292635e-04 -2.07758710e-04] [-3.22368245e-04 4.98598950e-04 1.02031466e-05] [ 3.22368243e-04 -4.98598952e-04 1.02031564e-05] [-1.68804722e-04 -2.16868431e-04 -2.78670187e-05] [ 1.68804726e-04 2.16868431e-04 -2.78670287e-05] [-2.91999114e-04 6.54469495e-04 -6.03449344e-04] [ 2.91999101e-04 -6.54469477e-04 -6.03449350e-04] [ 9.12035853e-06 5.19141474e-04 3.37900484e-04] [-9.12035531e-06 -5.19141462e-04 3.37900489e-04] [-5.71798214e-04 -1.76242425e-04 -4.74434839e-04] [ 5.71798219e-04 1.76242426e-04 -4.74434830e-04] [-1.14908881e-04 4.33154662e-04 -4.21342140e-04] [ 1.14908876e-04 -4.33154660e-04 -4.21342151e-04] [-5.19572669e-04 -5.53727998e-05 -2.26697593e-05] [ 5.19572673e-04 5.53727834e-05 -2.26697730e-05] [-9.16696315e-05 -1.61258415e-04 2.84562609e-05] [ 9.16696323e-05 1.61258413e-04 2.84562607e-05] [ 1.05288949e-04 1.25229756e-04 1.28603521e-04] [-1.05288950e-04 -1.25229755e-04 1.28603519e-04] [-1.37323143e-04 -2.62350009e-04 -3.54598669e-05] [ 1.37323144e-04 2.62349991e-04 -3.54598849e-05] [ 4.27874821e-04 2.47713535e-04 9.82411703e-05] [-4.27874826e-04 -2.47713536e-04 9.82411704e-05] [-1.29230872e-04 -3.43079217e-05 5.77459989e-05] [ 1.29230871e-04 3.43079190e-05 5.77460006e-05] [-2.24067095e-04 1.58031247e-04 1.62712634e-04] [ 2.24067094e-04 -1.58031243e-04 1.62712633e-04] [ 4.22447958e-04 -5.74339307e-04 -8.05846580e-06] [-4.22447954e-04 5.74339321e-04 -8.05846545e-06] [ 4.25292610e-04 -6.92813688e-05 -8.69743623e-05] [-4.25292606e-04 6.92813600e-05 -8.69743745e-05] [-1.21277669e-04 -1.70283062e-05 9.90825268e-05] [ 1.21277663e-04 1.70283013e-05 9.90825413e-05] [ 3.27868727e-04 6.61761661e-06 1.72920566e-04] [-3.27868731e-04 -6.61762195e-06 1.72920549e-04] [ 6.51816879e-05 -1.72674636e-04 1.88878126e-04] [-6.51816809e-05 1.72674632e-04 1.88878146e-04]] Final stress: [-5.37056354e-06 -5.12348945e-06 -2.26542372e-05 2.27193160e-15 3.95108146e-15 1.71635273e-05] Minimization converged after 15 steps. Minimization converged after 13 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.43758016e-05 2.28593867e-04 5.36631710e-05] [-5.43962823e-05 -5.85617917e-04 1.85226041e-05] [ 1.00556824e-04 -1.52208265e-04 4.63084026e-05] [-1.00984666e-04 -1.75475645e-04 -1.00053133e-05] [ 1.49307990e-04 -1.66441099e-04 -2.30409685e-04] [-1.50352471e-04 -6.49933240e-05 1.85339899e-04] [-6.47923732e-05 7.22518750e-05 1.04099823e-04] [ 6.44593131e-05 1.92148684e-04 2.23459005e-04] [ 6.24195664e-05 1.18946367e-04 1.23182928e-04] [-6.26176143e-05 2.04334684e-04 -3.63121684e-04] [ 1.07284182e-04 4.82930580e-05 3.21649763e-05] [-1.07059393e-04 5.83963240e-05 3.08834039e-05] [-1.42454807e-04 -8.34853984e-05 1.01028239e-04] [ 1.42417779e-04 3.47737372e-05 -2.02822521e-04] [-4.28386976e-04 -2.51670457e-04 -1.66171360e-04] [ 4.28197684e-04 1.06392202e-04 1.35732282e-04] [ 9.79020383e-05 -5.60299156e-05 8.68551475e-05] [-9.73308111e-05 -1.55696635e-04 -1.32319141e-04] [ 2.21294326e-05 8.01913878e-06 5.41553239e-05] [-2.20603192e-05 -6.51725137e-05 7.69644306e-05] [ 1.45245096e-04 -2.62807560e-04 -7.44630132e-05] [-1.45126708e-04 -2.74451430e-04 1.68169062e-04] [-1.31735033e-04 -2.14353299e-04 -3.07260821e-05] [ 1.31673824e-04 -3.67902311e-04 2.29760604e-04] [-7.08147324e-05 9.80546155e-05 -3.34983324e-04] [ 7.10325556e-05 4.95349975e-05 1.48639525e-04] [ 4.94673712e-05 1.93212659e-04 7.72896072e-05] [-4.93494823e-05 1.18239922e-04 6.23560123e-05] [ 7.72900099e-05 1.78634638e-04 5.98866408e-04] [-7.62874453e-05 2.88033211e-04 -1.06079431e-04] [ 1.56484891e-04 -1.29998231e-04 1.41868755e-05] [-1.56378549e-04 -1.61280273e-04 -1.81084566e-04] [-1.32384972e-04 -1.72597124e-05 -9.34467368e-05] [ 1.32254879e-04 1.47241752e-04 -4.34774454e-05] [ 4.56601965e-05 1.99485819e-04 1.62955035e-04] [ 2.07790588e-04 1.14303525e-04 1.81818495e-05] [-3.14658221e-05 3.22422288e-04 4.81455582e-07] [-2.18745069e-04 -1.05665427e-05 1.45686732e-04] [ 1.62405172e-04 1.50110919e-04 6.60019708e-06] [-8.43142494e-05 7.94933801e-05 -1.19639658e-04] [-1.65573216e-04 1.74149407e-04 -4.95619158e-05] [ 8.68479868e-05 5.52777345e-05 7.71887683e-05] [ 6.67905377e-05 -3.90740454e-05 -1.59539281e-04] [ 5.19696751e-05 2.93676207e-04 -3.31853857e-04] [ 3.62462584e-05 1.25225967e-04 3.33496103e-05] [-1.55477166e-04 1.29215791e-04 2.05593146e-04] [ 1.34249554e-04 -9.63726745e-05 -5.90688196e-05] [ 9.02577330e-05 -1.83318700e-04 1.89365399e-04] [-8.14329470e-05 -2.34119531e-04 2.46045240e-04] [-1.43632133e-04 -4.57840505e-05 -2.33415584e-06] [ 2.68780809e-04 1.06231842e-04 6.58417301e-05] [ 3.38128183e-06 -6.71741234e-05 -9.68369354e-05] [-1.83303087e-04 8.49811254e-05 -1.58844474e-04] [-9.08380595e-05 -4.65202124e-05 3.26154127e-06] [ 1.38604980e-04 6.71584238e-05 -1.10513753e-04] [-7.48275051e-05 2.83938225e-04 -9.34264405e-05] [ 1.60263074e-05 1.50465039e-04 -6.88632781e-06] [-7.89094080e-05 2.00643367e-04 -2.36950792e-05] [ 3.98879481e-04 2.62870059e-05 -8.05070433e-05] [-9.09990939e-05 -2.30964613e-04 -8.00933055e-05] [-3.13623092e-04 -1.67516919e-04 1.46432394e-04] [ 5.51992741e-06 -3.69873651e-05 1.46524557e-04] [-2.23655180e-04 1.04823836e-04 3.21323397e-05] [ 4.57994706e-05 -4.15167806e-04 -1.70805370e-04] [ 2.52588900e-04 -8.59612708e-05 -2.04413520e-04] [-7.44248158e-05 -2.24418493e-04 -1.58120640e-06] [ 9.12947158e-05 1.08545704e-04 2.17802084e-04] [-2.59150317e-04 -9.07148779e-05 4.29801834e-05] [-1.26994207e-04 6.68115478e-05 -1.99039624e-04] [ 2.94445907e-04 -4.92913477e-05 -2.43030716e-05] [ 1.89784581e-04 1.08631128e-04 5.19071509e-05] [-2.34108973e-04 -8.01408224e-05 -9.14033909e-05] [ 8.14437041e-06 7.56699475e-05 1.51685312e-05] [ 3.56630812e-05 -4.90602971e-05 1.59072881e-04] [ 2.73468589e-05 7.72491241e-05 -1.30835227e-04] [-2.78327499e-05 1.05272731e-06 8.97213444e-06] [-7.28419064e-05 1.06693387e-04 7.23045492e-05] [ 7.37954981e-05 -2.84809216e-05 -6.73889170e-05] [ 2.78142125e-04 -6.55909553e-05 2.19651274e-04] [-2.78564035e-04 -5.06549587e-05 -1.58619434e-04] [ 2.19498598e-04 1.33972308e-04 1.72378757e-04] [-2.19903213e-04 2.41296877e-05 -7.31428549e-05] [ 4.80316162e-05 -1.12844461e-04 -6.56200164e-05] [-4.80176132e-05 -1.40793192e-04 4.35069625e-05] [ 1.12398383e-04 -3.66388911e-05 2.77669307e-05] [-1.12388745e-04 -1.13229345e-04 -2.18263816e-04] [-1.62648390e-04 -1.65100433e-04 6.08309872e-05] [ 1.63675214e-04 4.32387667e-04 -1.46187156e-04] [-2.10688653e-04 -2.57969340e-04 -2.14776947e-04] [ 2.10423812e-04 -1.50871728e-04 1.16681890e-04] [-1.26212618e-04 1.49362730e-04 5.98129816e-05] [ 1.25883447e-04 1.22789921e-04 -9.64608526e-05] [ 9.64202781e-05 9.86078923e-05 -1.82995832e-04] [-9.55487215e-05 1.68044213e-04 2.69102895e-04] [ 1.21956463e-05 2.39351347e-04 -7.52550348e-05] [ 4.85572220e-05 -1.81363042e-06 -3.18513594e-04] [ 1.15571143e-04 2.56656170e-04 -2.12389403e-05] [-1.76645486e-04 -1.90155179e-05 2.23273072e-04] [-5.04260836e-05 -1.29823891e-04 -2.75244514e-05] [ 7.52134453e-05 -1.20851297e-04 -1.23148421e-04] [ 5.55199685e-05 -6.77205377e-05 2.30169816e-05] [-8.05988139e-05 -1.83550355e-04 1.17931057e-04]] Final stress: [-1.59842821e-06 -6.10148363e-08 -1.00741520e-05 5.15006366e-06 2.11225350e-09 -6.88413390e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.37727220e-05 2.30098427e-04 5.38500202e-05] [ 5.37897408e-05 -5.87926827e-04 1.91714706e-05] [-1.00487761e-04 -1.51345780e-04 4.61671972e-05] [ 1.00914837e-04 -1.74989655e-04 -1.01428414e-05] [-1.48991302e-04 -1.65897163e-04 -2.30156504e-04] [ 1.50035436e-04 -6.43879609e-05 1.85649545e-04] [ 6.51454116e-05 7.37826742e-05 1.03317716e-04] [-6.48174254e-05 1.93602950e-04 2.24011194e-04] [-6.18793224e-05 1.16666862e-04 1.22491646e-04] [ 6.20756615e-05 2.01669146e-04 -3.61747538e-04] [-1.07253906e-04 4.77318132e-05 3.30442803e-05] [ 1.07029641e-04 5.78110542e-05 3.00899319e-05] [ 1.42064625e-04 -8.29577885e-05 1.01573498e-04] [-1.42025941e-04 3.50554555e-05 -2.02178599e-04] [ 4.27161146e-04 -2.51780769e-04 -1.64933658e-04] [-4.26973673e-04 1.05705325e-04 1.37066028e-04] [-9.71490116e-05 -5.59497334e-05 8.71953802e-05] [ 9.65771167e-05 -1.55578411e-04 -1.32403008e-04] [-2.19870888e-05 7.07599885e-06 5.45585456e-05] [ 2.19169447e-05 -6.57992017e-05 7.63574172e-05] [-1.45839051e-04 -2.60281453e-04 -7.31782011e-05] [ 1.45720181e-04 -2.71866474e-04 1.66280939e-04] [ 1.32395032e-04 -2.14543882e-04 -3.11971323e-05] [-1.32331050e-04 -3.68262712e-04 2.29996518e-04] [ 7.02036671e-05 9.76129851e-05 -3.36200857e-04] [-7.04189300e-05 4.93619073e-05 1.50655974e-04] [-4.94608651e-05 1.91826508e-04 7.48337948e-05] [ 4.93440260e-05 1.18604357e-04 6.21204201e-05] [-7.72253072e-05 1.78950127e-04 5.99177252e-04] [ 7.62193052e-05 2.88050498e-04 -1.06007566e-04] [-1.56210566e-04 -1.30443280e-04 1.44915984e-05] [ 1.56104929e-04 -1.61420183e-04 -1.81462968e-04] [ 1.32681563e-04 -1.83184946e-05 -9.36027089e-05] [-1.32549728e-04 1.47451239e-04 -4.33875058e-05] [ 2.17478370e-04 -1.03122876e-05 1.45422790e-04] [ 3.11138122e-05 3.22222261e-04 1.21390284e-06] [-2.06849761e-04 1.14474425e-04 1.85075189e-05] [-4.49823763e-05 1.99369369e-04 1.62283794e-04] [-8.48725227e-05 5.50975216e-05 7.72386981e-05] [ 1.65608860e-04 1.74008497e-04 -4.97563382e-05] [ 8.20993386e-05 7.94226844e-05 -1.19551455e-04] [-1.62188868e-04 1.49866625e-04 6.92587841e-06] [ 1.56373480e-04 1.28982139e-04 2.05938824e-04] [-3.59172552e-05 1.25001482e-04 3.38427853e-05] [-5.31045328e-05 2.93587569e-04 -3.32372812e-04] [-6.68777818e-05 -3.94444667e-05 -1.60208071e-04] [ 1.44091202e-04 -4.59795654e-05 -1.44404359e-06] [ 7.96144218e-05 -2.33930171e-04 2.45659495e-04] [-9.03542264e-05 -1.84094906e-04 1.88977888e-04] [-1.32791243e-04 -9.56055579e-05 -5.81749748e-05] [ 9.01323831e-05 -4.66995277e-05 3.33881377e-06] [ 1.82955008e-04 8.46654212e-05 -1.58983270e-04] [-2.91116512e-06 -6.71430004e-05 -9.70790384e-05] [-2.68195607e-04 1.05706064e-04 6.58159969e-05] [ 7.75243294e-05 1.99275613e-04 -2.42779133e-05] [-1.34816800e-05 1.51135891e-04 -7.20947009e-06] [ 7.44967020e-05 2.83048011e-04 -9.28558933e-05] [-1.39437199e-04 6.73500209e-05 -1.10202787e-04] [-5.20995051e-06 -3.70795969e-05 1.46826064e-04] [ 3.13874874e-04 -1.66826677e-04 1.46246453e-04] [ 9.05615379e-05 -2.31083300e-04 -8.04346029e-05] [-3.99004895e-04 2.70025358e-05 -8.03605723e-05] [ 7.44721375e-05 -2.23055583e-04 -4.42747355e-06] [-2.52092818e-04 -8.68369561e-05 -2.05793512e-04] [-4.56241421e-05 -4.14798293e-04 -1.69053148e-04] [ 2.22933020e-04 1.04945227e-04 3.24115083e-05] [-2.93132261e-04 -5.06189684e-05 -2.46605904e-05] [ 1.26284256e-04 6.64489476e-05 -1.97503959e-04] [ 2.58660438e-04 -9.17320316e-05 4.43410017e-05] [-9.14094706e-05 1.07873056e-04 2.17269001e-04] [-3.79234283e-05 -4.63956636e-05 1.60096491e-04] [-5.08118811e-06 7.55733902e-05 1.53407559e-05] [ 2.35549013e-04 -7.66857261e-05 -9.31253473e-05] [-1.92024295e-04 1.07745300e-04 5.10366520e-05] [-7.33241892e-05 -2.78180061e-05 -6.67770548e-05] [ 7.32285211e-05 1.06833813e-04 7.25105668e-05] [ 2.79594823e-05 1.42386044e-06 8.06788097e-06] [-2.83253245e-05 7.76789510e-05 -1.31332904e-04] [-2.76833474e-04 -6.66930428e-05 2.19339333e-04] [ 2.77252811e-04 -5.26108700e-05 -1.59624949e-04] [-2.17852387e-04 1.33050431e-04 1.71382509e-04] [ 2.18255329e-04 2.30003108e-05 -7.21656387e-05] [-4.80015263e-05 -1.11767624e-04 -6.62252870e-05] [ 4.79872784e-05 -1.40387514e-04 4.33571600e-05] [-1.10683214e-04 -3.60250944e-05 2.76256464e-05] [ 1.10673500e-04 -1.12609438e-04 -2.17631880e-04] [ 1.60701193e-04 -1.66437474e-04 6.09338591e-05] [-1.61726779e-04 4.34962178e-04 -1.46360329e-04] [ 2.09131022e-04 -2.57150319e-04 -2.13889643e-04] [-2.08868034e-04 -1.49988272e-04 1.15451112e-04] [ 1.26641682e-04 1.49397155e-04 6.05628795e-05] [-1.26311766e-04 1.23682084e-04 -9.65828739e-05] [-9.73176063e-05 9.82238831e-05 -1.83360454e-04] [ 9.64370237e-05 1.66738501e-04 2.69394093e-04] [ 1.76535007e-04 -1.81178170e-05 2.23653958e-04] [-1.14907153e-04 2.55424719e-04 -2.32709765e-05] [-4.79506741e-05 -3.53042374e-07 -3.19263324e-04] [-1.33513121e-05 2.37556657e-04 -7.35993136e-05] [ 8.05433609e-05 -1.83915087e-04 1.18728776e-04] [-5.56712015e-05 -6.72840422e-05 2.30662225e-05] [-7.51936601e-05 -1.20735777e-04 -1.23558961e-04] [ 5.06099593e-05 -1.29866458e-04 -2.71907260e-05]] Final stress: [-1.60415023e-06 -5.73687175e-08 -1.00759643e-05 5.15087062e-06 -2.11502162e-09 6.88663451e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.39170432e-05 5.87166465e-04 1.91608754e-05] [-5.39000196e-05 -2.30269226e-04 5.37368871e-05] [ 1.00874680e-04 1.75106839e-04 -1.01713035e-05] [-1.00448002e-04 1.51534221e-04 4.61771877e-05] [ 1.50187886e-04 6.45130202e-05 1.85538525e-04] [-1.49144068e-04 1.65952307e-04 -2.30167760e-04] [-6.46925736e-05 -1.93241913e-04 2.23981392e-04] [ 6.50206485e-05 -7.34605328e-05 1.03353538e-04] [ 6.21817919e-05 -2.02317606e-04 -3.62108084e-04] [-6.19852070e-05 -1.17213741e-04 1.22744949e-04] [ 1.06935702e-04 -5.79709891e-05 3.02846633e-05] [-1.07160107e-04 -4.78409484e-05 3.28910290e-05] [-1.42203417e-04 -3.49404012e-05 -2.02188737e-04] [ 1.42241761e-04 8.30352925e-05 1.01337191e-04] [-4.27187306e-04 -1.05580244e-04 1.36926771e-04] [ 4.27374718e-04 2.51896587e-04 -1.65274267e-04] [ 9.68526721e-05 1.55593659e-04 -1.32324305e-04] [-9.74245457e-05 5.59575264e-05 8.70636148e-05] [ 2.19370080e-05 6.55569333e-05 7.64018922e-05] [-2.20069775e-05 -7.34450134e-06 5.45815316e-05] [ 1.45543441e-04 2.72469523e-04 1.66729469e-04] [-1.45662509e-04 2.60866003e-04 -7.35506222e-05] [-1.32029222e-04 3.68405508e-04 2.29818102e-04] [ 1.32093065e-04 2.14614386e-04 -3.09484875e-05] [-7.06493694e-05 -4.93933157e-05 1.50094740e-04] [ 7.04336997e-05 -9.76016546e-05 -3.35622031e-04] [ 4.91533889e-05 -1.18808204e-04 6.19957781e-05] [-4.92709869e-05 -1.92210956e-04 7.54675144e-05] [ 7.62442692e-05 -2.87865559e-04 -1.05942566e-04] [-7.72506291e-05 -1.78682686e-04 5.98960286e-04] [ 1.56207799e-04 1.61210982e-04 -1.81367054e-04] [-1.56312357e-04 1.30166425e-04 1.44685601e-05] [-1.32381697e-04 -1.47442019e-04 -4.33085228e-05] [ 1.32512950e-04 1.81093107e-05 -9.36063345e-05] [-2.07160715e-04 -1.14229433e-04 1.84501522e-05] [-4.50904828e-05 -1.99348968e-04 1.62481465e-04] [ 2.17842165e-04 1.05385836e-05 1.45425813e-04] [ 3.11702331e-05 -3.22183992e-04 9.62014599e-07] [ 8.28061265e-05 -7.93503495e-05 -1.19401510e-04] [-1.62443680e-04 -1.49886078e-04 6.86776674e-06] [-8.54928558e-05 -5.51037831e-05 7.70028223e-05] [ 1.65772840e-04 -1.73951992e-04 -4.97815230e-05] [-5.26596659e-05 -2.93522554e-04 -3.32236396e-04] [-6.67975637e-05 3.91957570e-05 -1.60053633e-04] [ 1.55944055e-04 -1.29017189e-04 2.05845457e-04] [-3.60133033e-05 -1.25150332e-04 3.37324655e-05] [-9.01916480e-05 1.83901913e-04 1.88989795e-04] [-1.32997370e-04 9.57724753e-05 -5.83985550e-05] [ 1.43887278e-04 4.58897539e-05 -1.52053274e-06] [ 7.98625199e-05 2.33994886e-04 2.45817032e-04] [-3.06572829e-06 6.70256934e-05 -9.69817262e-05] [-2.68304794e-04 -1.05914002e-04 6.58186326e-05] [ 9.03188429e-05 4.65843524e-05 3.30523583e-06] [ 1.83031043e-04 -8.48755006e-05 -1.58922561e-04] [ 7.42893388e-05 -2.83345997e-04 -9.29681456e-05] [-1.38695314e-04 -6.68261762e-05 -1.10422319e-04] [ 7.80157851e-05 -1.99629974e-04 -2.41743927e-05] [-1.45050883e-05 -1.50557553e-04 -7.00009349e-06] [ 9.07190346e-05 2.31101232e-04 -8.03788846e-05] [-3.98752002e-04 -2.67781302e-05 -8.04295752e-05] [-5.36310899e-06 3.71487459e-05 1.46783964e-04] [ 3.13616888e-04 1.66999932e-04 1.46329100e-04] [-4.57693583e-05 4.14847008e-04 -1.69488994e-04] [ 2.23134955e-04 -1.05068296e-04 3.23429012e-05] [ 7.46269357e-05 2.23309132e-04 -3.79793626e-06] [-2.52304050e-04 8.65082142e-05 -2.05529850e-04] [ 2.58685317e-04 9.14562108e-05 4.40143965e-05] [-9.13165741e-05 -1.07932045e-04 2.17371221e-04] [-2.93316946e-04 5.03113959e-05 -2.45374367e-05] [ 1.26352313e-04 -6.64763082e-05 -1.97809536e-04] [ 2.35092285e-04 7.74568182e-05 -9.27202504e-05] [-1.91167019e-04 -1.08146206e-04 5.14789145e-05] [-3.73238625e-05 4.70332487e-05 1.59837810e-04] [-6.08256876e-06 -7.58425952e-05 1.50443573e-05] [ 2.78738767e-05 -1.30869004e-06 8.38688508e-06] [-2.81667789e-05 -7.77244458e-05 -1.31102105e-04] [-7.33653417e-05 2.79545919e-05 -6.70039073e-05] [ 7.31957819e-05 -1.06899500e-04 7.23727361e-05] [ 2.77716889e-04 5.21772678e-05 -1.59428483e-04] [-2.77296865e-04 6.63880698e-05 2.19355174e-04] [ 2.18728441e-04 -2.32609947e-05 -7.22951421e-05] [-2.18325108e-04 -1.33235794e-04 1.71456789e-04] [ 4.79753118e-05 1.40498072e-04 4.33097414e-05] [-4.79889811e-05 1.12011854e-04 -6.60128807e-05] [ 1.11323617e-04 1.12742575e-04 -2.17709363e-04] [-1.11333829e-04 3.61450324e-05 2.76195632e-05] [-1.62028638e-04 -4.34212450e-04 -1.46285977e-04] [ 1.61003860e-04 1.66565078e-04 6.09224997e-05] [-2.09340803e-04 1.50212246e-04 1.15649474e-04] [ 2.09603743e-04 2.57317753e-04 -2.13959740e-04] [-1.26188004e-04 -1.23498971e-04 -9.65209701e-05] [ 1.26517352e-04 -1.49363135e-04 6.03674550e-05] [ 9.60063599e-05 -1.67175600e-04 2.69273588e-04] [-9.68838099e-05 -9.84285106e-05 -1.83290120e-04] [-4.81259763e-05 8.20810267e-07 -3.19156384e-04] [-1.30163421e-05 -2.37986062e-04 -7.39440635e-05] [ 1.76565586e-04 1.85089365e-05 2.23606241e-04] [-1.15096196e-04 -2.55776272e-04 -2.28655036e-05] [-7.51774149e-05 1.20596654e-04 -1.23226687e-04] [ 5.05929084e-05 1.29914509e-04 -2.73673323e-05] [ 8.04890714e-05 1.83721076e-04 1.18260099e-04] [-5.56164981e-05 6.73875103e-05 2.31065263e-05]] Final stress: [-1.60293874e-06 -5.85377529e-08 -1.00736763e-05 -5.15071771e-06 -2.11426260e-09 -6.88278983e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.11330189e-05 6.50356174e-04 3.31846911e-05] [ 5.10702820e-05 -2.55821006e-04 6.40485077e-05] [-9.94457162e-05 1.72682125e-04 -1.94809570e-05] [ 9.90351148e-05 1.49450139e-04 4.56586542e-05] [-1.46530486e-04 6.67569751e-05 1.78116962e-04] [ 1.45494604e-04 1.70005777e-04 -2.16232695e-04] [ 6.28634484e-05 -2.11479330e-04 2.51827612e-04] [-6.31419789e-05 -8.71040719e-05 8.74402906e-05] [-6.35906541e-05 -2.09499782e-04 -3.66474198e-04] [ 6.33937182e-05 -1.17928800e-04 1.20863076e-04] [-1.08560753e-04 -6.44381499e-05 5.22777643e-05] [ 1.08795339e-04 -5.03883820e-05 1.64422371e-05] [ 1.42991159e-04 -2.56834580e-05 -1.99222049e-04] [-1.43018854e-04 9.61316973e-05 1.07660635e-04] [ 4.18764660e-04 -1.11481124e-04 1.60380059e-04] [-4.18954973e-04 2.66924341e-04 -1.84488195e-04] [-9.99466316e-05 1.58745521e-04 -1.30545070e-04] [ 1.00518636e-04 6.33953086e-05 9.06292505e-05] [-1.97238882e-05 6.54470438e-05 6.32087141e-05] [ 1.97955092e-05 -1.79268036e-05 6.57759641e-05] [-1.39733937e-04 2.77530952e-04 1.60251797e-04] [ 1.39842732e-04 2.65453765e-04 -7.29547058e-05] [ 1.38057270e-04 3.94800668e-04 2.36278663e-04] [-1.38134307e-04 2.28850162e-04 -4.16296540e-05] [ 6.99836504e-05 -7.16534705e-05 1.80521804e-04] [-6.98039226e-05 -1.30449526e-04 -3.55108043e-04] [-5.00067265e-05 -1.35997086e-04 4.99039928e-05] [ 5.01206314e-05 -1.98533685e-04 8.46622936e-05] [-7.23685716e-05 -2.87192343e-04 -1.04137372e-04] [ 7.33728408e-05 -1.69188602e-04 6.00852633e-04] [-1.61028751e-04 1.61190120e-04 -1.83234797e-04] [ 1.61115126e-04 1.24140724e-04 1.93991527e-05] [ 1.29580214e-04 -1.66226506e-04 -4.35974413e-05] [-1.29733029e-04 9.06323147e-06 -9.53699210e-05] [-4.26142585e-05 -3.14284273e-04 3.46748483e-06] [-2.17442059e-04 1.30892708e-05 1.47562221e-04] [ 5.32674333e-05 -1.87967938e-04 1.56984994e-04] [ 2.10006047e-04 -1.15172042e-04 1.32987504e-05] [-1.61497583e-04 -1.68606082e-04 -4.72583627e-05] [ 8.07191097e-05 -5.45487864e-05 7.44648182e-05] [ 1.63054646e-04 -1.47226227e-04 -4.74059086e-06] [-8.30317270e-05 -7.61589775e-05 -1.25875592e-04] [ 4.48021674e-05 -1.17039401e-04 2.52535196e-05] [-1.49111501e-04 -1.38333920e-04 2.02717136e-04] [ 5.80569053e-05 3.88319126e-05 -1.53006146e-04] [ 4.57974446e-05 -2.94382174e-04 -3.30523122e-04] [-6.87601789e-05 2.43360709e-04 2.62130093e-04] [-1.53557157e-04 4.44716781e-05 5.97441863e-06] [ 1.33190984e-04 9.67875972e-05 -5.95469650e-05] [ 8.85988795e-05 1.90850033e-04 1.96602348e-04] [-1.79855269e-04 -8.64598185e-05 -1.50611517e-04] [-8.68241725e-05 5.29038760e-05 -3.46224741e-06] [ 2.66769329e-04 -1.06826619e-04 5.91828383e-05] [-2.08890522e-06 7.26689738e-05 -8.85601807e-05] [ 2.62159185e-05 -1.65606304e-04 -1.64321991e-05] [-7.19940160e-05 -1.91610966e-04 -2.45784137e-05] [ 1.20494714e-04 -6.85033624e-05 -1.08756355e-04] [-7.38507832e-05 -2.88675371e-04 -1.00306625e-04] [-2.98652840e-04 1.65069094e-04 1.42981979e-04] [ 1.35456458e-05 3.31648670e-05 1.42001267e-04] [ 3.85635923e-04 -2.35947815e-05 -7.51025365e-05] [-1.00740671e-04 2.21990920e-04 -7.36043191e-05] [ 2.79823708e-04 1.08231374e-04 -2.23309457e-04] [-8.18199949e-05 2.13282610e-04 -5.88109252e-06] [-2.35829450e-04 -1.04268160e-04 3.33072621e-05] [ 3.81819091e-05 4.25747292e-04 -1.84202346e-04] [-1.31092156e-04 -6.35112681e-05 -1.92763817e-04] [ 2.99787037e-04 4.61927112e-05 -2.39779041e-05] [ 9.65703759e-05 -1.05232940e-04 2.14406666e-04] [-2.65641166e-04 8.75942972e-05 4.55268424e-05] [ 1.73528898e-05 -7.63404884e-05 9.84153973e-06] [ 5.87669539e-05 2.96237552e-05 1.59837919e-04] [ 1.78754640e-04 -1.08147341e-04 5.83002515e-05] [-2.55390479e-04 5.95712589e-05 -9.10874458e-05] [-7.85424253e-05 -1.06469527e-04 8.21575258e-05] [ 7.13695708e-05 2.86263839e-05 -7.70088268e-05] [ 2.99823129e-05 -7.86306483e-05 -1.36673654e-04] [-2.23511632e-05 6.87409034e-07 2.25993238e-05] [-2.70138652e-04 6.64617397e-05 -1.60370638e-04] [ 2.69714690e-04 7.87933147e-05 2.18207793e-04] [-2.18706095e-04 -1.74373780e-05 -7.41931205e-05] [ 2.18318788e-04 -1.31021966e-04 1.70208147e-04] [-4.33422406e-05 1.40599016e-04 3.25182726e-05] [ 4.33526869e-05 1.10148670e-04 -5.25873274e-05] [-1.19910389e-04 1.32308149e-04 -2.50650060e-04] [ 1.19931778e-04 4.83906522e-05 5.35910353e-05] [ 1.46834092e-04 -4.93186542e-04 -1.45432976e-04] [-1.45840375e-04 1.84530323e-04 5.96062469e-05] [ 2.14476962e-04 1.51045296e-04 1.20318124e-04] [-2.14757215e-04 2.57771903e-04 -2.14398591e-04] [ 1.24907829e-04 -1.21051685e-04 -8.22413275e-05] [-1.25212913e-04 -1.50474993e-04 5.20343502e-05] [-9.99741281e-05 -1.79744692e-04 2.61289442e-04] [ 1.00909216e-04 -1.07625108e-04 -1.78352274e-04] [ 1.17664766e-04 -2.51082728e-04 -4.11485154e-05] [-1.83600222e-04 2.94779162e-05 2.18374353e-04] [ 1.56733508e-05 -2.22047469e-04 -7.10794835e-05] [ 4.99343643e-05 5.37426343e-07 -3.29315267e-04] [ 5.46444010e-05 5.49037350e-05 9.38595410e-06] [-7.55284709e-05 1.84667837e-04 1.36535363e-04] [-4.92704983e-05 1.23913762e-04 -1.13690526e-05] [ 6.99229477e-05 1.15041614e-04 -1.39169590e-04]] Final stress: [-1.62745357e-06 -2.28760963e-08 -1.00625060e-05 -5.12502744e-06 2.14990227e-09 6.85480311e-06] Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 147 steps. Minimization converged after 145 steps. Minimization converged after 150 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-4.74926550e-04 -1.10263671e-05 -2.52131547e-06] [-4.66801756e-04 -9.98127292e-06 -1.17522865e-05] [-4.36080178e-04 2.30171564e-04 -4.47850931e-05] [-2.08156711e-05 -2.24175987e-04 -7.22196545e-05] [-6.00462111e-04 -3.34483362e-04 1.31787519e-04] [-6.31454064e-04 3.04948454e-04 1.36541262e-04] [ 4.55303142e-04 4.41007967e-05 7.31426561e-05] [ 1.83978433e-04 -8.06078899e-05 4.22520352e-05] [-8.56319935e-04 -3.00870579e-04 -3.03895434e-04] [ 4.27100019e-05 2.94722969e-04 -2.95742315e-04] [ 1.43338088e-06 1.93979154e-04 -1.17062782e-04] [ 1.00040125e-03 -2.15157187e-04 -1.31320311e-04] [ 5.50623476e-05 -1.81465058e-05 5.09417816e-05] [-1.00696281e-03 1.02338472e-05 4.73254428e-05] [ 9.19007671e-04 4.32275916e-04 6.00117616e-05] [-1.35236619e-03 -4.24667225e-04 5.96794318e-05] [-3.60478179e-04 -4.44081544e-05 9.05716537e-05] [ 7.00328691e-04 6.33599881e-05 1.06516348e-04] [-3.44046431e-04 -1.02769206e-04 8.60211569e-05] [ 2.06398067e-04 1.01887921e-04 8.70221738e-05] [ 3.98994974e-04 1.04038680e-04 8.45279266e-05] [ 4.13241412e-04 -1.16022055e-04 1.02269210e-04] [ 3.14695483e-04 2.90427872e-05 5.02824184e-05] [-3.99211357e-04 -3.03538855e-05 5.26365107e-05] [ 5.93185929e-04 3.64547404e-05 -2.80732524e-04] [-1.82191217e-06 -8.46504269e-05 -3.07476056e-04] [ 2.95917676e-04 -5.30728774e-04 -2.18045106e-04] [ 1.12291352e-04 5.34602757e-04 -2.06464513e-04] [-4.53012313e-04 -9.31551614e-05 6.83204040e-04] [ 3.21459008e-04 1.23587919e-04 6.83426850e-04] [-1.54894838e-03 1.26243174e-04 -3.08169710e-04] [-4.39502677e-04 -1.11235001e-04 -3.26457466e-04] [-1.92418189e-04 -1.19125248e-04 9.34402558e-05] [-1.24857930e-04 1.38046262e-04 9.07209484e-05] [ 1.31324148e-04 -2.65482465e-04 3.34755673e-04] [-3.45480036e-04 9.03393466e-05 3.83100104e-05] [-7.39984346e-04 7.85546513e-05 2.77646596e-04] [ 4.06319771e-04 1.23706703e-04 -1.10077536e-05] [-5.28036020e-04 -5.01629009e-04 -1.18631910e-04] [-2.28586982e-04 4.89220604e-04 7.36199541e-04] [-5.83760637e-05 -4.74922597e-05 -4.21410110e-04] [-7.06566370e-04 5.76392515e-05 4.40320319e-04] [ 7.34415040e-04 -1.79611349e-04 -5.95766270e-04] [ 3.80613069e-04 -8.98119150e-04 4.92076299e-04] [ 5.77581490e-04 1.29203323e-03 -8.55564543e-04] [ 5.73730017e-04 -2.67287085e-04 3.16846943e-04] [ 4.33472908e-04 -5.52111243e-05 8.23307680e-04] [-3.74051632e-04 1.91798783e-05 6.81441530e-04] [-1.04379052e-04 -6.25563707e-05 -5.24852684e-04] [ 1.76064611e-04 7.17216461e-05 -7.09011539e-04] [-5.87047646e-04 -5.01658156e-04 -1.43720773e-04] [ 4.62817553e-04 -2.07737651e-04 -3.35449184e-04] [ 4.33093960e-04 2.10493589e-04 1.03462220e-04] [-4.77330090e-04 5.24436067e-04 -8.64834671e-05] [-4.59154278e-04 -9.84584661e-04 -8.47520992e-04] [-2.27527163e-04 -5.46580325e-04 5.02163105e-04] [-5.77752952e-04 1.39545272e-03 -1.18416785e-03] [-1.34437485e-04 1.82686920e-04 1.58544543e-04] [-3.79451958e-04 -1.48448376e-04 -1.15469588e-04] [ 5.80510262e-04 -1.32482122e-03 6.01443134e-04] [ 7.19282215e-04 9.10829904e-04 -3.60002033e-04] [-5.24594210e-04 5.49458689e-04 3.84120133e-04] [ 7.73941410e-04 -7.50499855e-04 -3.61420057e-04] [-6.27382016e-04 -3.23077092e-04 2.47119132e-04] [-3.73806416e-04 -2.82646983e-05 -6.42159375e-04] [ 5.34730350e-04 1.09887928e-03 -7.58201646e-06] [-9.41158869e-04 1.83498760e-05 -4.83742093e-04] [ 6.54699594e-04 3.51870665e-04 -9.07798820e-06] [ 7.30999559e-04 -3.08545965e-04 1.97165670e-04] [-1.03431606e-03 -5.36416661e-05 6.53343336e-04] [ 4.12684235e-04 -3.84584187e-05 -5.85887791e-04] [ 1.57720597e-04 -2.07888861e-04 5.31818691e-04] [ 1.18494365e-04 -4.78885545e-04 -2.02960950e-04] [ 4.68371394e-04 7.77808165e-04 9.26298653e-04] [-5.91947924e-04 1.67104187e-04 -5.21798834e-04] [-2.71874455e-04 5.78202510e-04 -1.97629849e-04] [-2.21275961e-04 -7.81445686e-04 -1.22635139e-04] [-6.12288250e-04 2.75029715e-05 1.71037934e-04] [-3.99869593e-04 -1.69906911e-05 7.94020257e-05] [ 1.07339729e-03 3.10715053e-05 5.33225428e-05] [-1.01261195e-03 4.89730494e-05 2.78475104e-05] [ 1.27894483e-03 -5.31891158e-05 3.02768299e-05] [ 2.41014192e-04 2.69925000e-04 -1.82112377e-04] [ 2.16017409e-04 -2.81768709e-04 -1.87081385e-04] [-1.10305560e-03 1.36857582e-04 -1.61635986e-04] [ 1.20417733e-03 -1.37249714e-04 -1.80485381e-04] [ 4.39254553e-04 -1.82918535e-04 3.18044486e-06] [ 3.15373842e-04 2.67426192e-04 -2.01103354e-05] [ 1.59980558e-03 -1.20570492e-04 2.91993989e-05] [-7.90759599e-04 1.05960736e-04 4.23933286e-05] [ 1.66569775e-04 -9.38762279e-05 1.63377177e-04] [-7.85967074e-05 9.47839273e-05 1.54481894e-04] [ 1.13904873e-04 2.73092438e-04 4.24506504e-05] [ 6.96385921e-04 -2.41166640e-04 3.27873558e-05] [ 3.53273252e-04 -6.86447845e-04 4.60883846e-04] [-6.54045622e-04 -8.42958363e-05 1.55253303e-04] [-6.66901110e-04 -4.17841440e-04 -1.38332455e-04] [ 3.37432905e-04 1.15788263e-03 -4.33559656e-04] [ 4.55368933e-04 -6.93215909e-05 9.51502554e-04] [ 5.42408451e-04 7.06117535e-04 -3.34717176e-04] [ 4.03422104e-04 -1.90653871e-04 6.45273723e-04] [ 6.31106429e-04 -4.85476395e-04 -5.92743010e-04]] Final stress: [-2.23693566e-06 1.30900482e-06 -2.29662283e-05 -5.01650049e-08 6.11189632e-06 1.22688760e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 3.06146924e-03 1.31037101e-02 1.92023944e-03] [-3.06146922e-03 -1.31037102e-02 1.92023947e-03] [ 3.15392274e-03 6.55145851e-04 -1.38618543e-03] [-3.15392275e-03 -6.55145838e-04 -1.38618541e-03] [ 5.10764825e-03 -2.97836313e-03 1.42540350e-03] [-5.10764824e-03 2.97836313e-03 1.42540352e-03] [-7.88813849e-03 -5.95324869e-03 8.13118030e-03] [ 7.88813849e-03 5.95324884e-03 8.13118050e-03] [-3.19457041e-03 4.05153176e-04 -1.27262600e-03] [ 3.19457041e-03 -4.05153185e-04 -1.27262605e-03] [ 3.16674934e-04 2.17452664e-03 8.70683671e-05] [-3.16674924e-04 -2.17452665e-03 8.70683704e-05] [-2.41633665e-04 7.22932681e-04 5.18628948e-03] [ 2.41633652e-04 -7.22932687e-04 5.18628942e-03] [-7.74816105e-03 2.07238566e-03 1.02997349e-02] [ 7.74816105e-03 -2.07238558e-03 1.02997350e-02] [-1.36075625e-03 8.13255565e-04 1.29054312e-04] [ 1.36075624e-03 -8.13255622e-04 1.29054280e-04] [-1.60032510e-03 -1.13371890e-03 -1.34907131e-03] [ 1.60032511e-03 1.13371888e-03 -1.34907134e-03] [ 8.92675270e-03 1.39600635e-03 8.71096924e-04] [-8.92675271e-03 -1.39600639e-03 8.71096915e-04] [-3.72784845e-03 8.13482844e-03 1.45747992e-03] [ 3.72784843e-03 -8.13482836e-03 1.45747989e-03] [-6.82901932e-04 2.25237012e-03 -5.41811649e-03] [ 6.82901936e-04 -2.25237002e-03 -5.41811641e-03] [-2.26224502e-03 -8.61601332e-03 -1.09922341e-02] [ 2.26224503e-03 8.61601321e-03 -1.09922341e-02] [ 6.74036629e-03 2.00910648e-03 5.00676073e-03] [-6.74036628e-03 -2.00910649e-03 5.00676071e-03] [-1.26827097e-03 -2.00678498e-03 -2.62398043e-03] [ 1.26827095e-03 2.00678499e-03 -2.62398042e-03] [-6.12552709e-03 -5.78168876e-03 -1.69995624e-03] [ 6.12552708e-03 5.78168876e-03 -1.69995625e-03] [-8.23835868e-03 6.41732503e-03 3.02409341e-03] [ 8.23835869e-03 -6.41732503e-03 3.02409343e-03] [ 6.88118033e-04 6.79336304e-03 2.82513618e-03] [-6.88118055e-04 -6.79336305e-03 2.82513615e-03] [ 6.31564230e-04 2.12184752e-04 5.75977762e-03] [-6.31564228e-04 -2.12184743e-04 5.75977762e-03] [-2.09299818e-03 -1.01678129e-03 -5.05031044e-03] [ 2.09299815e-03 1.01678129e-03 -5.05031044e-03] [-3.60178308e-03 -7.63152350e-03 -5.80199751e-03] [ 3.60178307e-03 7.63152350e-03 -5.80199750e-03] [ 2.36425537e-03 -4.57081951e-04 6.96905931e-03] [-2.36425538e-03 4.57081952e-04 6.96905931e-03] [-5.41067397e-03 7.80095945e-03 7.53203652e-03] [ 5.41067399e-03 -7.80095945e-03 7.53203657e-03] [ 6.72746907e-03 3.03314034e-04 -6.50104548e-04] [-6.72746905e-03 -3.03314030e-04 -6.50104566e-04] [-3.15507632e-03 -3.40864843e-03 -5.93916643e-03] [ 3.15507631e-03 3.40864842e-03 -5.93916644e-03] [-1.74157108e-03 -1.21641662e-03 5.30450056e-04] [ 1.74157110e-03 1.21641657e-03 5.30450026e-04] [-3.00731126e-03 -1.11704404e-02 1.35008299e-04] [ 3.00731132e-03 1.11704405e-02 1.35008267e-04] [-1.37995175e-02 2.21164530e-03 -4.19331524e-03] [ 1.37995174e-02 -2.21164519e-03 -4.19331524e-03] [ 5.98910911e-03 4.13142043e-03 -1.39912616e-03] [-5.98910911e-03 -4.13142043e-03 -1.39912616e-03] [-6.43158147e-03 -4.00524807e-04 -2.55077799e-04] [ 6.43158150e-03 4.00524828e-04 -2.55077794e-04] [ 3.94520807e-03 6.10796356e-03 5.17931032e-03] [-3.94520810e-03 -6.10796359e-03 5.17931028e-03] [-2.30099150e-03 1.44741530e-04 -1.63597011e-02] [ 2.30099152e-03 -1.44741549e-04 -1.63597010e-02] [ 1.34555712e-03 -1.93838464e-04 4.98692035e-03] [-1.34555715e-03 1.93838505e-04 4.98692037e-03] [ 3.08515904e-03 3.88315322e-03 -3.23350204e-04] [-3.08515899e-03 -3.88315319e-03 -3.23350241e-04] [ 5.67920170e-03 3.68033567e-03 -5.94621452e-03] [-5.67920172e-03 -3.68033565e-03 -5.94621453e-03] [-1.37740625e-02 9.14410036e-04 4.37549891e-03] [ 1.37740625e-02 -9.14410001e-04 4.37549893e-03] [ 2.16358969e-03 3.11200922e-03 -2.91244298e-03] [-2.16358968e-03 -3.11200922e-03 -2.91244293e-03] [ 3.72966888e-06 -8.10916226e-05 4.25153291e-03] [-3.72968562e-06 8.10916340e-05 4.25153287e-03] [ 2.40730762e-03 -1.77029509e-03 4.45366685e-04] [-2.40730763e-03 1.77029503e-03 4.45366617e-04] [-4.46152233e-03 1.03394649e-03 3.92446286e-04] [ 4.46152234e-03 -1.03394649e-03 3.92446282e-04] [ 3.68041047e-03 2.36314847e-03 -3.75534095e-03] [-3.68041048e-03 -2.36314844e-03 -3.75534096e-03] [-2.93695488e-03 7.11257190e-03 -5.56283592e-03] [ 2.93695488e-03 -7.11257203e-03 -5.56283604e-03] [ 3.11009101e-03 -1.44109305e-02 -1.48520877e-03] [-3.11009099e-03 1.44109306e-02 -1.48520878e-03] [ 7.34314567e-03 -1.03420002e-03 -1.50253570e-03] [-7.34314565e-03 1.03420003e-03 -1.50253567e-03] [-1.06864273e-02 -2.40432825e-03 2.31977587e-03] [ 1.06864273e-02 2.40432823e-03 2.31977584e-03] [ 8.34894801e-04 -3.06542073e-03 4.96493489e-04] [-8.34894805e-04 3.06542072e-03 4.96493473e-04] [ 4.02337201e-03 -1.35921137e-03 -5.42832999e-03] [-4.02337199e-03 1.35921138e-03 -5.42833008e-03] [-4.02486376e-03 -3.34886519e-03 -1.17869946e-03] [ 4.02486374e-03 3.34886518e-03 -1.17869936e-03] [-9.06973768e-03 -9.98420368e-03 3.12644365e-03] [ 9.06973764e-03 9.98420362e-03 3.12644360e-03] [ 3.23494039e-03 1.42645894e-03 5.62226996e-03] [-3.23494034e-03 -1.42645902e-03 5.62226999e-03]] Final stress: [-5.49053551e-05 4.07420939e-05 -9.18657942e-05 3.57004174e-14 -2.34218258e-14 -1.38647753e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.42103169e-03 9.67568399e-03 1.69502380e-03] [ 2.42103168e-03 -9.67568383e-03 1.69502378e-03] [-2.74782345e-03 6.40404707e-04 -7.71748793e-04] [ 2.74782344e-03 -6.40404708e-04 -7.71748789e-04] [-3.88392077e-03 -2.20934841e-03 1.27293878e-03] [ 3.88392077e-03 2.20934842e-03 1.27293879e-03] [ 6.64538107e-03 -4.31213283e-03 5.84751444e-03] [-6.64538106e-03 4.31213287e-03 5.84751450e-03] [ 2.24977950e-03 2.16643133e-04 -9.06346535e-04] [-2.24977950e-03 -2.16643157e-04 -9.06346544e-04] [-9.09080691e-04 1.64303004e-03 -2.18424773e-04] [ 9.09080688e-04 -1.64303005e-03 -2.18424802e-04] [-3.05351127e-04 5.32141602e-04 3.79251328e-03] [ 3.05351132e-04 -5.32141631e-04 3.79251325e-03] [ 6.56204052e-03 1.86436674e-03 7.89881092e-03] [-6.56204052e-03 -1.86436682e-03 7.89881093e-03] [ 8.76310459e-04 6.56326947e-04 1.89509668e-04] [-8.76310463e-04 -6.56326946e-04 1.89509667e-04] [ 1.65151233e-03 -9.09303741e-04 -8.86232384e-04] [-1.65151233e-03 9.09303742e-04 -8.86232420e-04] [-6.24218197e-03 1.17706916e-03 7.26313821e-04] [ 6.24218195e-03 -1.17706915e-03 7.26313793e-04] [ 2.94148504e-03 5.37835565e-03 7.57358744e-04] [-2.94148501e-03 -5.37835570e-03 7.57358739e-04] [ 1.29612346e-03 1.65824630e-03 -4.03907862e-03] [-1.29612347e-03 -1.65824628e-03 -4.03907857e-03] [ 1.03436857e-03 -6.65937898e-03 -8.46724026e-03] [-1.03436856e-03 6.65937901e-03 -8.46724023e-03] [-5.17582117e-03 1.38739491e-03 3.95715298e-03] [ 5.17582120e-03 -1.38739489e-03 3.95715297e-03] [ 1.10514270e-03 -1.45651873e-03 -2.02756327e-03] [-1.10514268e-03 1.45651871e-03 -2.02756327e-03] [ 5.02570205e-03 -4.25955362e-03 -1.27889359e-03] [-5.02570204e-03 4.25955359e-03 -1.27889359e-03] [ 6.58919381e-04 -5.24777587e-03 2.73876864e-03] [-6.58919378e-04 5.24777587e-03 2.73876864e-03] [-5.81961271e-03 -4.96136768e-03 1.55496052e-03] [ 5.81961271e-03 4.96136768e-03 1.55496053e-03] [-2.31297510e-03 1.16920909e-03 -3.61368917e-03] [ 2.31297512e-03 -1.16920911e-03 -3.61368919e-03] [ 9.18480544e-04 6.21015415e-04 4.37802227e-03] [-9.18480579e-04 -6.21015431e-04 4.37802227e-03] [ 2.13534940e-03 1.37228036e-03 4.66262886e-03] [-2.13534940e-03 -1.37228037e-03 4.66262885e-03] [-2.89097654e-03 6.70048676e-03 -4.31065765e-03] [ 2.89097653e-03 -6.70048676e-03 -4.31065764e-03] [ 5.58198676e-03 -5.92986852e-04 -1.85539955e-03] [-5.58198674e-03 5.92986876e-04 -1.85539957e-03] [-4.45430979e-03 -6.03473119e-03 6.57824958e-03] [ 4.45430982e-03 6.03473119e-03 6.57824963e-03] [-6.73501344e-04 1.18876236e-03 1.37228779e-03] [ 6.73501339e-04 -1.18876236e-03 1.37228782e-03] [-2.69249234e-03 2.79758996e-03 -5.39604190e-03] [ 2.69249233e-03 -2.79758997e-03 -5.39604192e-03] [-1.06060795e-02 -1.14857605e-03 -2.99491679e-03] [ 1.06060795e-02 1.14857609e-03 -2.99491681e-03] [-1.90345889e-03 8.24260862e-03 1.58539679e-04] [ 1.90345889e-03 -8.24260859e-03 1.58539682e-04] [-5.19795453e-03 8.50752082e-04 -7.81662713e-04] [ 5.19795451e-03 -8.50752066e-04 -7.81662714e-04] [ 4.97486274e-03 -2.56623178e-03 -2.25331525e-04] [-4.97486273e-03 2.56623180e-03 -2.25331532e-04] [-1.34774437e-03 5.20918006e-04 -1.23081217e-02] [ 1.34774436e-03 -5.20917973e-04 -1.23081216e-02] [ 2.14737733e-03 -3.95278915e-03 4.34335661e-03] [-2.14737733e-03 3.95278918e-03 4.34335659e-03] [ 1.08526782e-03 -2.56191186e-03 5.95639179e-05] [-1.08526781e-03 2.56191184e-03 5.95639365e-05] [ 2.63247094e-03 5.71043278e-04 3.78825938e-03] [-2.63247096e-03 -5.71043289e-04 3.78825939e-03] [-1.09230688e-02 -8.57510979e-04 3.52413191e-03] [ 1.09230688e-02 8.57511013e-04 3.52413189e-03] [ 5.01991151e-03 -2.39536690e-03 -5.01327766e-03] [-5.01991148e-03 2.39536693e-03 -5.01327764e-03] [ 1.04451647e-03 4.81170467e-04 3.40889174e-03] [-1.04451644e-03 -4.81170479e-04 3.40889179e-03] [ 1.04727701e-03 -1.95748767e-03 -2.83225027e-03] [-1.04727702e-03 1.95748767e-03 -2.83225029e-03] [-1.51027023e-03 -1.04301912e-03 -1.07481978e-04] [ 1.51027024e-03 1.04301908e-03 -1.07481970e-04] [ 3.56588860e-03 7.33547906e-04 2.58765860e-04] [-3.56588859e-03 -7.33547917e-04 2.58765859e-04] [-2.69679043e-03 1.94954183e-03 -3.01524657e-03] [ 2.69679043e-03 -1.94954183e-03 -3.01524657e-03] [ 2.20882941e-03 4.91705919e-03 -3.69815890e-03] [-2.20882943e-03 -4.91705922e-03 -3.69815892e-03] [-2.14053516e-03 -1.03179626e-02 -1.11134286e-03] [ 2.14053516e-03 1.03179625e-02 -1.11134283e-03] [-5.79962729e-03 -7.48026222e-04 -1.13350920e-03] [ 5.79962729e-03 7.48026223e-04 -1.13350920e-03] [ 7.99813249e-03 -2.02368252e-03 1.92409437e-03] [-7.99813249e-03 2.02368255e-03 1.92409437e-03] [-1.21876801e-03 -1.77888232e-03 4.83363299e-04] [ 1.21876800e-03 1.77888237e-03 4.83363312e-04] [-3.18745932e-03 2.80761779e-03 -8.80486940e-04] [ 3.18745934e-03 -2.80761783e-03 -8.80486967e-04] [ 3.63598096e-03 1.75013713e-03 -4.05409800e-03] [-3.63598100e-03 -1.75013716e-03 -4.05409797e-03] [ 3.02105201e-03 -7.26759624e-05 4.79601100e-03] [-3.02105202e-03 7.26759450e-05 4.79601098e-03] [-6.94288371e-03 7.85466649e-03 1.76016966e-03] [ 6.94288370e-03 -7.85466649e-03 1.76016969e-03]] Final stress: [-3.95270008e-05 3.00385372e-05 -7.76605674e-05 -3.19453721e-15 3.21581023e-14 1.09361813e-04] Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 20 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 1.39494750e-04 5.43425441e-05 -2.81700197e-05] [-1.39494750e-04 -5.43425308e-05 -2.81700223e-05] [ 1.26524436e-04 1.65239977e-05 8.60126902e-05] [-1.26524436e-04 -1.65239968e-05 8.60126913e-05] [ 2.03659112e-04 -8.32159359e-05 1.59328612e-05] [-2.03659112e-04 8.32159352e-05 1.59328602e-05] [-2.61592252e-04 -5.78467781e-05 6.63733728e-05] [ 2.61592252e-04 5.78467773e-05 6.63733684e-05] [-6.20482005e-05 3.82212749e-05 -1.06292017e-05] [ 6.20482002e-05 -3.82212751e-05 -1.06292011e-05] [ 4.00233614e-05 6.65292568e-05 -5.51851802e-05] [-4.00233613e-05 -6.65292574e-05 -5.51851815e-05] [-9.85712225e-05 -1.85607263e-06 -2.73682329e-06] [ 9.85712228e-05 1.85607191e-06 -2.73682303e-06] [-3.66109847e-04 8.90829375e-05 1.95347666e-04] [ 3.66109847e-04 -8.90829424e-05 1.95347663e-04] [-8.28442575e-06 7.45165243e-05 -2.82698069e-05] [ 8.28442590e-06 -7.45165238e-05 -2.82698060e-05] [-2.71676907e-05 -6.56343377e-05 4.31937087e-05] [ 2.71676908e-05 6.56343384e-05 4.31937085e-05] [ 3.61877624e-04 1.30819613e-05 3.66752137e-05] [-3.61877623e-04 -1.30819618e-05 3.66752144e-05] [-1.85310759e-04 4.66282615e-06 5.60686309e-05] [ 1.85310760e-04 -4.66282797e-06 5.60686327e-05] [-2.99193160e-05 -4.70497966e-05 -1.04696420e-04] [ 2.99193158e-05 4.70497964e-05 -1.04696421e-04] [-5.27097925e-05 -1.07042225e-04 -1.77546528e-04] [ 5.27097920e-05 1.07042227e-04 -1.77546528e-04] [ 2.01045808e-04 4.73987503e-05 2.40465015e-04] [-2.01045808e-04 -4.73987498e-05 2.40465016e-04] [ 4.95218555e-06 -5.56131483e-05 -1.11480421e-04] [-4.95218641e-06 5.56131484e-05 -1.11480422e-04] [-2.50448421e-04 -7.92423882e-05 -7.16836355e-05] [ 2.50448421e-04 7.92423865e-05 -7.16836345e-05] [-1.74544045e-04 2.03883328e-04 7.35412219e-05] [ 1.74544045e-04 -2.03883328e-04 7.35412217e-05] [ 1.45449809e-04 2.70758060e-04 1.31505250e-04] [-1.45449809e-04 -2.70758060e-04 1.31505251e-04] [ 1.74137952e-06 -6.09783504e-05 2.88114082e-04] [-1.74137925e-06 6.09783499e-05 2.88114081e-04] [-1.39925081e-04 -5.08958604e-06 -1.54733494e-04] [ 1.39925081e-04 5.08958565e-06 -1.54733494e-04] [-6.91889828e-05 -3.32167529e-04 -2.71671181e-04] [ 6.91889830e-05 3.32167529e-04 -2.71671181e-04] [ 1.15426422e-04 -4.68443382e-05 1.69392744e-04] [-1.15426422e-04 4.68443369e-05 1.69392744e-04] [-1.20090294e-04 2.14016239e-04 1.90761403e-04] [ 1.20090295e-04 -2.14016238e-04 1.90761401e-04] [ 4.00693141e-05 8.25247762e-05 -1.67520439e-04] [-4.00693157e-05 -8.25247759e-05 -1.67520438e-04] [ 1.31372801e-05 -5.31508041e-05 -2.00633067e-04] [-1.31372811e-05 5.31508030e-05 -2.00633066e-04] [-2.81159760e-05 -6.05739304e-05 2.82188728e-05] [ 2.81159757e-05 6.05739310e-05 2.82188725e-05] [ 9.81271240e-05 -1.34080507e-04 5.78551978e-05] [-9.81271236e-05 1.34080507e-04 5.78551983e-05] [-2.27873110e-04 -1.44151890e-04 -6.65951753e-05] [ 2.27873110e-04 1.44151888e-04 -6.65951762e-05] [ 2.69480488e-04 1.63106026e-04 -2.17816131e-05] [-2.69480488e-04 -1.63106026e-04 -2.17816127e-05] [-2.34583578e-04 -6.79408419e-05 4.30184538e-05] [ 2.34583578e-04 6.79408424e-05 4.30184532e-05] [ 5.81601459e-06 1.51592810e-04 2.99178191e-04] [-5.81601469e-06 -1.51592808e-04 2.99178193e-04] [-2.00667631e-04 1.51852752e-04 -4.12106633e-04] [ 2.00667630e-04 -1.51852750e-04 -4.12106634e-04] [ 5.88201029e-05 2.12292808e-05 2.17430074e-04] [-5.88201018e-05 -2.12292810e-05 2.17430074e-04] [ 6.22595973e-05 8.87085668e-05 -5.05857304e-05] [-6.22595981e-05 -8.87085673e-05 -5.05857300e-05] [ 3.37262423e-04 8.09781900e-05 -1.85163900e-04] [-3.37262424e-04 -8.09781901e-05 -1.85163900e-04] [-3.43910107e-04 1.70966016e-04 1.18422935e-04] [ 3.43910108e-04 -1.70966015e-04 1.18422935e-04] [ 1.17390852e-04 6.38657755e-05 -2.07489836e-04] [-1.17390851e-04 -6.38657757e-05 -2.07489836e-04] [ 1.49370645e-06 2.44800427e-05 8.38007133e-05] [-1.49370707e-06 -2.44800423e-05 8.38007143e-05] [ 1.78983831e-04 4.13915150e-05 -6.09244154e-05] [-1.78983832e-04 -4.13915135e-05 -6.09244148e-05] [-7.07064469e-05 2.29823772e-05 4.61578107e-05] [ 7.07064472e-05 -2.29823769e-05 4.61578105e-05] [ 7.72471359e-05 6.41166553e-05 -1.36267786e-04] [-7.72471353e-05 -6.41166548e-05 -1.36267785e-04] [-1.14271690e-04 1.21822514e-05 -2.32162183e-05] [ 1.14271689e-04 -1.21822500e-05 -2.32162182e-05] [-8.55911315e-05 5.40311969e-06 -2.97600178e-05] [ 8.55911318e-05 -5.40312913e-06 -2.97600169e-05] [ 1.96581968e-04 -4.08792982e-05 -9.10890185e-05] [-1.96581966e-04 4.08792984e-05 -9.10890185e-05] [-3.66497483e-04 -1.01406169e-04 3.22108978e-05] [ 3.66497483e-04 1.01406170e-04 3.22108989e-05] [ 2.92333924e-05 1.12837021e-05 5.66510293e-05] [-2.92333929e-05 -1.12837006e-05 5.66510296e-05] [ 1.49747540e-04 -1.30173448e-05 -1.01807105e-04] [-1.49747540e-04 1.30173430e-05 -1.01807102e-04] [-3.99893949e-05 -6.94586675e-05 1.62914186e-04] [ 3.99893947e-05 6.94586655e-05 1.62914183e-04] [-2.28239787e-04 -1.74824744e-04 -1.90611923e-05] [ 2.28239788e-04 1.74824745e-04 -1.90611925e-05] [ 2.09958487e-04 -1.03400516e-04 5.15626384e-05] [-2.09958487e-04 1.03400516e-04 5.15626384e-05]] Final stress: [-1.98167824e-06 -5.04773651e-07 -9.77777516e-06 2.17510577e-16 -1.98866813e-15 -6.36126809e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-1.35988584e-04 5.63022996e-05 -2.65955112e-05] [ 1.35988584e-04 -5.63023039e-05 -2.65955112e-05] [-1.23981222e-04 1.67911426e-05 8.44001426e-05] [ 1.23981222e-04 -1.67911437e-05 8.44001426e-05] [-1.97367770e-04 -8.24739992e-05 1.65017517e-05] [ 1.97367770e-04 8.24739987e-05 1.65017511e-05] [ 2.59386564e-04 -6.16538135e-05 7.17158819e-05] [-2.59386563e-04 6.16538123e-05 7.17158802e-05] [ 6.18602318e-05 3.74036987e-05 -1.16847830e-05] [-6.18602324e-05 -3.74036983e-05 -1.16847825e-05] [-4.24274932e-05 6.66194018e-05 -5.38958605e-05] [ 4.24274930e-05 -6.66194015e-05 -5.38958604e-05] [ 9.49297520e-05 -4.47806006e-07 1.59483603e-06] [-9.49297515e-05 4.47805548e-07 1.59483777e-06] [ 3.62203623e-04 8.99920449e-05 1.98082348e-04] [-3.62203625e-04 -8.99920423e-05 1.98082350e-04] [ 1.02640376e-05 7.33522363e-05 -2.71470303e-05] [-1.02640374e-05 -7.33522365e-05 -2.71470303e-05] [ 2.13869680e-05 -6.55427840e-05 4.10940011e-05] [-2.13869677e-05 6.55427831e-05 4.10940016e-05] [-3.55185983e-04 1.46497190e-05 3.76135372e-05] [ 3.55185983e-04 -1.46497200e-05 3.76135371e-05] [ 1.80786419e-04 9.46275953e-06 5.55658792e-05] [-1.80786418e-04 -9.46276005e-06 5.55658800e-05] [ 2.96879646e-05 -4.25500234e-05 -1.09207182e-04] [-2.96879652e-05 4.25500233e-05 -1.09207183e-04] [ 4.98586794e-05 -1.10346933e-04 -1.80870099e-04] [-4.98586802e-05 1.10346932e-04 -1.80870099e-04] [-2.00296494e-04 4.77929411e-05 2.36787370e-04] [ 2.00296495e-04 -4.77929418e-05 2.36787370e-04] [-1.72235556e-06 -5.59899467e-05 -1.09897147e-04] [ 1.72235496e-06 5.59899465e-05 -1.09897147e-04] [ 2.43704831e-04 -8.02560223e-05 -7.11852783e-05] [-2.43704831e-04 8.02560218e-05 -7.11852788e-05] [ 1.41636832e-04 -2.65334820e-04 1.30668929e-04] [-1.41636833e-04 2.65334822e-04 1.30668928e-04] [-1.72751306e-04 -2.02372997e-04 7.28393108e-05] [ 1.72751306e-04 2.02372997e-04 7.28393107e-05] [-1.38957853e-04 4.28604184e-06 -1.50369689e-04] [ 1.38957852e-04 -4.28604140e-06 -1.50369688e-04] [ 3.35311731e-06 5.86551917e-05 2.80218233e-04] [-3.35311679e-06 -5.86551917e-05 2.80218234e-04] [ 1.13730030e-04 4.72172208e-05 1.65059770e-04] [-1.13730029e-04 -4.72172196e-05 1.65059770e-04] [-6.79069403e-05 3.28336479e-04 -2.65327855e-04] [ 6.79069401e-05 -3.28336478e-04 -2.65327854e-04] [ 4.11316249e-05 -8.19294891e-05 -1.60359150e-04] [-4.11316251e-05 8.19294886e-05 -1.60359149e-04] [-1.20429217e-04 -2.13039169e-04 1.84910432e-04] [ 1.20429217e-04 2.13039170e-04 1.84910430e-04] [-2.77601838e-05 5.89918361e-05 2.74867402e-05] [ 2.77601830e-05 -5.89918370e-05 2.74867402e-05] [ 1.11406154e-05 5.44430551e-05 -1.98870636e-04] [-1.11406164e-05 -5.44430535e-05 -1.98870635e-04] [-2.32585369e-04 1.36142719e-04 -6.51508920e-05] [ 2.32585368e-04 -1.36142720e-04 -6.51508904e-05] [ 9.52630443e-05 1.35018847e-04 5.37869036e-05] [-9.52630430e-05 -1.35018848e-04 5.37869041e-05] [-2.30601565e-04 6.95070520e-05 4.09294114e-05] [ 2.30601565e-04 -6.95070516e-05 4.09294117e-05] [ 2.64884842e-04 -1.58535985e-04 -2.15094284e-05] [-2.64884842e-04 1.58535985e-04 -2.15094288e-05] [-1.95041106e-04 -1.45400152e-04 -4.03521012e-04] [ 1.95041106e-04 1.45400151e-04 -4.03521012e-04] [ 5.41542221e-06 -1.48120288e-04 2.90021925e-04] [-5.41542248e-06 1.48120287e-04 2.90021926e-04] [ 6.27195814e-05 -9.28440148e-05 -5.08454724e-05] [-6.27195820e-05 9.28440148e-05 -5.08454722e-05] [ 5.77474587e-05 -2.38402498e-05 2.15676286e-04] [-5.77474577e-05 2.38402517e-05 2.15676287e-04] [-3.43320587e-04 -1.65411416e-04 1.19389783e-04] [ 3.43320588e-04 1.65411415e-04 1.19389782e-04] [ 3.32435172e-04 -7.87056798e-05 -1.85750417e-04] [-3.32435172e-04 7.87056812e-05 -1.85750417e-04] [ 1.31899643e-06 -2.23009999e-05 8.41716026e-05] [-1.31899414e-06 2.23010016e-05 8.41716024e-05] [ 1.16358750e-04 -6.33851323e-05 -2.03088836e-04] [-1.16358749e-04 6.33851322e-05 -2.03088835e-04] [-1.73598634e-04 3.92724585e-05 -5.94043620e-05] [ 1.73598634e-04 -3.92724578e-05 -5.94043615e-05] [ 6.65124844e-05 2.21933389e-05 4.51562947e-05] [-6.65124847e-05 -2.21933384e-05 4.51562948e-05] [-7.82977274e-05 6.49414396e-05 -1.36027513e-04] [ 7.82977272e-05 -6.49414399e-05 -1.36027514e-04] [ 1.15195540e-04 1.63092232e-05 -2.61146051e-05] [-1.15195541e-04 -1.63092224e-05 -2.61146047e-05] [ 8.66781215e-05 2.38995658e-06 -3.01700977e-05] [-8.66781213e-05 -2.38995403e-06 -3.01700989e-05] [-1.91563247e-04 -3.94469631e-05 -8.97254420e-05] [ 1.91563248e-04 3.94469632e-05 -8.97254422e-05] [ 3.58063676e-04 -1.01019399e-04 3.31527224e-05] [-3.58063676e-04 1.01019396e-04 3.31527217e-05] [-3.27975854e-05 8.53638045e-06 5.57108336e-05] [ 3.27975853e-05 -8.53637869e-06 5.57108334e-05] [-4.12430354e-05 6.90306243e-05 1.55526952e-04] [ 4.12430338e-05 -6.90306242e-05 1.55526952e-04] [ 1.48181452e-04 1.30850109e-05 -1.02294994e-04] [-1.48181453e-04 -1.30850108e-05 -1.02294993e-04] [ 2.04675119e-04 9.90230294e-05 5.55785432e-05] [-2.04675118e-04 -9.90230293e-05 5.55785441e-05] [-2.27311564e-04 1.75039186e-04 -1.46271325e-05] [ 2.27311564e-04 -1.75039185e-04 -1.46271316e-05]] Final stress: [-1.95195613e-06 -5.52092575e-07 -9.62793347e-06 6.56117071e-16 2.71768710e-15 6.20894449e-06] Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 0 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 1 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 2 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 1 steps. Minimization converged after 7 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90487 0.54163 0.43115 -0. -0. 0.00469] [ 0.54163 0.91153 0.4983 -0.00001 -0.00002 -0.00269] [ 0.43115 0.4983 0.77684 -0. -0.00001 0.00571] [-0. -0.00001 -0. 0.24759 -0. 0. ] [-0. -0.00002 -0.00001 -0. 0.20616 -0.00139] [ 0.00469 -0.00269 0.00571 0. -0.00139 0.07043]] 95%% Error estimate [ASE units]: [[0.00203 0.00128 0.00046 0.00002 0.00042 0.00495] [0.00128 0.001 0.00074 0.00006 0.00046 0.01429] [0.00046 0.00074 0.00024 0.00004 0.00001 0.01203] [0.00002 0.00006 0.00004 0.00068 0.00016 0.00339] [0.00042 0.00046 0.00001 0.00016 0.00019 0.02438] [0.00495 0.01429 0.01203 0.00339 0.02438 0.06982]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.034909 is too big compared to maximum elastic constant component 0.911534 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.005714 Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 31 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 34 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 53 steps. Minimization converged after 57 steps. Minimization converged after 59 steps. Minimization converged after 56 steps. Minimization converged after 59 steps. Minimization converged after 60 steps. Minimization converged after 57 steps. Minimization converged after 59 steps. Minimization converged after 112 steps. Minimization converged after 115 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 57 steps. Minimization converged after 53 steps. Minimization converged after 57 steps. Minimization converged after 62 steps. Minimization converged after 60 steps. Minimization converged after 59 steps. Minimization converged after 112 steps. Minimization converged after 113 steps. Minimization converged after 109 steps. Minimization converged after 112 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 58 steps. Minimization converged after 57 steps. Minimization converged after 66 steps. Minimization converged after 63 steps. Minimization converged after 113 steps. Minimization converged after 110 steps. Minimization converged after 117 steps. Minimization converged after 116 steps. Minimization converged after 57 steps. Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 3.40697553e-03 -2.25330487e-03 1.42518628e-03] [ 1.20172440e-03 2.55059192e-03 -3.03207781e-03] [-2.74152106e-03 6.12259648e-04 -3.43085127e-03] [-6.70941852e-04 1.56138897e-03 2.10939273e-03] [-3.48604981e-03 1.55478621e-04 1.86451334e-03] [-1.12666628e-03 1.19000477e-03 -1.79448995e-03] [ 3.08374064e-03 -4.24768891e-03 2.65581487e-03] [-7.82964630e-04 -1.03052910e-03 1.90903754e-03] [-5.92502415e-03 -3.37132706e-03 1.46020845e-03] [-5.23164716e-03 -3.88867507e-03 -2.42952353e-03] [ 1.43542579e-03 6.71877674e-03 1.00406669e-03] [ 3.63335590e-03 4.96850481e-03 -5.42431443e-04] [ 2.93338666e-03 7.55622571e-04 -7.84808766e-04] [ 2.24577518e-03 7.14902336e-04 2.93576600e-03] [-5.45722052e-04 5.52033260e-04 -2.65249300e-03] [-4.39238684e-03 6.34048778e-04 3.61371579e-03] [ 1.01513114e-04 4.14757237e-04 3.98179792e-03] [-3.11828077e-04 1.31498781e-03 -5.16184797e-03] [ 9.81032833e-05 -2.04354144e-03 -1.04804897e-03] [-4.13593753e-04 -1.98753467e-03 2.74527238e-04] [-1.27320404e-03 4.44510429e-03 -2.16704512e-05] [-2.04090959e-03 4.17853282e-03 1.32645421e-04] [-7.99896061e-04 5.65153841e-04 1.74384714e-04] [-4.32654194e-03 -9.18577501e-03 1.83362566e-03] [ 2.38072632e-03 2.82743572e-03 -3.58096840e-03] [ 1.84414388e-03 1.63953235e-03 -5.70240290e-04] [-2.84462899e-03 1.65169376e-03 4.15184167e-03] [-5.91315479e-03 3.31011670e-03 -5.31374698e-03] [-2.42567866e-03 1.87253649e-03 -1.58732337e-03] [-2.71260971e-04 4.06918130e-04 1.85373375e-03] [ 7.46239079e-03 -2.38764920e-03 1.30738345e-03] [ 7.54340620e-03 -1.01604000e-03 -2.14497912e-03] [-2.30477488e-03 -4.86741406e-04 2.42649048e-03] [-2.17242082e-03 3.88064605e-04 -2.76236802e-03] [-2.37671513e-03 -4.09324404e-03 1.37470565e-03] [ 2.40615461e-03 -2.44188559e-03 -1.37229527e-03] [ 1.32601803e-03 7.24446086e-04 -8.53794947e-04] [ 1.55524774e-03 7.31811673e-04 2.53374351e-03] [-1.83861548e-03 3.69655061e-03 -2.42009629e-03] [-1.85048186e-03 -2.20652399e-04 2.14412338e-03] [-3.28198847e-04 1.11357532e-03 5.39211966e-04] [-1.39739794e-04 1.29467786e-03 -5.77065834e-04] [-1.98207074e-03 -1.17028478e-03 4.19537902e-03] [ 9.92407685e-04 -6.31685208e-04 -1.48899374e-03] [ 1.55553726e-03 6.77466518e-04 -2.70293693e-03] [ 5.12367145e-04 -1.79376038e-03 3.22449341e-03] [-7.39232853e-05 3.75830265e-03 2.42981975e-03] [ 3.16027657e-04 2.33320797e-03 -1.07332394e-03] [ 1.43522843e-03 -3.58015683e-03 -3.63227733e-03] [ 1.47345709e-03 -4.07727413e-03 3.64896308e-03] [-5.88708001e-03 1.71631415e-04 1.23702719e-03] [-9.03272774e-04 -1.65436756e-03 -3.86168644e-04] [ 1.94910043e-03 6.57309357e-04 -3.94343704e-03] [-5.98249643e-04 -7.09890039e-04 2.22890078e-03] [-5.69755997e-03 -6.14352293e-03 4.88717683e-03] [-1.37544354e-03 -3.74959757e-04 -5.50579948e-03] [-1.76384509e-03 3.06498559e-03 -2.60104730e-03] [ 8.49908378e-04 -4.80859650e-04 -1.35357860e-03] [-1.36701822e-03 2.69601041e-03 8.77095512e-04] [ 1.92868305e-03 3.58461593e-03 -1.81078697e-03] [ 3.05982434e-03 -5.16749660e-03 4.34974820e-04] [ 1.44371901e-03 -2.98897716e-03 -1.25548718e-03] [-1.56663906e-03 -3.54441579e-03 -1.51689781e-03] [-7.05332836e-05 -1.02013541e-03 1.59664485e-04] [ 1.59084203e-03 4.56956177e-03 3.26564441e-03] [-1.44939407e-03 5.39349260e-03 -4.31448014e-03] [ 2.64156669e-03 7.68418371e-04 -8.26086164e-04] [ 4.56325999e-03 7.51118339e-05 -2.32067581e-03] [ 2.99305438e-03 -1.90974268e-03 2.03931557e-04] [ 2.05352285e-03 -3.46493818e-03 7.88199786e-04] [-2.36382899e-03 -6.75396038e-04 -1.49460389e-04] [-2.53256974e-04 -4.10357842e-03 -7.07300266e-04] [-4.57208071e-03 -6.44575974e-03 6.66714435e-03] [-2.09119741e-03 -4.43726188e-03 -3.48877392e-03] [-3.11609044e-03 5.40381515e-03 2.29383175e-03] [-1.20449809e-03 7.41845621e-03 2.12359654e-05] [-8.72068522e-04 -1.15867299e-03 -2.12271299e-03] [-7.10403031e-04 -3.56367219e-04 3.32457799e-03] [-9.91163801e-04 2.64915065e-03 2.53610193e-03] [ 3.30826852e-03 5.82199883e-03 2.18304436e-03] [ 4.05345469e-04 -1.68615052e-03 -9.80123335e-04] [ 5.20209213e-04 -1.58714730e-03 1.25825228e-03] [-3.53709474e-03 2.09601993e-03 1.12079948e-03] [-3.06570061e-03 2.30095017e-03 -4.56265425e-04] [-1.62244556e-03 3.48449345e-03 -9.95666188e-04] [ 2.31549367e-03 -2.03890291e-03 -5.33838829e-03] [ 1.06947908e-03 1.06450133e-03 4.17456945e-03] [ 1.99530245e-03 -2.10083643e-03 -5.21557511e-03] [-3.62020868e-04 -3.23967765e-03 2.16981101e-05] [ 8.27788309e-04 -2.57259873e-03 -2.84671339e-04] [-2.04922583e-04 -1.44222956e-03 2.18928706e-03] [-1.13182855e-03 -2.87135130e-03 -3.02208443e-03] [ 3.94068941e-03 -5.62020751e-03 9.59656508e-04] [ 4.97813761e-03 1.60681923e-03 -5.90238285e-05] [-1.41603458e-03 3.53620307e-03 8.36507619e-04] [-1.80866733e-03 2.85472026e-03 -4.32101362e-04] [-1.29859031e-03 -1.16637134e-03 -2.30215707e-03] [ 1.85326380e-03 2.51599587e-03 1.76078021e-03] [ 4.20506861e-03 -1.99677430e-03 1.98888039e-04] [ 5.32379881e-03 2.67498061e-04 1.55320318e-03] [ 1.55103041e-03 2.82739595e-03 9.53868809e-04] [ 5.58102045e-03 -1.72130064e-03 1.02676851e-03]] Final stress: [-1.64128334e-05 -3.25120033e-06 6.28048828e-06 5.24291349e-04 3.76657387e-04 7.06847846e-05] Minimization converged after 178 steps. Minimization converged after 178 steps. Minimization converged after 178 steps. Minimization converged after 136 steps. Minimization converged after 133 steps. Minimization converged after 132 steps. Minimization converged after 132 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 131 steps. Minimization converged after 126 steps. Minimization converged after 125 steps. Minimization converged after 147 steps. Minimization converged after 111 steps. Minimization converged after 110 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 31 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. Minimization converged after 32 steps. Minimization converged after 46 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 54 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 63 steps. Minimization converged after 61 steps. Minimization converged after 58 steps. Minimization converged after 56 steps. Minimization converged after 107 steps. Minimization converged after 112 steps. Minimization converged after 114 steps. Minimization converged after 114 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 51 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. Minimization converged after 58 steps. Minimization converged after 61 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 111 steps. Minimization converged after 108 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.23034156e-03 7.89402301e-04 -1.49071587e-03] [-5.23034156e-03 -7.89402349e-04 -1.49071586e-03] [ 5.61287205e-03 5.69103982e-03 -5.70574002e-04] [-5.61287205e-03 -5.69103981e-03 -5.70574007e-04] [ 2.50742590e-03 -4.43311319e-03 -4.69024303e-03] [-2.50742590e-03 4.43311319e-03 -4.69024303e-03] [-8.26958334e-03 -8.87487635e-03 1.21609610e-03] [ 8.26958335e-03 8.87487635e-03 1.21609611e-03] [ 9.64064618e-04 4.81105838e-03 -3.63376701e-03] [-9.64064619e-04 -4.81105838e-03 -3.63376701e-03] [ 1.09268697e-03 1.33330523e-03 4.77686771e-03] [-1.09268697e-03 -1.33330523e-03 4.77686771e-03] [-6.52789257e-03 1.01561013e-03 -5.72637139e-03] [ 6.52789257e-03 -1.01561014e-03 -5.72637139e-03] [-1.23870616e-02 -1.06063062e-02 -6.10620539e-03] [ 1.23870616e-02 1.06063062e-02 -6.10620539e-03] [ 1.12973132e-03 7.52436381e-03 -8.16598290e-03] [-1.12973132e-03 -7.52436381e-03 -8.16598290e-03] [ 2.67500258e-03 -2.73588080e-04 3.44022294e-03] [-2.67500258e-03 2.73588076e-04 3.44022294e-03] [ 9.01097220e-03 -5.67446314e-03 3.30748573e-04] [-9.01097220e-03 5.67446314e-03 3.30748571e-04] [-6.29727471e-03 3.13871078e-03 4.56968989e-03] [ 6.29727471e-03 -3.13871083e-03 4.56968991e-03] [ 2.67880971e-04 -4.39359264e-04 1.51427282e-03] [-2.67880970e-04 4.39359273e-04 1.51427283e-03] [-1.31304758e-03 9.86775318e-03 1.02026188e-02] [ 1.31304758e-03 -9.86775317e-03 1.02026188e-02] [ 5.81567355e-03 3.57119919e-03 -4.48567807e-03] [-5.81567355e-03 -3.57119919e-03 -4.48567808e-03] [-1.41051261e-04 3.70493239e-03 2.72908861e-03] [ 1.41051261e-04 -3.70493240e-03 2.72908860e-03] [-7.25719858e-03 -5.46553492e-03 -1.03640600e-03] [ 7.25719858e-03 5.46553493e-03 -1.03640600e-03] [-1.07459913e-02 2.23019615e-03 1.16099501e-03] [ 1.07459913e-02 -2.23019614e-03 1.16099501e-03] [-1.28377243e-05 6.41131724e-03 2.58623242e-03] [ 1.28377246e-05 -6.41131724e-03 2.58623242e-03] [ 1.47983136e-03 2.10014664e-03 8.24673154e-03] [-1.47983135e-03 -2.10014665e-03 8.24673153e-03] [-8.31685646e-04 -2.99114164e-03 -4.92495066e-03] [ 8.31685637e-04 2.99114163e-03 -4.92495066e-03] [-3.08342533e-03 -4.77939868e-03 -2.59690620e-03] [ 3.08342534e-03 4.77939869e-03 -2.59690620e-03] [-1.65525417e-03 -5.30154375e-03 6.80256825e-03] [ 1.65525417e-03 5.30154375e-03 6.80256825e-03] [-1.76313109e-03 6.61761992e-03 5.04115002e-03] [ 1.76313109e-03 -6.61761993e-03 5.04115003e-03] [-1.79837676e-03 -8.29992010e-04 -7.69797532e-03] [ 1.79837676e-03 8.29991999e-04 -7.69797533e-03] [ 6.71606684e-05 -4.72823812e-03 -2.98523498e-03] [-6.71606686e-05 4.72823812e-03 -2.98523498e-03] [-5.62531309e-03 -1.40067212e-03 -1.15147364e-03] [ 5.62531309e-03 1.40067213e-03 -1.15147364e-03] [-1.58270304e-04 -3.99056867e-03 2.90246430e-03] [ 1.58270304e-04 3.99056867e-03 2.90246430e-03] [-4.37956375e-03 -2.69600763e-03 -1.67061078e-03] [ 4.37956375e-03 2.69600763e-03 -1.67061078e-03] [ 6.78626636e-03 4.83487788e-03 -3.79691918e-03] [-6.78626636e-03 -4.83487788e-03 -3.79691918e-03] [-4.78678980e-03 -3.98755855e-03 -5.85483129e-05] [ 4.78678980e-03 3.98755855e-03 -5.85483125e-05] [ 2.51976181e-03 1.85602235e-04 4.24820862e-03] [-2.51976182e-03 -1.85602243e-04 4.24820861e-03] [-4.19545623e-03 9.66260936e-03 -1.06024019e-02] [ 4.19545624e-03 -9.66260937e-03 -1.06024019e-02] [-7.33801756e-03 -2.61393125e-03 3.45352358e-03] [ 7.33801756e-03 2.61393125e-03 3.45352358e-03] [-4.25516143e-03 2.60229710e-03 -6.64908999e-03] [ 4.25516143e-03 -2.60229710e-03 -6.64908999e-03] [ 2.10647206e-03 8.51213922e-03 2.19962229e-03] [-2.10647206e-03 -8.51213922e-03 2.19962229e-03] [-9.66740520e-03 3.99302025e-03 3.63531220e-03] [ 9.66740519e-03 -3.99302025e-03 3.63531220e-03] [ 1.82588449e-03 -3.49078774e-03 3.11068388e-03] [-1.82588449e-03 3.49078774e-03 3.11068388e-03] [-6.46646667e-03 5.55937478e-03 8.80886724e-03] [ 6.46646667e-03 -5.55937478e-03 8.80886724e-03] [ 5.36327539e-03 -1.63212282e-03 2.26494065e-03] [-5.36327539e-03 1.63212282e-03 2.26494065e-03] [ 4.48170408e-03 -1.06382541e-02 1.88066284e-04] [-4.48170408e-03 1.06382541e-02 1.88066286e-04] [ 5.20918729e-04 -4.45963184e-03 -2.79525605e-03] [-5.20918729e-04 4.45963184e-03 -2.79525605e-03] [ 1.11363195e-03 7.51623541e-04 -8.51855896e-04] [-1.11363195e-03 -7.51623542e-04 -8.51855897e-04] [-2.72315000e-03 4.29174216e-03 -2.45949119e-03] [ 2.72315000e-03 -4.29174212e-03 -2.45949119e-03] [-1.68197501e-04 8.82916073e-03 -2.65204014e-03] [ 1.68197501e-04 -8.82916073e-03 -2.65204014e-03] [-8.26295291e-03 -2.84070383e-03 4.13980189e-03] [ 8.26295291e-03 2.84070383e-03 4.13980190e-03] [-2.25597796e-03 -2.45617475e-03 1.95411409e-03] [ 2.25597796e-03 2.45617479e-03 1.95411409e-03] [-3.30092068e-05 -1.69976917e-03 -3.99254214e-03] [ 3.30092040e-05 1.69976918e-03 -3.99254215e-03] [-2.30253709e-03 4.51298372e-03 5.00057937e-03] [ 2.30253710e-03 -4.51298371e-03 5.00057938e-03] [-6.62472432e-03 -2.24826150e-03 -2.25767327e-03] [ 6.62472432e-03 2.24826151e-03 -2.25767328e-03] [ 6.50830701e-03 -2.85220682e-03 -1.47455384e-03] [-6.50830702e-03 2.85220683e-03 -1.47455383e-03]] Final stress: [-3.77288250e-04 -5.07426028e-04 -1.94239145e-04 2.37019639e-15 -1.31544704e-16 -1.23605748e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.17337583e-03 6.75337086e-04 -1.49156638e-03] [ 5.17337583e-03 -6.75337070e-04 -1.49156638e-03] [-5.57632079e-03 5.61088891e-03 -5.46220295e-04] [ 5.57632079e-03 -5.61088891e-03 -5.46220293e-04] [-2.50071810e-03 -4.38201370e-03 -4.63906313e-03] [ 2.50071810e-03 4.38201369e-03 -4.63906313e-03] [ 8.20248610e-03 -8.80811749e-03 1.23877331e-03] [-8.20248610e-03 8.80811747e-03 1.23877330e-03] [-9.65826616e-04 4.77211246e-03 -3.59441836e-03] [ 9.65826616e-04 -4.77211246e-03 -3.59441836e-03] [-1.07350908e-03 1.31023796e-03 4.73066540e-03] [ 1.07350908e-03 -1.31023796e-03 4.73066540e-03] [ 6.47216406e-03 1.02548375e-03 -5.66787695e-03] [-6.47216406e-03 -1.02548374e-03 -5.66787695e-03] [ 1.22894732e-02 -1.05100906e-02 -6.04467282e-03] [-1.22894732e-02 1.05100906e-02 -6.04467283e-03] [-1.11301401e-03 7.45505984e-03 -8.07197458e-03] [ 1.11301401e-03 -7.45505984e-03 -8.07197458e-03] [-2.62987364e-03 -3.03266423e-04 3.40422551e-03] [ 2.62987364e-03 3.03266425e-04 3.40422551e-03] [-8.93673392e-03 -5.63307788e-03 3.31945138e-04] [ 8.93673392e-03 5.63307788e-03 3.31945138e-04] [ 6.25489969e-03 3.14472032e-03 4.54270853e-03] [-6.25489969e-03 -3.14472029e-03 4.54270852e-03] [-2.56305378e-04 -3.94985446e-04 1.42548951e-03] [ 2.56305378e-04 3.94985441e-04 1.42548950e-03] [ 1.27123909e-03 9.79220794e-03 1.01021935e-02] [-1.27123909e-03 -9.79220795e-03 1.01021935e-02] [-5.74761817e-03 3.52612439e-03 -4.44239033e-03] [ 5.74761817e-03 -3.52612439e-03 -4.44239033e-03] [ 1.37844495e-04 3.69127973e-03 2.70138383e-03] [-1.37844495e-04 -3.69127973e-03 2.70138383e-03] [ 7.21274436e-03 -5.36238005e-03 -1.03884694e-03] [-7.21274436e-03 5.36238004e-03 -1.03884694e-03] [-2.33017666e-06 -6.34168882e-03 2.58278862e-03] [ 2.33017700e-06 6.34168882e-03 2.58278862e-03] [-1.06162463e-02 -2.19743825e-03 1.13935287e-03] [ 1.06162463e-02 2.19743825e-03 1.13935287e-03] [-7.95412772e-04 2.97921667e-03 -4.89530723e-03] [ 7.95412767e-04 -2.97921667e-03 -4.89530722e-03] [ 1.46015134e-03 -2.07755596e-03 8.16535523e-03] [-1.46015134e-03 2.07755597e-03 8.16535523e-03] [-1.62802667e-03 5.28932981e-03 6.73370280e-03] [ 1.62802667e-03 -5.28932981e-03 6.73370280e-03] [-3.04152199e-03 4.73844873e-03 -2.60345876e-03] [ 3.04152199e-03 -4.73844873e-03 -2.60345876e-03] [-1.77996207e-03 8.19481452e-04 -7.70836161e-03] [ 1.77996207e-03 -8.19481448e-04 -7.70836162e-03] [-1.73986499e-03 -6.55037088e-03 5.04361056e-03] [ 1.73986500e-03 6.55037089e-03 5.04361057e-03] [-5.56980140e-03 1.40197944e-03 -1.14328402e-03] [ 5.56980140e-03 -1.40197945e-03 -1.14328402e-03] [ 8.16219407e-05 4.69788172e-03 -2.97655372e-03] [-8.16219410e-05 -4.69788172e-03 -2.97655372e-03] [-4.39880410e-03 2.68013652e-03 -1.68893594e-03] [ 4.39880410e-03 -2.68013652e-03 -1.68893594e-03] [-1.55606804e-04 3.92971560e-03 2.87969601e-03] [ 1.55606806e-04 -3.92971561e-03 2.87969601e-03] [-4.73420522e-03 3.94624574e-03 -5.03110990e-05] [ 4.73420522e-03 -3.94624574e-03 -5.03110984e-05] [ 6.75141879e-03 -4.80314078e-03 -3.75500740e-03] [-6.75141879e-03 4.80314078e-03 -3.75500740e-03] [-4.16519425e-03 -9.59876783e-03 -1.05124546e-02] [ 4.16519425e-03 9.59876784e-03 -1.05124546e-02] [ 2.51421765e-03 -1.71992114e-04 4.25635589e-03] [-2.51421766e-03 1.71992118e-04 4.25635589e-03] [-4.25908772e-03 -2.53916300e-03 -6.59954848e-03] [ 4.25908772e-03 2.53916300e-03 -6.59954848e-03] [-7.24683691e-03 2.62380328e-03 3.39987056e-03] [ 7.24683691e-03 -2.62380328e-03 3.39987056e-03] [-9.62811076e-03 -3.92021717e-03 3.61194272e-03] [ 9.62811076e-03 3.92021717e-03 3.61194273e-03] [ 2.10578653e-03 -8.38465133e-03 2.18177915e-03] [-2.10578653e-03 8.38465133e-03 2.18177915e-03] [-6.38001172e-03 -5.49244202e-03 8.76643858e-03] [ 6.38001172e-03 5.49244202e-03 8.76643858e-03] [ 1.79832794e-03 3.49161871e-03 3.08403785e-03] [-1.79832794e-03 -3.49161871e-03 3.08403786e-03] [-5.30671792e-03 -1.62898990e-03 2.23865954e-03] [ 5.30671792e-03 1.62898990e-03 2.23865954e-03] [-4.42194567e-03 -1.05432966e-02 1.68535083e-04] [ 4.42194567e-03 1.05432966e-02 1.68535082e-04] [-4.94521040e-04 -4.41146013e-03 -2.79390847e-03] [ 4.94521040e-04 4.41146013e-03 -2.79390847e-03] [-1.06282825e-03 7.33204311e-04 -8.43952739e-04] [ 1.06282825e-03 -7.33204306e-04 -8.43952733e-04] [ 2.70184577e-03 4.37890435e-03 -2.41175504e-03] [-2.70184576e-03 -4.37890436e-03 -2.41175504e-03] [ 1.43666509e-04 8.74223520e-03 -2.60393130e-03] [-1.43666509e-04 -8.74223520e-03 -2.60393130e-03] [ 8.18397997e-03 -2.82135936e-03 4.14256634e-03] [-8.18397997e-03 2.82135936e-03 4.14256634e-03] [ 2.21964635e-03 -2.48097064e-03 1.93295353e-03] [-2.21964635e-03 2.48097062e-03 1.93295353e-03] [-2.28142292e-03 -4.42772329e-03 4.94103152e-03] [ 2.28142292e-03 4.42772329e-03 4.94103153e-03] [-1.64282760e-05 1.72058092e-03 -3.95915275e-03] [ 1.64282764e-05 -1.72058092e-03 -3.95915276e-03] [ 6.47505234e-03 2.82894932e-03 -1.42089222e-03] [-6.47505234e-03 -2.82894932e-03 -1.42089221e-03] [-6.55656317e-03 2.23852632e-03 -2.24221643e-03] [ 6.55656317e-03 -2.23852632e-03 -2.24221644e-03]] Final stress: [-3.76357778e-04 -5.08535025e-04 -1.95186168e-04 2.57588447e-15 -3.56366561e-16 1.22922017e-04] Minimization converged after 45 steps. Minimization converged after 33 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 56 steps. Minimization converged after 60 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.71082063e-03 1.52352313e-03 -2.83713453e-03] [ 1.71082063e-03 -1.52352315e-03 -2.83713453e-03] [-7.81496746e-04 -5.32176069e-03 2.87084936e-04] [ 7.81496746e-04 5.32176069e-03 2.87084936e-04] [ 3.66251537e-03 5.53657597e-03 -1.24267619e-03] [-3.66251537e-03 -5.53657597e-03 -1.24267619e-03] [-1.90778116e-03 -5.29802896e-04 -7.51555549e-04] [ 1.90778116e-03 5.29802900e-04 -7.51555543e-04] [ 1.97683487e-03 3.06852028e-03 3.61278316e-03] [-1.97683487e-03 -3.06852028e-03 3.61278316e-03] [-2.32342092e-03 -1.14629416e-03 1.96320560e-03] [ 2.32342092e-03 1.14629416e-03 1.96320560e-03] [-2.99145652e-03 -2.82988584e-03 1.24169495e-04] [ 2.99145652e-03 2.82988583e-03 1.24169495e-04] [-1.07060814e-02 1.33300023e-03 2.17878168e-03] [ 1.07060814e-02 -1.33300023e-03 2.17878169e-03] [ 4.51523866e-03 5.45148282e-04 8.88371390e-04] [-4.51523866e-03 -5.45148282e-04 8.88371390e-04] [ 2.94510703e-03 2.81524011e-03 7.72056255e-04] [-2.94510703e-03 -2.81524011e-03 7.72056253e-04] [ 9.09327952e-04 -4.77241593e-04 4.75598991e-04] [-9.09327952e-04 4.77241593e-04 4.75598992e-04] [-5.06952155e-03 -3.00190849e-03 4.29177848e-04] [ 5.06952155e-03 3.00190849e-03 4.29177848e-04] [-2.24209931e-04 3.64311533e-04 -4.36475804e-03] [ 2.24209932e-04 -3.64311531e-04 -4.36475804e-03] [ 2.89296042e-03 2.17833310e-03 -2.38997645e-04] [-2.89296042e-03 -2.17833310e-03 -2.38997645e-04] [ 1.10646522e-03 7.43876542e-03 -9.60270842e-03] [-1.10646522e-03 -7.43876542e-03 -9.60270842e-03] [ 4.37560817e-03 -6.72337030e-03 1.31863687e-03] [-4.37560817e-03 6.72337030e-03 1.31863687e-03] [ 4.63961614e-03 1.75536602e-03 -1.61444286e-03] [-4.63961614e-03 -1.75536602e-03 -1.61444286e-03] [ 3.47372020e-03 1.20475222e-03 -2.36324264e-03] [-3.47372020e-03 -1.20475222e-03 -2.36324264e-03] [-1.11355234e-03 -2.55786439e-03 -2.13230168e-03] [ 1.11355233e-03 2.55786439e-03 -2.13230168e-03] [-2.60932921e-03 4.60706083e-03 -3.94979229e-03] [ 2.60932921e-03 -4.60706083e-03 -3.94979229e-03] [-5.53596427e-04 -2.07615542e-03 1.47880993e-03] [ 5.53596426e-04 2.07615542e-03 1.47880993e-03] [-1.79508151e-04 -4.40079843e-04 5.46251802e-03] [ 1.79508151e-04 4.40079844e-04 5.46251802e-03] [-8.87570616e-05 -5.94809014e-03 4.63825898e-03] [ 8.87570614e-05 5.94809014e-03 4.63825898e-03] [-4.65771757e-03 -1.95535745e-03 -7.37024788e-03] [ 4.65771757e-03 1.95535745e-03 -7.37024787e-03] [ 2.19315916e-03 -4.49481558e-03 6.34095921e-03] [-2.19315916e-03 4.49481558e-03 6.34095921e-03] [ 1.89042291e-03 3.13083814e-03 4.78637235e-03] [-1.89042291e-03 -3.13083814e-03 4.78637235e-03] [-4.58104417e-03 1.43385162e-03 -1.16635380e-03] [ 4.58104417e-03 -1.43385162e-03 -1.16635380e-03] [-4.79183560e-04 2.35119936e-03 5.60095035e-03] [ 4.79183559e-04 -2.35119936e-03 5.60095035e-03] [ 7.94000201e-04 -3.91254671e-03 2.91431018e-03] [-7.94000201e-04 3.91254671e-03 2.91431018e-03] [ 3.05486993e-03 -6.08787840e-03 -6.71568814e-03] [-3.05486993e-03 6.08787840e-03 -6.71568814e-03] [-3.37226399e-03 -2.62071136e-04 -2.70745966e-03] [ 3.37226399e-03 2.62071137e-04 -2.70745966e-03] [-7.20399931e-03 -1.97387840e-03 -2.74506584e-03] [ 7.20399931e-03 1.97387839e-03 -2.74506584e-03] [ 2.70117207e-03 2.10696253e-03 2.06445259e-03] [-2.70117207e-03 -2.10696253e-03 2.06445260e-03] [ 9.24402647e-03 -5.98548102e-03 3.52173654e-03] [-9.24402647e-03 5.98548102e-03 3.52173654e-03] [-4.90488496e-03 2.09323935e-03 -1.56348767e-03] [ 4.90488496e-03 -2.09323935e-03 -1.56348767e-03] [ 2.32443187e-03 -9.29494685e-03 4.12464006e-03] [-2.32443187e-03 9.29494685e-03 4.12464006e-03] [ 6.61135539e-04 -4.93040020e-03 -8.26382370e-03] [-6.61135539e-04 4.93040020e-03 -8.26382370e-03] [ 6.43794613e-03 2.13420260e-04 5.09427842e-03] [-6.43794613e-03 -2.13420260e-04 5.09427842e-03] [ 1.45544114e-03 -2.08996914e-03 1.38045267e-03] [-1.45544114e-03 2.08996914e-03 1.38045267e-03] [ 8.49042404e-03 -2.41963644e-03 2.68727963e-03] [-8.49042404e-03 2.41963644e-03 2.68727963e-03] [ 6.76983686e-03 4.24579131e-04 -1.05139410e-03] [-6.76983686e-03 -4.24579131e-04 -1.05139410e-03] [-2.32624396e-03 -4.20817306e-03 -3.57639831e-03] [ 2.32624396e-03 4.20817306e-03 -3.57639831e-03] [ 4.49971739e-03 1.27853936e-03 4.16343171e-04] [-4.49971739e-03 -1.27853936e-03 4.16343168e-04] [ 2.02158822e-03 -2.23946022e-03 -4.40190238e-03] [-2.02158822e-03 2.23946023e-03 -4.40190238e-03] [-8.40017801e-03 -1.44504452e-04 -2.64935264e-03] [ 8.40017801e-03 1.44504452e-04 -2.64935263e-03] [ 3.75851808e-03 -7.65042604e-04 -3.14608228e-04] [-3.75851809e-03 7.65042604e-04 -3.14608229e-04] [ 4.20900282e-03 -1.70528608e-03 1.71779663e-03] [-4.20900282e-03 1.70528608e-03 1.71779663e-03] [-7.62553590e-03 3.41499060e-04 1.64609630e-03] [ 7.62553590e-03 -3.41499058e-04 1.64609630e-03] [ 2.21453407e-03 5.85738284e-03 1.40226185e-03] [-2.21453407e-03 -5.85738284e-03 1.40226186e-03] [-3.13491162e-03 5.54896931e-03 -8.39591195e-04] [ 3.13491162e-03 -5.54896931e-03 -8.39591196e-04] [-4.44893073e-03 1.42820286e-03 5.13560023e-03] [ 4.44893073e-03 -1.42820286e-03 5.13560023e-03]] Final stress: [ 2.44426555e-04 2.70892721e-04 8.01843483e-04 -4.21611568e-16 -1.21825439e-16 -2.88204615e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.71083763e-03 1.52486494e-03 -2.83689825e-03] [-1.71083763e-03 -1.52486493e-03 -2.83689825e-03] [ 7.81633626e-04 -5.32180741e-03 2.87162218e-04] [-7.81633626e-04 5.32180741e-03 2.87162218e-04] [-3.66255651e-03 5.53637168e-03 -1.24239521e-03] [ 3.66255651e-03 -5.53637168e-03 -1.24239521e-03] [ 1.90750355e-03 -5.29940099e-04 -7.51374320e-04] [-1.90750355e-03 5.29940101e-04 -7.51374320e-04] [-1.97684144e-03 3.06857600e-03 3.61286491e-03] [ 1.97684143e-03 -3.06857600e-03 3.61286491e-03] [ 2.32344134e-03 -1.14614195e-03 1.96304719e-03] [-2.32344134e-03 1.14614195e-03 1.96304719e-03] [ 2.99137134e-03 -2.83009070e-03 1.24197378e-04] [-2.99137134e-03 2.83009070e-03 1.24197377e-04] [ 1.07061115e-02 1.33259325e-03 2.17928976e-03] [-1.07061115e-02 -1.33259325e-03 2.17928976e-03] [-4.51525492e-03 5.45186299e-04 8.88444615e-04] [ 4.51525492e-03 -5.45186299e-04 8.88444616e-04] [-2.94514113e-03 2.81544476e-03 7.72096774e-04] [ 2.94514113e-03 -2.81544476e-03 7.72096773e-04] [-9.09174409e-04 -4.77332419e-04 4.75342867e-04] [ 9.09174409e-04 4.77332419e-04 4.75342866e-04] [ 5.06926342e-03 -3.00172785e-03 4.29297558e-04] [-5.06926341e-03 3.00172785e-03 4.29297559e-04] [ 2.24314001e-04 3.64164395e-04 -4.36429821e-03] [-2.24314000e-04 -3.64164392e-04 -4.36429821e-03] [-2.89289682e-03 2.17822001e-03 -2.39375667e-04] [ 2.89289682e-03 -2.17822001e-03 -2.39375665e-04] [-1.10650263e-03 7.43867553e-03 -9.60219172e-03] [ 1.10650263e-03 -7.43867553e-03 -9.60219172e-03] [-4.37569679e-03 -6.72339983e-03 1.31851183e-03] [ 4.37569679e-03 6.72339983e-03 1.31851183e-03] [-4.63983420e-03 1.75516036e-03 -1.61462204e-03] [ 4.63983420e-03 -1.75516036e-03 -1.61462204e-03] [-1.11344216e-03 2.55770247e-03 -2.13235840e-03] [ 1.11344216e-03 -2.55770247e-03 -2.13235840e-03] [ 3.47373576e-03 -1.20469879e-03 -2.36297911e-03] [-3.47373576e-03 1.20469879e-03 -2.36297911e-03] [-5.53889992e-04 2.07613191e-03 1.47883480e-03] [ 5.53889991e-04 -2.07613191e-03 1.47883480e-03] [-2.60953228e-03 -4.60719324e-03 -3.95001094e-03] [ 2.60953228e-03 4.60719324e-03 -3.95001094e-03] [-8.87763629e-05 5.94788384e-03 4.63800751e-03] [ 8.87763629e-05 -5.94788384e-03 4.63800751e-03] [-1.79451639e-04 4.40115587e-04 5.46249810e-03] [ 1.79451639e-04 -4.40115587e-04 5.46249810e-03] [ 2.19294707e-03 4.49512720e-03 6.34148356e-03] [-2.19294707e-03 -4.49512720e-03 6.34148356e-03] [-4.65760550e-03 1.95525765e-03 -7.37030690e-03] [ 4.65760550e-03 -1.95525765e-03 -7.37030690e-03] [-4.58096771e-03 -1.43399654e-03 -1.16653575e-03] [ 4.58096771e-03 1.43399654e-03 -1.16653575e-03] [ 1.89045498e-03 -3.13090771e-03 4.78642102e-03] [-1.89045498e-03 3.13090771e-03 4.78642101e-03] [ 7.94091351e-04 3.91265302e-03 2.91443295e-03] [-7.94091350e-04 -3.91265302e-03 2.91443295e-03] [-4.79228578e-04 -2.35114611e-03 5.60080958e-03] [ 4.79228576e-04 2.35114611e-03 5.60080958e-03] [-3.37220907e-03 2.62212724e-04 -2.70741456e-03] [ 3.37220907e-03 -2.62212724e-04 -2.70741456e-03] [ 3.05491636e-03 6.08787656e-03 -6.71560803e-03] [-3.05491636e-03 -6.08787656e-03 -6.71560803e-03] [ 2.70090401e-03 -2.10685097e-03 2.06461866e-03] [-2.70090401e-03 2.10685097e-03 2.06461866e-03] [-7.20416737e-03 1.97354977e-03 -2.74562329e-03] [ 7.20416737e-03 -1.97354977e-03 -2.74562329e-03] [-4.90471233e-03 -2.09326118e-03 -1.56322190e-03] [ 4.90471233e-03 2.09326118e-03 -1.56322190e-03] [ 9.24422057e-03 5.98536018e-03 3.52205164e-03] [-9.24422057e-03 -5.98536018e-03 3.52205164e-03] [ 6.61916267e-04 4.92977151e-03 -8.26405817e-03] [-6.61916269e-04 -4.92977151e-03 -8.26405817e-03] [ 2.32398225e-03 9.29483991e-03 4.12468770e-03] [-2.32398225e-03 -9.29483990e-03 4.12468770e-03] [ 1.45550734e-03 2.08988982e-03 1.38001489e-03] [-1.45550734e-03 -2.08988982e-03 1.38001489e-03] [ 6.43793069e-03 -2.13527109e-04 5.09427466e-03] [-6.43793069e-03 2.13527109e-04 5.09427465e-03] [-8.49055582e-03 -2.41942129e-03 2.68687513e-03] [ 8.49055582e-03 2.41942128e-03 2.68687513e-03] [-6.76998985e-03 4.24759542e-04 -1.05126584e-03] [ 6.76998985e-03 -4.24759542e-04 -1.05126584e-03] [ 2.32611007e-03 -4.20805475e-03 -3.57645069e-03] [-2.32611007e-03 4.20805475e-03 -3.57645069e-03] [-4.50002498e-03 1.27857941e-03 4.16408931e-04] [ 4.50002498e-03 -1.27857941e-03 4.16408929e-04] [-2.02126081e-03 -2.24017531e-03 -4.40200060e-03] [ 2.02126081e-03 2.24017531e-03 -4.40200060e-03] [ 8.40033977e-03 -1.44559136e-04 -2.64956540e-03] [-8.40033977e-03 1.44559135e-04 -2.64956540e-03] [-3.75862868e-03 -7.65153485e-04 -3.14630414e-04] [ 3.75862868e-03 7.65153486e-04 -3.14630415e-04] [-4.20892616e-03 -1.70563930e-03 1.71791445e-03] [ 4.20892616e-03 1.70563930e-03 1.71791445e-03] [ 2.21497645e-03 -5.85789423e-03 1.40229519e-03] [-2.21497645e-03 5.85789422e-03 1.40229519e-03] [-7.62540192e-03 -3.41619446e-04 1.64587334e-03] [ 7.62540192e-03 3.41619443e-04 1.64587334e-03] [-4.44888460e-03 -1.42819411e-03 5.13520233e-03] [ 4.44888460e-03 1.42819411e-03 5.13520233e-03] [-3.13459485e-03 -5.54903313e-03 -8.39774134e-04] [ 3.13459485e-03 5.54903313e-03 -8.39774131e-04]] Final stress: [ 2.44425754e-04 2.70894892e-04 8.01827261e-04 -1.16211914e-15 -1.25647414e-15 2.88203587e-04] Minimization converged after 119 steps. Minimization converged after 117 steps. Minimization converged after 49 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[ 1.11534695e-03 2.15789913e-03 5.42222016e-04] [ 1.95249617e-04 3.92102575e-04 -3.32282180e-04] [-1.24625986e-03 6.44026692e-04 -4.33142445e-04] [-1.58617231e-03 -2.32961409e-04 -1.23138516e-04] [-1.05760813e-03 4.58802183e-04 -1.54552837e-03] [ 3.41745223e-04 4.44767694e-04 1.75187091e-03] [ 2.28304195e-04 3.31385380e-04 -8.07333279e-04] [-7.93833926e-04 -1.15006444e-03 -7.92997682e-04] [-2.45074360e-03 -3.60974299e-04 3.10955681e-04] [-2.51871831e-03 -8.88775885e-05 1.21225978e-04] [-2.66308225e-03 9.90338586e-04 2.39850619e-03] [-1.48414857e-03 1.10857207e-03 -2.73576220e-03] [ 2.35685659e-04 -2.57144815e-04 2.27146145e-04] [ 2.62441840e-05 -3.98516005e-05 -6.07116788e-04] [ 9.17880905e-04 -2.18458447e-03 1.69891598e-03] [-8.63116363e-04 -1.88814876e-03 -1.78182927e-03] [ 7.00259251e-04 1.33763772e-04 9.55243158e-04] [ 2.63805679e-04 7.62883852e-04 -1.27307996e-03] [-2.75320433e-04 2.49754656e-04 1.31097138e-03] [-2.29785208e-04 6.95002086e-05 -1.08557466e-03] [ 2.93274919e-03 -7.49950066e-04 5.47609879e-04] [ 3.66808216e-03 -9.36925895e-04 -9.56552651e-04] [ 7.56543558e-05 -5.15849086e-04 5.36106152e-04] [-1.76854957e-03 1.68662492e-03 -1.06690830e-03] [ 2.74070780e-03 -3.82592488e-04 7.38112298e-04] [ 1.60558860e-03 1.52662600e-03 1.05145311e-03] [-2.54990508e-04 -8.68256127e-04 -1.32319279e-03] [-2.15270923e-03 -1.42557863e-03 1.23132516e-03] [ 2.03646301e-03 -4.30473125e-04 -2.16369599e-03] [ 2.39855756e-03 -4.28096631e-04 1.94906563e-03] [ 1.72021783e-03 2.08306354e-03 8.59177992e-04] [ 2.90453943e-03 2.25866601e-03 -1.11570597e-03] [ 3.63471498e-04 1.39060194e-03 3.76588405e-04] [ 1.17865267e-03 1.97047395e-03 -2.01489249e-04] [-1.16028957e-03 -2.40874588e-03 2.73733046e-04] [ 7.03858033e-04 -1.53833758e-03 -1.01574589e-03] [-3.28473991e-04 1.29576932e-03 -1.45149479e-03] [-4.64269348e-04 1.99205053e-03 2.22301469e-03] [ 1.02120775e-03 2.79108241e-03 3.72320201e-03] [ 1.84197463e-03 1.67244452e-03 -3.46588478e-03] [ 1.84611797e-03 -1.30819691e-03 -9.45056870e-04] [ 8.13873704e-04 -3.14096862e-03 1.97850955e-03] [ 1.42213945e-03 -3.63743573e-04 5.77444397e-04] [ 2.53432681e-03 -4.25787429e-04 -1.03320381e-04] [ 1.16080163e-04 9.81050127e-04 -2.45207964e-03] [-2.35656265e-04 1.75785064e-04 2.72561163e-03] [-9.72459576e-04 -1.00487724e-03 -8.23725241e-04] [-6.62697071e-04 -2.99929046e-04 8.89413833e-04] [-9.59034398e-04 -8.54438882e-04 4.42229231e-04] [-1.74654868e-03 -2.24557015e-04 -4.22776432e-04] [-2.81210614e-03 8.63955095e-04 1.13824142e-03] [-3.53512771e-05 -3.31586206e-04 -1.86241802e-04] [ 1.36661706e-03 -1.98936498e-03 -1.22058629e-03] [-4.28852110e-04 -2.60338962e-03 1.01714734e-03] [ 8.08806045e-04 -1.16132343e-03 1.04804850e-03] [ 1.47316530e-03 -6.98193098e-04 -5.18989407e-04] [-2.13935845e-04 2.86787074e-04 3.96933950e-04] [-2.30282530e-03 2.06954871e-03 -5.43121491e-04] [-1.34173761e-03 -1.17010955e-03 1.15129686e-03] [ 7.33656548e-04 -2.46910596e-04 -1.39418413e-03] [ 2.75557786e-03 -1.64765595e-03 4.30160831e-04] [ 1.08403996e-03 -8.99846388e-04 -1.38018291e-04] [ 1.67666426e-03 1.34435966e-03 6.02800950e-05] [ 1.39943875e-03 1.58594666e-03 -4.06514109e-04] [ 1.56720942e-05 -3.04664516e-03 -3.48920003e-03] [ 3.10454728e-04 -2.64899636e-03 3.37069372e-03] [-1.78493376e-03 8.82028466e-04 -1.63269296e-03] [-1.49744943e-03 6.23175385e-04 4.94485472e-04] [-1.26686310e-03 -9.52042721e-04 -7.81168904e-04] [-2.14270570e-03 -1.49872250e-03 1.63412902e-03] [-1.22777473e-03 6.36192130e-04 -4.89670362e-04] [-6.61152765e-04 -2.47072224e-04 -3.83490394e-04] [ 1.01115394e-03 1.41111830e-03 9.40381836e-05] [-1.04952393e-04 2.64504207e-04 6.37962928e-04] [-2.34021076e-03 8.98780618e-04 -1.68696632e-03] [-2.03709989e-03 1.42646246e-03 2.47110620e-03] [-3.18530596e-04 -3.87965049e-04 -2.78918621e-03] [-1.30778614e-03 -4.23800916e-05 1.05977339e-03] [-1.28502336e-03 -7.75542463e-04 -7.44479017e-04] [ 3.18210342e-04 -1.58284495e-03 5.02468812e-04] [-6.80816248e-04 -7.55939539e-05 6.64718319e-04] [-2.91738500e-04 1.61793649e-04 -5.35784339e-04] [ 4.25119175e-04 4.66175749e-03 -1.65144733e-03] [ 3.75524309e-04 4.14537688e-03 1.81558197e-03] [-2.23359409e-03 -1.22275582e-03 1.56249945e-03] [-1.44894914e-03 -8.27237877e-05 -6.88372237e-04] [-1.94372116e-03 1.06168092e-03 3.56121660e-04] [-9.17110385e-04 3.73467224e-03 -8.52996637e-04] [ 1.77166313e-03 -1.96160881e-03 -6.19739206e-04] [ 1.23470018e-03 -1.90446183e-03 3.12818345e-04] [ 1.28833307e-03 -2.17220471e-03 1.69954318e-03] [ 1.21156473e-03 -1.95059836e-03 -1.64495575e-03] [-2.56566649e-03 1.20458389e-03 3.00277980e-04] [-2.93931170e-03 -1.21256545e-03 -5.71748645e-05] [ 1.34338056e-03 -2.36145888e-04 -1.34719320e-04] [ 1.96927334e-04 2.46029764e-04 1.18946849e-03] [-6.36339451e-04 6.78534258e-04 -3.53715747e-04] [ 3.29034090e-04 7.85011319e-04 3.91589956e-04] [ 1.64820130e-03 5.52967053e-05 -3.33787274e-03] [ 7.47614175e-04 -1.57704051e-03 3.21057897e-03] [ 1.76750429e-03 6.33565687e-04 5.43172960e-04] [ 1.39919776e-03 6.07005387e-04 -1.68609023e-03]] Final stress: [-1.45567508e-05 6.90707290e-06 -3.08140003e-06 3.17045126e-04 2.47656840e-04 5.28371351e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[-4.99867101e-05 3.62285741e-05 3.77727892e-06] [ 3.28377017e-05 1.93970585e-04 -1.43347430e-05] [ 1.41618042e-04 -3.69904033e-05 3.51829902e-05] [ 2.08350774e-04 -1.31005835e-04 -6.59086796e-05] [ 9.61658941e-05 8.22181816e-06 -1.06780378e-04] [-6.03400641e-05 4.78288633e-05 2.06708074e-04] [ 7.66328652e-05 -1.81750799e-04 2.00925678e-04] [ 9.51851912e-05 -2.82752376e-05 -4.18193212e-05] [ 2.66447375e-04 -3.25857871e-05 -3.88136314e-05] [ 2.47858213e-04 3.31541926e-05 6.62932250e-06] [ 2.67078676e-04 1.38511584e-04 2.10958478e-04] [ 1.27912876e-04 8.30244963e-05 -2.56790075e-04] [-6.17631107e-05 -2.45451894e-05 1.09548301e-04] [-4.19362919e-05 -3.82916302e-05 1.04222990e-04] [-1.91440580e-04 -5.04879153e-05 2.87409477e-04] [ 4.55791418e-05 -2.87630463e-04 -6.69665124e-05] [-1.46714128e-04 4.01196251e-05 1.02992231e-04] [-1.20574458e-04 1.19646458e-04 -4.25709324e-05] [ 7.11728209e-06 -2.67977048e-05 1.08641858e-04] [-1.08519299e-06 4.44597822e-06 -2.27715343e-04] [-2.62584151e-04 -1.99020307e-04 6.56303763e-06] [-3.24321327e-04 -2.12772304e-04 3.52622922e-05] [-5.41233918e-05 1.70349249e-04 5.98142188e-05] [ 1.26904843e-04 -2.12546467e-05 -7.39911960e-05] [-2.23568321e-04 1.29068705e-04 -6.66318452e-05] [-2.36605776e-05 -8.77501031e-05 -1.99544876e-04] [ 4.17928883e-06 -2.20370785e-04 -2.35521826e-04] [ 1.95477639e-04 3.18350492e-05 -6.79946979e-05] [-1.66905326e-04 -5.95483889e-05 -2.13313748e-04] [-1.39738450e-04 -6.74873096e-05 2.31342148e-04] [-5.28141828e-05 1.94898702e-04 6.34971276e-05] [-1.92579596e-04 2.32944507e-04 -1.16361430e-04] [-2.64055302e-05 6.34073588e-05 9.04039355e-05] [-1.54187922e-04 1.16486774e-04 -8.29883863e-05] [ 5.36828083e-05 2.77114405e-04 2.52755964e-04] [ 3.52040635e-05 1.08459750e-04 -9.49447727e-05] [-1.03253195e-04 -1.55282753e-04 -9.30980062e-05] [ 8.82301006e-05 -1.96359728e-04 8.31568736e-05] [ 1.27796051e-05 -3.91787692e-04 2.83809819e-04] [-2.92468571e-04 -1.44695957e-04 -6.50864136e-05] [-2.19939697e-04 3.89084685e-05 -5.13571792e-04] [ 5.34460481e-05 3.03305716e-04 3.92505682e-04] [ 1.68165794e-05 3.26858109e-05 2.70614073e-04] [-6.58579375e-05 1.02107929e-04 -2.60510443e-04] [-2.68363574e-04 -4.89092566e-05 -5.21887856e-05] [-1.22387365e-04 -1.60592824e-05 5.69209255e-05] [ 1.68072721e-04 2.83589203e-06 -1.01769629e-04] [ 1.11261350e-04 -9.23303221e-05 6.11559424e-05] [-1.16961875e-04 4.40720317e-05 2.56783778e-04] [ 6.32855490e-05 -6.09676557e-05 -1.73427362e-04] [ 8.07070769e-05 -2.10771751e-04 8.49198772e-05] [-1.27169594e-04 -9.19977233e-05 -1.99892430e-04] [-9.51622920e-05 8.14629028e-05 -8.42584820e-05] [ 2.41219511e-04 1.09967240e-04 1.12962249e-04] [ 2.02501690e-04 2.26795481e-04 1.78455014e-05] [ 1.98700080e-04 1.96987201e-04 -1.06708610e-04] [-1.18214732e-04 -2.76518436e-05 -6.41833184e-05] [ 3.04077692e-04 -4.32773189e-04 -3.54698994e-05] [-3.90294013e-05 -9.33632212e-05 -3.75010497e-05] [-2.23792603e-04 -1.77348805e-04 5.61748932e-05] [-1.31045535e-04 -1.75033922e-05 -1.61564971e-04] [ 1.20208436e-04 -1.27884307e-04 1.12980950e-04] [-2.27504222e-05 -2.95618481e-04 3.60442585e-04] [ 3.18931732e-05 -3.19390793e-04 -3.79390281e-04] [-1.44217476e-04 1.24625127e-04 -1.45229166e-04] [-2.85986770e-04 1.24077638e-04 3.65972605e-05] [ 2.47515605e-04 -1.46536979e-04 1.48681776e-04] [ 1.39972801e-04 -1.60433630e-05 -8.50285440e-05] [ 1.66000808e-04 3.88778811e-05 8.21579597e-05] [ 1.99094516e-04 6.77341436e-05 -1.65781856e-04] [-5.59191245e-05 9.64090636e-05 1.08767617e-04] [ 8.46168771e-05 -1.20483034e-05 6.71342926e-05] [ 1.69365813e-04 9.75791961e-05 -1.71955175e-04] [ 3.17735282e-04 2.09654867e-04 3.39152682e-05] [ 1.86713290e-04 5.03976556e-07 7.33390693e-05] [ 7.96626278e-05 -7.58855178e-05 -2.43908677e-04] [ 3.46620401e-04 1.13197092e-04 2.39971586e-04] [ 3.51215497e-04 1.27641919e-04 -5.93568445e-05] [ 8.79607684e-05 -1.62162484e-04 -2.47677120e-05] [-1.94931324e-04 -5.51214712e-05 4.55207845e-05] [ 5.57850987e-05 4.87898925e-05 1.35138677e-04] [-4.03652552e-05 6.77959853e-05 -1.17316617e-04] [-9.73218789e-05 4.20745149e-04 -2.22407866e-04] [-4.74689518e-05 2.92456729e-04 1.88351964e-04] [ 4.11319722e-06 5.92092668e-05 4.90348690e-05] [-1.21185842e-05 -7.59295515e-05 -7.83799835e-05] [ 1.97081279e-04 3.19473648e-04 3.84200118e-05] [ 2.57169322e-05 2.78283057e-04 -3.31081427e-05] [-1.62483022e-04 -1.47736791e-04 -5.34291163e-05] [-8.93543471e-05 -1.49701575e-04 2.75498811e-05] [-1.16546475e-04 -2.78392926e-04 1.80200977e-04] [-1.35350260e-04 -1.78799288e-04 -1.17721696e-04] [ 1.65248373e-04 5.15707031e-06 -9.63149872e-06] [ 4.91054190e-04 1.23557711e-04 -5.90288008e-06] [-1.88490733e-04 2.18645422e-04 -7.46931285e-05] [ 5.21710418e-05 2.63472001e-05 -1.43124151e-04] [-8.08341461e-05 -8.46122988e-05 3.76269059e-05] [-1.90439809e-04 -8.08909445e-05 1.81595780e-05] [-2.99691303e-04 -5.28378950e-05 -2.08667458e-05] [-2.27609732e-04 1.10115512e-04 6.96853891e-05] [-2.69398079e-04 3.01305712e-05 5.69649344e-04] [-2.09423309e-04 -4.58931140e-05 -3.02588097e-04]] Final stress: [-2.81710339e-06 -2.73996739e-06 -2.99947102e-06 3.10259025e-04 -2.56668291e-04 -5.93580936e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[-3.05167192e-05 -1.79217392e-04 -3.34280051e-05] [ 9.64461435e-05 -1.18386432e-04 3.47621994e-05] [-2.55562723e-04 1.22438175e-04 -6.33178521e-05] [-1.91942197e-04 -4.13006751e-07 3.09059825e-05] [ 7.77900236e-05 -5.56913305e-05 2.46094136e-04] [-1.31549113e-04 -3.75360242e-05 -1.55984218e-04] [-1.41509277e-04 8.53979775e-05 -8.88681091e-05] [-4.15296938e-05 1.46828466e-04 1.45122213e-04] [-3.22207991e-04 -2.74551889e-05 1.57895239e-05] [-3.32104488e-04 4.32264956e-05 -2.14232750e-05] [-1.88346556e-04 -1.20591417e-04 -3.38609268e-04] [-3.68510085e-04 -1.53161566e-04 2.86439296e-04] [ 2.55401174e-05 3.93174990e-05 5.90580705e-05] [ 5.44236794e-05 3.95051101e-05 8.94646284e-05] [-8.46545568e-05 3.12805254e-04 -1.31973266e-04] [ 2.05603030e-04 1.32415071e-04 3.01672191e-04] [ 9.72116213e-05 -1.39539074e-04 -9.28114296e-05] [ 1.37451506e-04 -4.77349327e-05 1.35064959e-04] [-9.77802250e-06 -9.45241337e-06 -2.32229606e-04] [-1.63700420e-05 7.34824610e-06 1.47036954e-04] [ 4.41893720e-04 2.35526518e-04 -1.73917913e-05] [ 3.51863220e-04 2.15894035e-04 3.96388733e-05] [-1.91087294e-04 -8.33569592e-05 -1.10271097e-04] [ 6.47315595e-05 -7.11660462e-05 6.18945624e-05] [ 1.08570180e-04 2.68467525e-05 -1.21277720e-04] [ 3.19186046e-04 -7.74073913e-05 -2.49390954e-05] [-2.85471070e-04 4.59991322e-05 -3.76139179e-06] [-1.99886362e-05 2.05190585e-04 -2.44761045e-04] [ 2.35683780e-04 7.43119485e-05 2.79982090e-04] [ 2.17608900e-04 7.81956623e-05 -2.72820753e-04] [ 2.72573562e-04 -2.97350257e-04 -1.52810163e-04] [ 1.02641467e-04 -2.65881515e-04 9.90064781e-05] [ 1.80997514e-04 -1.78609408e-04 -6.82558387e-05] [ 4.56520436e-05 -1.24774696e-04 8.53581760e-05] [-3.67148405e-05 -1.51925902e-04 -1.47479564e-04] [-1.00034920e-04 -3.28586718e-04 3.16141738e-04] [-1.11945586e-04 2.65762975e-04 9.21609791e-05] [ 1.21933610e-04 1.94001389e-04 -1.43868524e-04] [ 2.89996557e-04 1.91886162e-04 -1.05443097e-04] [ 1.94253199e-05 4.79728771e-04 3.13697627e-04] [ 1.78543480e-05 -3.86416242e-04 4.98105713e-04] [ 2.41602022e-04 -1.38943755e-04 -5.57077629e-04] [ 6.48993496e-05 -1.33963767e-04 -3.40580561e-04] [-3.73084107e-05 -4.34273517e-05 3.44986126e-04] [ 1.85999044e-04 1.95779516e-05 6.44079175e-05] [ 3.56992876e-04 6.57371061e-05 -5.06729874e-05] [-1.49354874e-04 1.09141278e-04 7.30347751e-05] [-2.25611656e-04 1.65826571e-05 -1.07753359e-04] [-9.30899183e-05 9.81413638e-05 -1.80261391e-04] [ 7.18617859e-05 -2.76599865e-05 2.25297890e-04] [ 1.68818961e-04 1.69625571e-04 -2.27577182e-04] [-1.10760126e-04 3.05783649e-04 1.19741965e-04] [-3.15694352e-04 -1.45344045e-04 1.60534165e-04] [ 8.70968149e-05 -5.21385476e-05 -8.69545333e-05] [-1.23865011e-04 -1.57964038e-04 -7.30311830e-05] [-2.34084526e-04 -2.80594353e-04 -1.64557758e-05] [-1.87045850e-04 3.71758677e-04 4.37846673e-05] [ 1.61374698e-04 4.45221927e-05 -8.19736424e-05] [ 3.19749348e-04 2.30362864e-04 6.94113228e-05] [ 7.34053577e-05 1.28811360e-04 -2.97855368e-05] [-1.45271546e-04 1.77928555e-04 1.59926212e-04] [ 1.65920600e-04 2.62714867e-05 -2.06978228e-04] [-3.19032699e-05 4.08812788e-04 -4.74087820e-04] [ 1.25250665e-05 3.60030438e-04 4.58457227e-04] [ 3.05096060e-04 -1.48314361e-04 6.79199944e-05] [ 1.99928217e-04 -1.82274370e-04 -1.41977266e-04] [-1.69802227e-04 4.73328155e-05 -1.04969120e-04] [-2.98494260e-04 1.78540609e-04 2.11441652e-04] [-2.38935742e-04 -1.07628294e-04 -2.13840818e-04] [-1.91381400e-04 -6.28717191e-05 8.16425315e-05] [ 1.66233419e-05 -8.15941548e-05 5.31351717e-05] [ 4.50890863e-05 -7.14501795e-05 1.19267167e-04] [-3.19455629e-04 -1.77598437e-04 -1.30023089e-05] [-1.64591514e-04 -3.64103415e-05 -1.40979114e-04] [-8.32056021e-05 7.89175424e-05 -3.46733770e-04] [-2.18783243e-04 -8.89756759e-06 1.18744515e-04] [-4.05003597e-04 -1.31153377e-04 -1.36906308e-04] [-3.84936025e-04 -1.54554381e-04 3.16794519e-04] [ 1.47867575e-04 1.31148066e-04 5.63446157e-05] [-1.59937920e-04 1.72592001e-04 -6.99705002e-05] [ 2.16117242e-05 -6.22469795e-05 -1.15203738e-04] [-6.60784638e-05 -3.10306081e-05 1.37431372e-04] [ 5.94083175e-05 -4.22545872e-04 2.39659190e-04] [ 1.03369910e-04 -5.52220752e-04 -2.58627350e-04] [-7.65867414e-05 4.94230471e-05 -8.26768331e-05] [-1.58917758e-04 1.16194890e-05 1.20574215e-04] [-4.91068209e-05 -3.80866073e-04 -5.46607091e-05] [-2.24481888e-04 -3.35058052e-04 4.52059763e-05] [ 1.36344444e-04 2.08065026e-04 2.69583163e-05] [ 2.22009782e-04 2.03056661e-04 -5.93976255e-05] [ 1.68653005e-04 2.42708877e-04 -1.70569603e-04] [ 1.61424283e-04 3.37159174e-04 2.23732354e-04] [-5.08198901e-04 -3.83326206e-05 -1.77626173e-05] [-2.83791471e-04 -8.92753517e-05 1.28825149e-05] [-5.25318956e-05 -7.03965259e-05 -1.24177494e-04] [ 1.78475097e-04 -2.17847692e-04 -4.19777845e-05] [ 2.21761208e-04 7.47146973e-05 -1.33393421e-05] [ 8.03787031e-05 4.91174259e-05 8.72915649e-05] [ 2.75381129e-04 -1.45196387e-04 8.84886774e-05] [ 3.16104041e-04 -1.75382502e-05 -9.68647185e-05] [ 2.64624247e-04 2.40679297e-05 -4.11730088e-04] [ 2.48560407e-04 7.58145806e-05 6.15789037e-04]] Final stress: [-3.19045383e-06 -2.33083554e-06 -3.15243024e-06 -3.10506304e-04 2.56320825e-04 -7.77544328e-06] Minimization converged after 185 steps. Minimization converged after 132 steps. Minimization converged after 136 steps. Minimization converged after 136 steps. Minimization converged after 131 steps. Minimization converged after 63 steps. Minimization converged after 57 steps. Minimization converged after 142 steps. Minimization converged after 140 steps. Minimization converged after 126 steps. Minimization converged after 127 steps. Minimization converged after 110 steps. Minimization converged after 111 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 29 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 28 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 52 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 56 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 115 steps. Minimization converged after 115 steps. Minimization converged after 111 steps. Minimization converged after 111 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 55 steps. Minimization converged after 57 steps. Minimization converged after 58 steps. Minimization converged after 55 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.82571112e-03 -5.61912192e-04 -7.85427460e-04] [-2.82571112e-03 5.61912208e-04 -7.85427464e-04] [ 3.36943495e-03 -4.37241864e-03 -1.50411421e-03] [-3.36943494e-03 4.37241864e-03 -1.50411421e-03] [ 1.83353588e-03 9.32279253e-04 2.82301738e-03] [-1.83353588e-03 -9.32279254e-04 2.82301738e-03] [-4.06691679e-03 6.77705747e-03 -1.24566461e-03] [ 4.06691679e-03 -6.77705747e-03 -1.24566462e-03] [ 8.67851222e-04 -2.38786298e-03 2.57103949e-03] [-8.67851222e-04 2.38786298e-03 2.57103949e-03] [ 8.47264477e-04 1.33750449e-04 -4.09737201e-03] [-8.47264477e-04 -1.33750450e-04 -4.09737202e-03] [-4.10024359e-03 -7.02884915e-05 2.71276918e-03] [ 4.10024359e-03 7.02884926e-05 2.71276918e-03] [-8.03925158e-03 4.67499347e-03 4.36927912e-03] [ 8.03925158e-03 -4.67499347e-03 4.36927911e-03] [-2.72055302e-05 -4.76985787e-03 4.25415579e-03] [ 2.72055308e-05 4.76985787e-03 4.25415579e-03] [ 1.87496755e-03 -3.93857715e-04 -2.44918039e-03] [-1.87496755e-03 3.93857717e-04 -2.44918038e-03] [ 6.49590071e-03 3.53070637e-03 -1.11584558e-03] [-6.49590071e-03 -3.53070637e-03 -1.11584558e-03] [-4.45216593e-03 -5.62700922e-04 -2.39172208e-03] [ 4.45216593e-03 5.62700928e-04 -2.39172208e-03] [ 4.76913863e-04 -3.66163168e-03 1.97259322e-03] [-4.76913864e-04 3.66163168e-03 1.97259322e-03] [-1.08748779e-04 -4.06399732e-03 -7.24661110e-03] [ 1.08748779e-04 4.06399731e-03 -7.24661110e-03] [ 3.92039172e-03 -6.67306007e-04 2.97463420e-03] [-3.92039172e-03 6.67306008e-04 2.97463420e-03] [ 6.13322141e-04 -3.27274311e-03 -2.58773452e-03] [-6.13322142e-04 3.27274311e-03 -2.58773452e-03] [-4.22278209e-03 2.39869513e-03 3.21827739e-04] [ 4.22278209e-03 -2.39869513e-03 3.21827741e-04] [-3.22123689e-03 2.60912146e-03 -1.72865207e-03] [ 3.22123689e-03 -2.60912147e-03 -1.72865207e-03] [ 3.60293944e-03 2.59982238e-03 3.18927136e-05] [-3.60293944e-03 -2.59982239e-03 3.18927135e-05] [-4.41826584e-04 -3.18059896e-04 2.91607814e-03] [ 4.41826582e-04 3.18059896e-04 2.91607814e-03] [-3.54480375e-04 1.69687352e-03 -4.21037246e-03] [ 3.54480377e-04 -1.69687351e-03 -4.21037246e-03] [-4.53014685e-04 -6.90057330e-03 -2.81214428e-03] [ 4.53014686e-04 6.90057330e-03 -2.81214428e-03] [ 1.74376632e-03 -1.30122840e-03 4.74089414e-03] [-1.74376632e-03 1.30122840e-03 4.74089414e-03] [ 3.14762850e-04 -1.49070165e-04 4.32137998e-03] [-3.14762849e-04 1.49070167e-04 4.32137998e-03] [ 1.46893823e-03 3.79285144e-03 -1.09671990e-03] [-1.46893823e-03 -3.79285143e-03 -1.09671990e-03] [ 2.10047530e-03 1.06258461e-03 8.38116125e-04] [-2.10047530e-03 -1.06258461e-03 8.38116124e-04] [-2.49717463e-03 -3.24560142e-03 1.18658015e-03] [ 2.49717463e-03 3.24560142e-03 1.18658015e-03] [ 3.79021587e-03 -1.02829225e-03 1.99600351e-03] [-3.79021587e-03 1.02829225e-03 1.99600351e-03] [-2.36898298e-03 -1.38715003e-03 -1.39550735e-03] [ 2.36898298e-03 1.38715002e-03 -1.39550735e-03] [ 3.46033068e-03 -1.93249661e-03 -1.07093976e-03] [-3.46033068e-03 1.93249661e-03 -1.07093976e-03] [-4.71781437e-03 1.64241579e-03 2.35302718e-03] [ 4.71781437e-03 -1.64241579e-03 2.35302718e-03] [ 1.71590531e-03 5.72853236e-03 7.09897491e-03] [-1.71590531e-03 -5.72853236e-03 7.09897491e-03] [-1.49389639e-03 1.11088135e-03 -3.90420239e-03] [ 1.49389639e-03 -1.11088135e-03 -3.90420239e-03] [ 3.53552307e-03 2.46167076e-03 4.22284809e-03] [-3.53552307e-03 -2.46167076e-03 4.22284809e-03] [ 3.92968226e-03 -1.40485159e-03 -3.18669883e-03] [-3.92968226e-03 1.40485159e-03 -3.18669883e-03] [ 6.02957869e-03 1.63677697e-03 -2.89323796e-03] [-6.02957869e-03 -1.63677696e-03 -2.89323796e-03] [-4.39145597e-03 2.28655164e-03 -6.83964404e-04] [ 4.39145597e-03 -2.28655164e-03 -6.83964405e-04] [ 3.38538307e-03 3.25682874e-03 -5.25497814e-03] [-3.38538307e-03 -3.25682874e-03 -5.25497814e-03] [-1.85367594e-03 -1.92026496e-03 -2.24622917e-03] [ 1.85367594e-03 1.92026496e-03 -2.24622917e-03] [ 3.08408413e-03 1.25372773e-03 1.01255935e-03] [-3.08408413e-03 -1.25372773e-03 1.01255935e-03] [ 3.09959694e-03 8.05033682e-03 4.34949123e-04] [-3.09959694e-03 -8.05033682e-03 4.34949123e-04] [ 2.70719000e-04 2.14177378e-03 1.59371254e-03] [-2.70718999e-04 -2.14177378e-03 1.59371254e-03] [-4.93037068e-04 7.20156697e-04 -2.05324022e-03] [ 4.93037068e-04 -7.20156695e-04 -2.05324022e-03] [-2.32280179e-03 -6.01335196e-03 -3.25275446e-05] [ 2.32280179e-03 6.01335195e-03 -3.25275453e-05] [-8.60047041e-04 -6.90620154e-03 1.38853301e-03] [ 8.60047042e-04 6.90620154e-03 1.38853301e-03] [-5.08807683e-03 3.01384010e-03 -2.54913400e-03] [ 5.08807683e-03 -3.01384010e-03 -2.54913400e-03] [ 4.06928109e-04 1.19856645e-03 -2.17714225e-04] [-4.06928110e-04 -1.19856646e-03 -2.17714225e-04] [ 2.57777275e-04 3.43423647e-03 -2.47193422e-03] [-2.57777274e-04 -3.43423647e-03 -2.47193422e-03] [ 4.83792548e-04 -2.68977232e-03 2.96251455e-03] [-4.83792549e-04 2.68977232e-03 2.96251454e-03] [-3.25030645e-03 -1.23583027e-03 3.04519447e-04] [ 3.25030645e-03 1.23583027e-03 3.04519450e-04] [ 3.44684566e-03 7.81784948e-04 1.82996985e-03] [-3.44684566e-03 -7.81784949e-04 1.82996985e-03]] Final stress: [ 1.69807718e-04 3.52704064e-04 1.20306215e-04 2.10616193e-15 2.81936594e-16 -8.63502347e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.82604607e-03 -5.64031286e-04 -7.86222330e-04] [ 2.82604607e-03 5.64031284e-04 -7.86222329e-04] [-3.36945484e-03 -4.37267657e-03 -1.50407276e-03] [ 3.36945484e-03 4.37267657e-03 -1.50407277e-03] [-1.83348334e-03 9.32323637e-04 2.82306129e-03] [ 1.83348334e-03 -9.32323637e-04 2.82306129e-03] [ 4.06703772e-03 6.77790320e-03 -1.24654307e-03] [-4.06703772e-03 -6.77790320e-03 -1.24654307e-03] [-8.67845610e-04 -2.38795871e-03 2.57143459e-03] [ 8.67845610e-04 2.38795871e-03 2.57143459e-03] [-8.47555913e-04 1.33823991e-04 -4.09781128e-03] [ 8.47555913e-04 -1.33823991e-04 -4.09781128e-03] [ 4.10026396e-03 -7.02901908e-05 2.71261942e-03] [-4.10026396e-03 7.02901902e-05 2.71261942e-03] [ 8.03933248e-03 4.67559044e-03 4.36911212e-03] [-8.03933248e-03 -4.67559044e-03 4.36911211e-03] [ 2.72362762e-05 -4.77024194e-03 4.25448784e-03] [-2.72362771e-05 4.77024194e-03 4.25448784e-03] [-1.87501611e-03 -3.94146025e-04 -2.44926943e-03] [ 1.87501611e-03 3.94146025e-04 -2.44926943e-03] [-6.49621284e-03 3.53084151e-03 -1.11587233e-03] [ 6.49621284e-03 -3.53084151e-03 -1.11587233e-03] [ 4.45270141e-03 -5.64442601e-04 -2.39192432e-03] [-4.45270141e-03 5.64442596e-04 -2.39192432e-03] [-4.77159218e-04 -3.66215861e-03 1.97250968e-03] [ 4.77159218e-04 3.66215861e-03 1.97250968e-03] [ 1.09038582e-04 -4.06365016e-03 -7.24689635e-03] [-1.09038582e-04 4.06365017e-03 -7.24689635e-03] [-3.92077240e-03 -6.67248878e-04 2.97459201e-03] [ 3.92077240e-03 6.67248878e-04 2.97459201e-03] [-6.13307887e-04 -3.27275415e-03 -2.58801742e-03] [ 6.13307888e-04 3.27275415e-03 -2.58801742e-03] [ 4.22298300e-03 2.39938314e-03 3.22058234e-04] [-4.22298300e-03 -2.39938314e-03 3.22058234e-04] [ 3.60301261e-03 -2.60000117e-03 3.17801108e-05] [-3.60301261e-03 2.60000117e-03 3.17801103e-05] [-3.22145047e-03 -2.60930881e-03 -1.72873979e-03] [ 3.22145047e-03 2.60930881e-03 -1.72873979e-03] [-3.54193336e-04 -1.69741540e-03 -4.21002430e-03] [ 3.54193337e-04 1.69741540e-03 -4.21002430e-03] [-4.41772397e-04 3.18536485e-04 2.91659389e-03] [ 4.41772396e-04 -3.18536486e-04 2.91659389e-03] [ 1.74409940e-03 1.30122292e-03 4.74116381e-03] [-1.74409940e-03 -1.30122292e-03 4.74116381e-03] [-4.53136413e-04 6.90091797e-03 -2.81205286e-03] [ 4.53136414e-04 -6.90091797e-03 -2.81205286e-03] [ 1.46912564e-03 -3.79349916e-03 -1.09683534e-03] [-1.46912564e-03 3.79349916e-03 -1.09683534e-03] [ 3.15026521e-04 1.49363710e-04 4.32054650e-03] [-3.15026522e-04 -1.49363710e-04 4.32054650e-03] [-2.49738837e-03 3.24574824e-03 1.18675428e-03] [ 2.49738837e-03 -3.24574823e-03 1.18675428e-03] [ 2.10040928e-03 -1.06282593e-03 8.38218907e-04] [-2.10040928e-03 1.06282593e-03 8.38218907e-04] [-2.36921974e-03 1.38712759e-03 -1.39570289e-03] [ 2.36921974e-03 -1.38712759e-03 -1.39570289e-03] [ 3.79070286e-03 1.02773285e-03 1.99586341e-03] [-3.79070286e-03 -1.02773286e-03 1.99586341e-03] [-4.71805799e-03 -1.64260285e-03 2.35297176e-03] [ 4.71805799e-03 1.64260285e-03 2.35297176e-03] [ 3.46074062e-03 1.93270744e-03 -1.07085353e-03] [-3.46074062e-03 -1.93270744e-03 -1.07085353e-03] [-1.49417948e-03 -1.11131548e-03 -3.90389899e-03] [ 1.49417948e-03 1.11131548e-03 -3.90389899e-03] [ 1.71598678e-03 -5.72837750e-03 7.09964415e-03] [-1.71598678e-03 5.72837750e-03 7.09964415e-03] [ 3.93004691e-03 1.40453452e-03 -3.18720683e-03] [-3.93004691e-03 -1.40453452e-03 -3.18720683e-03] [ 3.53549986e-03 -2.46203316e-03 4.22285144e-03] [-3.53549986e-03 2.46203316e-03 4.22285144e-03] [-4.39159202e-03 -2.28666600e-03 -6.83671786e-04] [ 4.39159202e-03 2.28666600e-03 -6.83671786e-04] [ 6.02970662e-03 -1.63760332e-03 -2.89314149e-03] [-6.02970662e-03 1.63760332e-03 -2.89314149e-03] [-1.85375689e-03 1.92021626e-03 -2.24646778e-03] [ 1.85375689e-03 -1.92021626e-03 -2.24646778e-03] [ 3.38581659e-03 -3.25729750e-03 -5.25518492e-03] [-3.38581659e-03 3.25729750e-03 -5.25518491e-03] [-3.08421653e-03 1.25362499e-03 1.01286576e-03] [ 3.08421653e-03 -1.25362499e-03 1.01286576e-03] [-3.09965887e-03 8.05063572e-03 4.34716882e-04] [ 3.09965887e-03 -8.05063572e-03 4.34716882e-04] [-2.70918072e-04 2.14198714e-03 1.59355647e-03] [ 2.70918073e-04 -2.14198714e-03 1.59355647e-03] [ 4.92932840e-04 7.19954176e-04 -2.05320594e-03] [-4.92932840e-04 -7.19954175e-04 -2.05320594e-03] [ 2.32304879e-03 -6.01222412e-03 -3.22439021e-05] [-2.32304879e-03 6.01222412e-03 -3.22439031e-05] [ 8.60046184e-04 -6.90673126e-03 1.38896432e-03] [-8.60046183e-04 6.90673126e-03 1.38896432e-03] [ 5.08860462e-03 3.01400504e-03 -2.54902684e-03] [-5.08860462e-03 -3.01400504e-03 -2.54902684e-03] [-4.07096541e-04 1.20005845e-03 -2.17792717e-04] [ 4.07096541e-04 -1.20005845e-03 -2.17792717e-04] [ 4.83850233e-04 2.68996578e-03 2.96312644e-03] [-4.83850234e-04 -2.68996578e-03 2.96312644e-03] [ 2.57806225e-04 -3.43505623e-03 -2.47170441e-03] [-2.57806226e-04 3.43505623e-03 -2.47170441e-03] [ 3.44738921e-03 -7.81816290e-04 1.83002014e-03] [-3.44738921e-03 7.81816290e-04 1.83002014e-03] [-3.25004611e-03 1.23541843e-03 3.04870156e-04] [ 3.25004611e-03 -1.23541843e-03 3.04870157e-04]] Final stress: [1.69806415e-04 3.52700854e-04 1.20303669e-04 9.53327975e-16 2.12647092e-16 8.63613580e-05] Minimization converged after 111 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.65680461e-03 1.08494835e-03 8.92719082e-05] [ 1.65680461e-03 -1.08494836e-03 8.92719098e-05] [-1.98989667e-03 2.21941909e-03 2.82120136e-04] [ 1.98989667e-03 -2.21941909e-03 2.82120136e-04] [-1.13337577e-03 -1.21312698e-03 -1.76868323e-03] [ 1.13337577e-03 1.21312698e-03 -1.76868323e-03] [ 2.90282934e-03 -3.62222221e-03 6.79230151e-04] [-2.90282934e-03 3.62222221e-03 6.79230154e-04] [-3.78214229e-04 1.62275290e-03 -1.37014968e-03] [ 3.78214229e-04 -1.62275290e-03 -1.37014968e-03] [-4.34424939e-04 1.32039275e-04 2.04146039e-03] [ 4.34424939e-04 -1.32039275e-04 2.04146039e-03] [ 2.27950680e-03 3.63238852e-04 -2.00542982e-03] [-2.27950680e-03 -3.63238853e-04 -2.00542982e-03] [ 4.41853038e-03 -3.79945746e-03 -2.62168342e-03] [-4.41853038e-03 3.79945746e-03 -2.62168342e-03] [-2.80137007e-04 2.95772485e-03 -2.96943011e-03] [ 2.80137007e-04 -2.95772485e-03 -2.96943012e-03] [-6.65334991e-04 -8.42587073e-05 1.27063361e-03] [ 6.65334992e-04 8.42587059e-05 1.27063360e-03] [-3.41854104e-03 -1.90990679e-03 3.25046726e-04] [ 3.41854104e-03 1.90990679e-03 3.25046726e-04] [ 2.48333931e-03 2.56902279e-04 1.34519941e-03] [-2.48333931e-03 -2.56902288e-04 1.34519941e-03] [-8.66369219e-05 6.09917409e-04 1.05221656e-04] [ 8.66369217e-05 -6.09917406e-04 1.05221661e-04] [ 5.00167112e-04 3.46319897e-03 4.26095039e-03] [-5.00167112e-04 -3.46319897e-03 4.26095039e-03] [-2.20144182e-03 8.37217554e-04 -1.53073311e-03] [ 2.20144182e-03 -8.37217554e-04 -1.53073311e-03] [-7.39815046e-06 1.69987852e-03 1.18421724e-03] [ 7.39815070e-06 -1.69987852e-03 1.18421724e-03] [ 2.65939614e-03 -1.89971039e-03 -5.21290474e-04] [-2.65939613e-03 1.89971039e-03 -5.21290475e-04] [ 7.05136226e-04 -2.24288442e-03 1.07445064e-03] [-7.05136226e-04 2.24288442e-03 1.07445064e-03] [-3.03656184e-03 -8.70228853e-04 2.34862492e-04] [ 3.03656184e-03 8.70228853e-04 2.34862492e-04] [ 3.72772839e-04 6.94023789e-04 -1.94443753e-03] [-3.72772837e-04 -6.94023791e-04 -1.94443753e-03] [ 3.33456886e-04 -4.13265205e-04 3.29156762e-03] [-3.33456887e-04 4.13265204e-04 3.29156762e-03] [-4.69712338e-04 2.62691111e-03 2.11378848e-03] [ 4.69712338e-04 -2.62691110e-03 2.11378848e-03] [-1.01661561e-03 1.61167119e-03 -1.69146771e-03] [ 1.01661561e-03 -1.61167119e-03 -1.69146771e-03] [-4.55785088e-04 7.33883572e-05 -3.05031749e-03] [ 4.55785088e-04 -7.33883588e-05 -3.05031749e-03] [-4.05495058e-04 -2.58915482e-03 1.70620381e-03] [ 4.05495057e-04 2.58915482e-03 1.70620380e-03] [-1.64575195e-03 5.14964063e-04 -3.62856347e-04] [ 1.64575195e-03 -5.14964063e-04 -3.62856346e-04] [ 6.88847949e-04 1.79580925e-03 -1.31975644e-03] [-6.88847949e-04 -1.79580925e-03 -1.31975644e-03] [-1.84103138e-03 8.72331221e-04 -8.05641602e-04] [ 1.84103138e-03 -8.72331220e-04 -8.05641603e-04] [ 9.12853295e-04 9.54715783e-04 1.07353433e-03] [-9.12853295e-04 -9.54715781e-04 1.07353434e-03] [-1.89130475e-03 1.38456830e-03 1.88010526e-04] [ 1.89130475e-03 -1.38456830e-03 1.88010526e-04] [ 2.59573468e-03 -1.75749539e-03 -1.21511621e-03] [-2.59573468e-03 1.75749539e-03 -1.21511621e-03] [-1.68222769e-03 -3.22799420e-03 -4.36611397e-03] [ 1.68222769e-03 3.22799420e-03 -4.36611397e-03] [ 1.55425587e-03 -6.76924443e-04 2.02163128e-03] [-1.55425586e-03 6.76924441e-04 2.02163128e-03] [-1.77074980e-03 -7.93133726e-04 -2.37982379e-03] [ 1.77074980e-03 7.93133726e-04 -2.37982379e-03] [-2.54834204e-03 1.13017839e-03 1.20527508e-03] [ 2.54834204e-03 -1.13017839e-03 1.20527508e-03] [-3.18467996e-03 -1.65261665e-03 1.33293143e-03] [ 3.18467996e-03 1.65261665e-03 1.33293143e-03] [ 1.14359485e-03 -2.47314600e-03 7.86014036e-04] [-1.14359485e-03 2.47314600e-03 7.86014036e-04] [-2.05943662e-03 -1.98332823e-03 3.46319838e-03] [ 2.05943662e-03 1.98332823e-03 3.46319838e-03] [ 5.32064311e-04 1.37023108e-03 1.15098766e-03] [-5.32064311e-04 -1.37023108e-03 1.15098766e-03] [-2.28103726e-03 -4.95896958e-04 3.35492004e-04] [ 2.28103726e-03 4.95896956e-04 3.35492003e-04] [-1.14726722e-03 -4.14860421e-03 -1.13820840e-04] [ 1.14726722e-03 4.14860421e-03 -1.13820839e-04] [ 1.30026599e-05 -1.60905588e-03 -8.49675973e-04] [-1.30026598e-05 1.60905588e-03 -8.49675973e-04] [ 2.47038871e-04 -7.02519530e-05 1.34505098e-05] [-2.47038871e-04 7.02519515e-05 1.34505083e-05] [ 1.23492306e-03 1.34028078e-03 -6.00534415e-04] [-1.23492306e-03 -1.34028078e-03 -6.00534415e-04] [-3.93013120e-04 3.50636534e-03 -7.33392609e-04] [ 3.93013120e-04 -3.50636534e-03 -7.33392608e-04] [ 2.97075697e-03 -1.19301790e-03 1.51742614e-03] [-2.97075697e-03 1.19301790e-03 1.51742614e-03] [ 2.45284628e-04 8.57447258e-05 6.26909018e-04] [-2.45284628e-04 -8.57447182e-05 6.26909018e-04] [-5.75530818e-04 -1.87584984e-03 1.58969749e-03] [ 5.75530818e-04 1.87584984e-03 1.58969749e-03] [ 1.30990025e-04 1.18897352e-03 -1.56876278e-03] [-1.30990025e-04 -1.18897352e-03 -1.56876278e-03] [ 2.37835962e-03 1.21963611e-03 -5.92666726e-04] [-2.37835962e-03 -1.21963611e-03 -5.92666729e-04] [-2.17115070e-03 3.90531038e-04 -9.26998270e-04] [ 2.17115070e-03 -3.90531038e-04 -9.26998267e-04]] Final stress: [-2.17708224e-04 -3.35381059e-04 -1.59177077e-04 1.16449518e-15 1.43469632e-17 4.38180077e-05] Minimization converged after 40 steps. Minimization converged after 33 steps. Minimization converged after 48 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 55 steps. Minimization converged after 54 steps. Minimization converged after 58 steps. Minimization converged after 54 steps. Minimization converged after 110 steps. Minimization converged after 110 steps. Minimization converged after 116 steps. Minimization converged after 116 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[ 2.68706052e-04 -9.94351668e-05 5.90427735e-05] [ 1.62242916e-04 -1.04911476e-04 -7.81304465e-05] [-1.05781571e-04 3.01447855e-06 1.46929397e-04] [-1.13959708e-04 3.58509218e-05 -1.52492015e-04] [-9.61582399e-05 4.45297439e-05 -9.73086963e-05] [ 5.33325526e-05 6.43203908e-05 6.58858796e-05] [-1.18849579e-04 5.20418961e-05 1.16192538e-05] [-2.48450447e-04 6.30174812e-05 -1.73788783e-05] [-8.63702729e-06 -4.99482453e-06 -5.62069324e-05] [ 1.41755208e-06 2.77517403e-05 5.37269622e-05] [-4.00044356e-04 -7.91572250e-05 5.09071859e-05] [-2.83885903e-04 -8.69075449e-05 -4.52107903e-05] [-5.54199244e-05 -1.00147718e-04 -3.88207163e-05] [-5.33008701e-05 -9.29647151e-05 2.38954967e-05] [-1.28767284e-06 8.52102814e-05 -1.06668127e-04] [-1.65270760e-04 8.13162112e-05 4.18418881e-05] [-3.02533754e-05 1.20244947e-04 -3.33585402e-05] [-3.89017616e-05 1.39304662e-04 9.08028231e-07] [ 1.09384999e-04 3.29086989e-05 -5.70818640e-05] [ 1.07383014e-04 1.48679838e-05 7.08638176e-05] [ 1.68584024e-05 -4.77111982e-05 6.76998441e-05] [ 2.84198666e-05 -7.20137253e-05 -4.26330045e-05] [ 1.47325941e-04 3.27095123e-05 -1.64569382e-04] [-6.59172428e-05 2.42355668e-05 1.80447496e-04] [ 1.66011901e-04 -1.56243245e-04 -1.45207334e-04] [ 5.17875492e-05 -1.79034316e-04 9.68936681e-05] [ 7.93510105e-05 9.77535616e-05 -1.58386924e-04] [-1.00663057e-04 6.68478051e-05 2.42168008e-04] [ 5.06853517e-05 -1.34544040e-04 -4.19982703e-05] [ 9.16043081e-05 -1.13012609e-04 4.17728505e-05] [-1.00347182e-04 -2.66066537e-05 1.96824855e-04] [-4.16608587e-05 -1.98064288e-05 -2.14373158e-04] [ 3.71981902e-05 1.27889087e-05 -3.54440131e-05] [ 8.73590365e-05 -1.28895221e-07 4.98215422e-05] [ 1.64981245e-05 -5.13727284e-06 1.74910087e-04] [ 1.37374584e-04 6.19319524e-05 -2.23211894e-04] [-3.04713248e-06 -7.24762617e-05 9.25322039e-05] [-1.37104176e-04 -2.90943810e-05 -3.73366161e-05] [ 6.43490893e-05 1.93805477e-04 -1.22720475e-04] [ 1.63136729e-04 6.48164727e-05 1.04529231e-04] [ 2.17831356e-05 -9.41170841e-05 1.69686455e-04] [-3.67107664e-05 -2.08450314e-04 -1.51396173e-04] [ 6.67858584e-05 -1.67335443e-04 -1.30388964e-04] [ 1.28233418e-04 -2.15737869e-04 1.44982400e-04] [ 1.74571888e-04 5.65714308e-05 -1.28878838e-04] [ 9.02995978e-05 -1.93982499e-05 1.24925067e-04] [-1.30360133e-04 5.78506488e-06 4.84154510e-04] [-1.30400669e-04 -1.46961701e-05 -4.30319845e-04] [ 7.43780434e-05 -1.22632441e-05 6.13766327e-05] [ 4.66278503e-05 -3.04510667e-06 -1.13056984e-04] [-4.81329683e-05 1.57148529e-04 4.11044787e-05] [ 1.56037802e-04 4.98077565e-05 3.24267395e-05] [-4.66178057e-05 -1.94470713e-04 -2.03402317e-04] [-2.64570015e-04 -2.53358998e-04 1.50207333e-04] [-2.41404270e-04 1.30438262e-04 1.07668678e-04] [-1.67828210e-04 3.04232489e-04 -7.94276063e-05] [ 2.40556153e-05 1.09571256e-04 -1.62638061e-04] [-1.16410585e-04 2.23780029e-04 8.95662113e-05] [ 1.23576353e-04 -5.23332326e-05 1.66797466e-04] [ 3.30870235e-04 5.11082269e-05 -2.17146408e-04] [ 1.22107429e-04 -4.27544819e-05 -1.27971532e-04] [-9.38358648e-05 6.65535784e-05 1.70021535e-04] [ 2.02990786e-04 2.08166656e-06 2.27083393e-04] [ 2.10813639e-04 2.03656888e-05 -2.60086055e-04] [ 1.01074689e-04 4.39455694e-05 -1.19253884e-05] [ 1.02772015e-04 1.05365351e-04 2.77244059e-05] [ 1.65526345e-04 -8.90163396e-05 -2.73148800e-04] [ 2.50511814e-04 -1.59853739e-04 1.32858240e-04] [ 4.88683972e-05 8.05718850e-05 2.39750757e-05] [-3.85635752e-06 2.30108556e-05 5.90139927e-05] [ 5.35235891e-06 1.80836125e-05 -5.72808904e-05] [ 8.70897706e-05 -1.29449683e-04 -1.27797554e-06] [ 2.06875116e-04 -5.27342228e-05 -2.35593282e-05] [ 8.13166201e-05 -1.45829508e-04 1.15424053e-04] [ 8.60898527e-05 9.75778927e-05 5.76639609e-05] [ 1.54019300e-04 1.89712877e-04 4.21743531e-05] [-2.19598767e-05 -5.01466574e-05 -1.25500528e-04] [-6.61657764e-05 -1.48025348e-05 7.81732408e-05] [-2.47182386e-04 -7.75524901e-05 -1.43169332e-04] [-8.94532661e-05 -1.77032141e-05 1.91915633e-04] [-3.04516178e-05 -1.38944602e-04 -9.72023020e-05] [-1.74561774e-05 -1.45265186e-04 8.61259836e-05] [ 3.65554143e-05 -7.68179024e-05 6.50870044e-05] [ 1.36537894e-05 -5.17558186e-05 -6.71993809e-05] [-1.94975220e-04 4.82883695e-05 3.14646377e-05] [-3.71139465e-05 3.55954658e-05 -7.23701976e-05] [-1.19645368e-04 -1.45997942e-04 -3.66599944e-05] [ 2.46399977e-05 -1.30102016e-04 2.93237877e-05] [-1.06249461e-04 2.00964019e-05 4.36147175e-05] [-1.09362587e-04 5.43926554e-05 -2.78918904e-05] [ 4.45144371e-06 1.55441840e-04 -7.02746439e-05] [-2.28487788e-05 1.25399451e-04 7.10411162e-05] [-2.50755414e-04 3.24103778e-05 3.37863116e-05] [-2.41535812e-04 2.62686375e-05 -1.94421183e-05] [ 1.58449097e-04 7.61040738e-05 -2.64883420e-05] [ 6.04276188e-05 8.56595824e-05 5.65728921e-05] [ 4.54388231e-05 1.52735669e-05 9.13067869e-05] [ 1.31624465e-04 7.41915182e-05 -7.08293528e-05] [-3.28716376e-05 -2.00509573e-05 -1.16919936e-04] [-8.04671893e-05 -6.31784217e-05 1.85717278e-04] [-1.67381220e-04 2.36658254e-04 -9.02461109e-05] [-9.33515232e-05 1.70728931e-04 3.84525355e-05]] Final stress: [-1.89558214e-06 -1.97629292e-06 -3.04144257e-06 1.93267516e-04 1.61050931e-04 5.86246050e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[-4.07523428e-04 -2.02701536e-04 7.28807083e-05] [-2.67842714e-04 -1.41270261e-04 -1.11843231e-04] [ 1.02868672e-04 4.37203571e-05 1.86440436e-04] [ 1.30861374e-04 1.09502129e-04 -2.00961768e-04] [ 1.38065458e-04 5.83316903e-05 -1.27549546e-04] [-4.63379735e-05 9.75671328e-05 7.36448748e-05] [ 2.52389791e-04 8.18714262e-05 2.91630932e-05] [ 3.63812110e-04 1.14868431e-04 -3.48293643e-05] [ 1.30227355e-05 -6.78012227e-05 -1.01839909e-04] [-4.39921873e-06 -1.10497214e-05 8.66062576e-05] [ 5.22383208e-04 -1.01341416e-04 6.05204509e-05] [ 3.74369517e-04 -1.20224180e-04 -3.79736405e-05] [ 6.53900521e-05 -1.32234107e-04 -2.07655629e-05] [ 5.29320028e-05 -1.18895308e-04 1.79059432e-05] [ 6.31405484e-05 1.13461344e-04 -1.85075749e-04] [ 2.59780220e-04 7.36570726e-05 5.62806310e-05] [ 4.33321436e-05 1.72589733e-04 -6.30870042e-05] [ 6.73455932e-05 1.97241865e-04 2.09649744e-05] [-1.32226841e-04 3.92735861e-05 -1.08409246e-04] [-1.37043930e-04 1.58359249e-05 1.20523310e-04] [-1.60050597e-05 5.05803334e-05 1.23761368e-04] [-2.14270914e-05 -4.37351356e-06 -6.56247198e-05] [-1.85850533e-04 6.21525161e-05 -2.32257946e-04] [ 8.26853109e-05 -5.66802138e-05 2.74239170e-04] [-1.89031341e-04 -2.14464162e-04 -1.93410462e-04] [-8.02290994e-06 -3.03676774e-04 6.95930136e-05] [-9.44275964e-05 1.08748247e-04 -2.26772186e-04] [ 1.22708669e-04 9.84011996e-05 3.79866736e-04] [-5.73963548e-05 -1.89745550e-04 -4.69271951e-05] [-6.60055662e-05 -1.59476695e-04 3.81247174e-05] [ 1.12068869e-04 -5.31242787e-05 2.65313845e-04] [ 2.99217927e-05 -4.43567522e-05 -2.86190293e-04] [-5.23498890e-05 4.97014002e-05 -5.42051298e-05] [-1.36556703e-04 2.88049561e-05 7.10222507e-05] [ 1.79459108e-04 -6.91202734e-05 -8.15232174e-05] [ 5.28783213e-06 -1.27572653e-04 1.54212009e-04] [-1.82874014e-04 8.79184904e-05 -2.79085634e-04] [-3.62990155e-05 -4.46314674e-06 2.33609049e-04] [-1.26839317e-05 -2.09564333e-04 -2.50459227e-04] [-1.39336528e-04 -4.14465660e-05 3.14023476e-04] [-4.01646158e-04 -8.06055915e-07 1.46101884e-04] [-1.83887199e-04 2.13428827e-04 -2.17187655e-04] [-1.22207797e-04 -4.24104739e-05 1.43570330e-04] [-2.24054649e-04 6.06285622e-05 -1.48060993e-04] [-1.06317837e-04 -2.93782153e-04 1.98077852e-04] [-3.65275294e-05 -2.25683840e-04 -1.81433654e-04] [-1.24214030e-04 -2.23996577e-05 -1.92120640e-04] [-1.52993259e-04 -5.08842363e-05 8.65552757e-05] [ 2.54044721e-04 -3.83242681e-05 -6.33841951e-04] [ 2.45909466e-04 -1.03598655e-05 7.52825323e-04] [ 3.25319568e-04 -3.61562248e-04 2.01782456e-04] [ 1.93393749e-05 -3.01848184e-04 -2.73077451e-04] [-1.88677890e-04 6.18872197e-05 6.29511476e-05] [ 7.75387228e-05 1.94601390e-04 2.87909335e-05] [ 2.38926919e-04 3.20658769e-04 1.30286133e-04] [ 1.73890852e-05 1.79161488e-04 -2.26866852e-04] [ 2.07587052e-04 4.69519319e-04 -1.35667249e-04] [ 3.52845717e-04 1.57964339e-04 1.22413919e-04] [ 1.19291661e-04 9.19639675e-05 2.56124725e-04] [-1.58098187e-04 -5.47031808e-05 -2.00815572e-04] [-4.34357514e-04 9.39500436e-05 -3.06101911e-04] [-1.57882861e-04 -3.45500620e-05 2.32899060e-04] [-2.70885329e-04 1.17157338e-04 8.59431788e-05] [-2.21983926e-04 6.60447980e-05 -3.47718551e-05] [-3.60796076e-04 2.71065722e-05 -3.24366083e-04] [-4.05163077e-04 4.31704115e-05 2.25324582e-04] [-1.34159877e-05 1.32551848e-05 3.13907304e-05] [-7.82262201e-05 9.41459752e-05 4.57483851e-05] [-3.96975884e-04 -2.51296795e-04 1.72111105e-04] [-2.75351699e-04 -1.65316994e-04 -3.75847077e-04] [-1.15907265e-04 -1.70107481e-04 1.50637396e-04] [-2.78919902e-04 -9.80636150e-05 -7.37688451e-06] [-1.66304187e-04 -2.04885417e-04 -1.53424909e-05] [-4.91960667e-05 2.72606423e-05 -4.60199619e-05] [ 4.06654616e-05 -3.42405004e-05 1.24495282e-04] [-1.68442986e-05 -7.74624386e-05 -1.67741418e-04] [-2.99022688e-04 2.83013823e-04 5.81248464e-05] [-2.03522517e-04 1.69856891e-04 1.04417289e-04] [ 3.39864918e-04 -1.03927904e-04 -2.02824106e-04] [ 1.41351093e-04 3.18844383e-05 3.15052641e-04] [ 1.11841481e-04 -2.37983082e-04 -1.94500008e-04] [ 8.41956756e-05 -2.41001617e-04 1.65872469e-04] [-2.92848824e-05 -1.12020444e-04 1.44235605e-04] [ 2.38649977e-07 -6.42546047e-05 -1.40354471e-04] [ 2.36544378e-04 8.53780581e-05 5.01893482e-05] [ 7.67661902e-05 3.27354112e-05 -1.39629240e-04] [ 3.29233797e-04 -1.87113187e-04 -2.80212178e-05] [ 5.42629269e-05 -1.97564589e-04 2.32072628e-05] [ 2.01299260e-04 5.31286231e-05 9.36657408e-05] [ 2.02466202e-04 1.01001919e-04 -6.27489363e-05] [ 2.76157793e-05 2.60437872e-04 -1.05725110e-04] [ 6.00272460e-05 2.17224209e-04 1.00267014e-04] [ 3.77864741e-04 2.67198130e-05 4.04111379e-05] [ 4.70988785e-04 1.03120611e-04 -2.00246048e-05] [-1.94395399e-04 9.64174185e-05 -1.52512212e-04] [-5.16283004e-05 -5.46950786e-06 1.70283079e-04] [-6.45379442e-05 1.26912659e-04 6.75277608e-05] [-2.07764694e-04 1.41533447e-04 9.36336060e-06] [ 1.55708390e-04 2.24140916e-04 8.98907380e-05] [ 2.58376286e-04 3.18959681e-04 -1.73700688e-04] [ 9.63071914e-05 -7.03599141e-05 2.60709373e-04] [ 7.89961467e-05 -7.66334976e-05 -1.24472351e-04]] Final stress: [-1.78674353e-06 -2.01459160e-06 -3.07604154e-06 1.93198033e-04 -1.61113950e-04 -7.48078210e-06] Minimization converged after 188 steps. Minimization converged after 178 steps. Minimization converged after 136 steps. Minimization converged after 138 steps. Minimization converged after 137 steps. Minimization converged after 137 steps. Minimization converged after 56 steps. Minimization converged after 53 steps. Minimization converged after 144 steps. Minimization converged after 141 steps. Minimization converged after 142 steps. Minimization converged after 143 steps. Minimization converged after 109 steps. Minimization converged after 110 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 22 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 22 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 0.00658536 -0.00427125 -0.00194848] [-0.00658536 0.00427125 -0.00194848] [ 0.00607132 0.00266574 -0.00461168] [-0.00607132 -0.00266574 -0.00461168] [ 0.00648806 0.00275143 -0.00897572] [-0.00648806 -0.00275143 -0.00897572] [-0.00995221 0.00039721 -0.0069556 ] [ 0.00995221 -0.00039721 -0.0069556 ] [ 0.0014378 0.01339182 -0.00598697] [-0.0014378 -0.01339182 -0.00598697] [-0.00069944 -0.0065064 0.00230492] [ 0.00069944 0.0065064 0.00230492] [-0.00657289 0.00328028 -0.00443161] [ 0.00657289 -0.00328028 -0.00443161] [-0.01249721 -0.00576229 0.00687501] [ 0.01249721 0.00576229 0.00687501] [ 0.00101278 0.00288555 -0.00578515] [-0.00101278 -0.00288555 -0.00578515] [-0.00201274 -0.00536852 0.00428697] [ 0.00201274 0.00536852 0.00428697] [ 0.01147097 -0.00977792 0.00885543] [-0.01147097 0.00977792 0.00885543] [-0.0094573 0.00662702 -0.0001372 ] [ 0.0094573 -0.00662702 -0.0001372 ] [ 0.00154525 -0.00812254 0.00463577] [-0.00154525 0.00812254 0.00463577] [ 0.00114566 0.00903922 -0.00372228] [-0.00114566 -0.00903922 -0.00372228] [ 0.00515833 0.01116608 -0.00534052] [-0.00515833 -0.01116608 -0.00534052] [-0.00030506 -0.01047895 0.0048772 ] [ 0.00030506 0.01047895 0.0048772 ] [-0.01218707 -0.00453687 -0.00151568] [ 0.01218707 0.00453687 -0.00151568] [-0.01067693 0.00491866 0.00362253] [ 0.01067693 -0.00491866 0.00362253] [-0.00119146 0.00508188 0.0094833 ] [ 0.00119146 -0.00508188 0.0094833 ] [-0.00050097 0.00811182 0.00700839] [ 0.00050097 -0.00811182 0.00700839] [-0.0047735 -0.00500471 -0.00244346] [ 0.0047735 0.00500471 -0.00244346] [-0.00616219 -0.01645443 -0.0066503 ] [ 0.00616219 0.01645443 -0.0066503 ] [-0.00265831 0.00569469 0.01098605] [ 0.00265831 -0.00569469 0.01098605] [-0.0031623 0.00551483 0.01113058] [ 0.0031623 -0.00551483 0.01113058] [ 0.00101103 0.00081763 -0.01198364] [-0.00101103 -0.00081763 -0.01198364] [-0.00131587 -0.00064256 -0.01021914] [ 0.00131587 0.00064256 -0.01021914] [-0.00579996 -0.00282813 -0.00372498] [ 0.00579996 0.00282813 -0.00372498] [ 0.00336168 -0.0039472 0.01452068] [-0.00336168 0.0039472 0.01452068] [-0.01302471 0.00343594 0.00489349] [ 0.01302471 -0.00343594 0.00489349] [ 0.0035354 0.01073176 -0.00370439] [-0.0035354 -0.01073176 -0.00370439] [-0.01154554 -0.00162596 0.00098831] [ 0.01154554 0.00162596 0.00098831] [-0.00465435 0.00102722 0.01230082] [ 0.00465435 -0.00102722 0.01230082] [-0.00604879 0.01511725 -0.01136344] [ 0.00604879 -0.01511725 -0.01136344] [ 0.00070521 -0.00542317 0.00104439] [-0.00070521 0.00542317 0.00104439] [-0.00566978 0.00192587 -0.00503952] [ 0.00566978 -0.00192587 -0.00503952] [ 0.0083516 0.0039968 -0.00955018] [-0.0083516 -0.0039968 -0.00955018] [-0.02176263 -0.00304799 -0.00029058] [ 0.02176263 0.00304799 -0.00029058] [ 0.00188581 -0.00159363 -0.00621211] [-0.00188581 0.00159363 -0.00621211] [-0.00171455 0.0004113 0.00790954] [ 0.00171455 -0.0004113 0.00790954] [ 0.00758535 0.00278073 0.00518202] [-0.00758535 -0.00278073 0.00518202] [ 0.00276215 0.0043197 0.00162867] [-0.00276215 -0.0043197 0.00162867] [-0.00098844 0.00236569 -0.00419283] [ 0.00098844 -0.00236569 -0.00419283] [-0.00941785 -0.00164421 -0.00434658] [ 0.00941785 0.00164421 -0.00434658] [-0.00382714 0.00352145 -0.00641519] [ 0.00382714 -0.00352145 -0.00641519] [ 0.0019874 -0.00509243 -0.00041638] [-0.0019874 0.00509243 -0.00041638] [-0.0124202 -0.0011724 0.00178541] [ 0.0124202 0.0011724 0.00178541] [ 0.00382947 -0.001545 0.00592756] [-0.00382947 0.001545 0.00592756] [ 0.00711709 -0.00390372 -0.00156671] [-0.00711709 0.00390372 -0.00156671] [ 0.0020553 -0.00233308 0.00245504] [-0.0020553 0.00233308 0.00245504] [-0.0049308 -0.00143319 0.00012647] [ 0.0049308 0.00143319 0.00012647] [ 0.01275833 -0.00120223 0.00470174] [-0.01275833 0.00120223 0.00470174]] Final stress: [ 9.95987290e-05 2.50383884e-04 1.95249147e-04 1.70620500e-15 8.41154286e-16 -2.29692683e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-7.20240300e-03 -6.00105919e-03 -1.54983148e-03] [ 7.20240300e-03 6.00105920e-03 -1.54983148e-03] [-6.55931506e-03 3.29186910e-03 -5.59367754e-03] [ 6.55931506e-03 -3.29186910e-03 -5.59367754e-03] [-4.72351741e-03 1.27110228e-03 -7.65949793e-03] [ 4.72351741e-03 -1.27110228e-03 -7.65949793e-03] [ 1.15107497e-02 1.50322014e-03 -8.79273640e-03] [-1.15107497e-02 -1.50322015e-03 -8.79273641e-03] [-7.98490497e-04 1.59465051e-02 -6.73060971e-03] [ 7.98490497e-04 -1.59465051e-02 -6.73060971e-03] [-4.84725626e-04 -5.90002681e-03 3.83526451e-04] [ 4.84725627e-04 5.90002681e-03 3.83526452e-04] [ 6.58133986e-03 1.59568680e-03 -3.48555220e-03] [-6.58133986e-03 -1.59568680e-03 -3.48555220e-03] [ 1.15236227e-02 -2.76705409e-03 6.81210512e-03] [-1.15236227e-02 2.76705408e-03 6.81210511e-03] [-1.32349939e-03 2.20854708e-03 -5.34052234e-03] [ 1.32349939e-03 -2.20854708e-03 -5.34052234e-03] [ 2.29041762e-03 -6.03049535e-03 2.47764882e-03] [-2.29041762e-03 6.03049535e-03 2.47764883e-03] [-1.28202534e-02 -1.19179137e-02 9.09749752e-03] [ 1.28202534e-02 1.19179137e-02 9.09749752e-03] [ 1.29684753e-02 2.03192270e-03 -2.75202120e-03] [-1.29684753e-02 -2.03192270e-03 -2.75202120e-03] [-3.25086196e-03 -6.71109025e-03 4.57800529e-03] [ 3.25086196e-03 6.71109025e-03 4.57800528e-03] [-1.03274425e-03 7.74249970e-03 -4.74300683e-03] [ 1.03274425e-03 -7.74249970e-03 -4.74300683e-03] [-5.65817734e-03 1.40823363e-02 -6.20106273e-03] [ 5.65817734e-03 -1.40823363e-02 -6.20106273e-03] [ 8.67523948e-05 -1.12850038e-02 4.94172498e-03] [-8.67523955e-05 1.12850038e-02 4.94172498e-03] [ 1.32438551e-02 -4.12626380e-03 -1.34059967e-03] [-1.32438551e-02 4.12626379e-03 -1.34059967e-03] [-2.38311369e-03 -6.20770427e-03 1.15995285e-02] [ 2.38311369e-03 6.20770427e-03 1.15995285e-02] [-1.07002857e-02 -2.67204526e-03 1.10395159e-03] [ 1.07002857e-02 2.67204526e-03 1.10395159e-03] [-1.30138801e-03 5.59644093e-03 -2.45812588e-03] [ 1.30138801e-03 -5.59644093e-03 -2.45812588e-03] [-1.85553502e-03 -3.60543859e-03 1.24379102e-02] [ 1.85553502e-03 3.60543860e-03 1.24379102e-02] [-2.14093043e-03 -3.39731106e-03 1.16633208e-02] [ 2.14093043e-03 3.39731106e-03 1.16633208e-02] [-8.96466069e-03 2.10264648e-02 -3.99921248e-03] [ 8.96466069e-03 -2.10264648e-02 -3.99921248e-03] [ 2.12595089e-03 -2.83078341e-03 -1.26369812e-02] [-2.12595089e-03 2.83078341e-03 -1.26369812e-02] [-2.72787954e-03 -7.32843919e-03 1.09859230e-02] [ 2.72787954e-03 7.32843919e-03 1.09859230e-02] [-5.24476597e-03 4.12974140e-03 -2.98984147e-03] [ 5.24476598e-03 -4.12974140e-03 -2.98984147e-03] [-1.20631923e-03 -9.22087216e-04 -1.17920208e-02] [ 1.20631923e-03 9.22087216e-04 -1.17920208e-02] [-1.33703180e-02 -3.24117018e-03 5.67775536e-03] [ 1.33703180e-02 3.24117018e-03 5.67775536e-03] [ 1.65735894e-03 2.14705221e-03 1.58754428e-02] [-1.65735894e-03 -2.14705221e-03 1.58754428e-02] [-1.25285272e-02 3.72560014e-03 -1.05809299e-03] [ 1.25285272e-02 -3.72560014e-03 -1.05809299e-03] [ 3.16586425e-03 -8.48966822e-03 -2.81641105e-03] [-3.16586425e-03 8.48966821e-03 -2.81641105e-03] [-6.21074311e-03 -1.06837451e-02 -1.67587456e-02] [ 6.21074312e-03 1.06837451e-02 -1.67587456e-02] [-1.50985894e-03 3.57672501e-04 1.43802156e-02] [ 1.50985894e-03 -3.57672498e-04 1.43802156e-02] [-5.03666874e-03 -1.03597370e-03 -5.21874648e-03] [ 5.03666874e-03 1.03597370e-03 -5.21874649e-03] [-4.28745991e-05 5.10491218e-03 2.43135475e-03] [ 4.28745972e-05 -5.10491218e-03 2.43135475e-03] [-2.64248294e-02 2.34613014e-03 -2.27831424e-03] [ 2.64248294e-02 -2.34613014e-03 -2.27831423e-03] [ 9.30060471e-03 -3.52421199e-03 -1.04107497e-02] [-9.30060471e-03 3.52421199e-03 -1.04107497e-02] [-2.82678435e-03 -1.38196401e-03 7.80588567e-03] [ 2.82678434e-03 1.38196401e-03 7.80588567e-03] [ 2.55660522e-03 2.68405419e-03 -7.39676512e-03] [-2.55660522e-03 -2.68405419e-03 -7.39676512e-03] [-6.18836009e-03 3.11370770e-03 5.88707835e-03] [ 6.18836009e-03 -3.11370770e-03 5.88707835e-03] [ 7.32808770e-04 3.86169420e-03 2.07848540e-03] [-7.32808771e-04 -3.86169419e-03 2.07848539e-03] [ 2.27725674e-03 3.09573634e-03 -5.15442631e-03] [-2.27725674e-03 -3.09573634e-03 -5.15442631e-03] [ 9.27692600e-03 -2.84143504e-03 -4.56068245e-03] [-9.27692600e-03 2.84143505e-03 -4.56068245e-03] [ 2.67451228e-03 3.92046834e-04 -5.97186308e-03] [-2.67451228e-03 -3.92046851e-04 -5.97186308e-03] [-6.42457736e-03 -5.37864073e-03 -8.93712420e-04] [ 6.42457736e-03 5.37864073e-03 -8.93712419e-04] [ 1.33905626e-02 -1.31990907e-03 3.28194730e-03] [-1.33905626e-02 1.31990907e-03 3.28194730e-03] [-4.31060686e-03 3.48028900e-03 6.45512440e-03] [ 4.31060686e-03 -3.48028900e-03 6.45512440e-03] [ 2.37747241e-03 2.57491752e-03 3.77330635e-03] [-2.37747241e-03 -2.57491752e-03 3.77330636e-03] [ 7.48547954e-03 5.09848789e-03 -1.57100985e-03] [-7.48547954e-03 -5.09848789e-03 -1.57100986e-03] [ 1.45718075e-02 2.65173546e-03 6.04534951e-03] [-1.45718075e-02 -2.65173546e-03 6.04534952e-03] [-3.78513785e-03 4.21080500e-04 2.38173151e-03] [ 3.78513785e-03 -4.21080501e-04 2.38173150e-03]] Final stress: [ 7.75684959e-05 2.66102486e-04 2.02488954e-04 -5.75903928e-16 1.28084857e-15 2.52468386e-04] Minimization converged after 109 steps. Minimization converged after 109 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 51 steps. Minimization converged after 56 steps. Minimization converged after 51 steps. Minimization converged after 50 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 113 steps. Minimization converged after 110 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.48219524e-03 2.56975340e-03 3.69071767e-03] [ 1.48219524e-03 -2.56975324e-03 3.69071764e-03] [-1.62167755e-03 5.67202409e-03 -5.64693475e-03] [ 1.62167755e-03 -5.67202410e-03 -5.64693474e-03] [ 1.33623474e-03 -7.36465732e-03 3.67280883e-03] [-1.33623474e-03 7.36465731e-03 3.67280883e-03] [-1.45979757e-03 1.14460526e-02 -1.10701064e-02] [ 1.45979757e-03 -1.14460527e-02 -1.10701064e-02] [ 1.59814297e-03 9.91678167e-04 1.55013816e-04] [-1.59814297e-03 -9.91678168e-04 1.55013816e-04] [-2.46140934e-03 2.37431937e-03 -4.17958656e-03] [ 2.46140934e-03 -2.37431939e-03 -4.17958658e-03] [-4.79831165e-04 2.73078686e-03 1.39309877e-03] [ 4.79831164e-04 -2.73078685e-03 1.39309878e-03] [-8.30558664e-03 -5.39210431e-03 1.65019750e-03] [ 8.30558664e-03 5.39210426e-03 1.65019749e-03] [ 5.78587635e-03 -3.43863331e-03 1.91729738e-03] [-5.78587635e-03 3.43863332e-03 1.91729739e-03] [ 2.25504325e-03 -2.39428534e-03 8.36432135e-04] [-2.25504325e-03 2.39428536e-03 8.36432138e-04] [ 2.91275724e-03 -6.37854051e-04 -5.91418452e-04] [-2.91275724e-03 6.37854045e-04 -5.91418444e-04] [-4.85676183e-03 2.56609025e-03 -3.51232980e-03] [ 4.85676183e-03 -2.56609022e-03 -3.51232982e-03] [ 5.69072403e-03 -4.63356692e-04 2.75387273e-04] [-5.69072403e-03 4.63356659e-04 2.75387234e-04] [ 2.32746606e-03 4.60575089e-03 -6.95114079e-03] [-2.32746606e-03 -4.60575088e-03 -6.95114080e-03] [-2.89694543e-04 -7.07365169e-03 1.02944222e-02] [ 2.89694542e-04 7.07365169e-03 1.02944222e-02] [ 1.02630583e-03 7.30055495e-03 -3.75141607e-03] [-1.02630583e-03 -7.30055495e-03 -3.75141607e-03] [ 4.93109398e-03 -6.15993730e-03 5.01461780e-03] [-4.93109398e-03 6.15993727e-03 5.01461782e-03] [-3.35191227e-03 -4.75385584e-03 1.66021262e-03] [ 3.35191227e-03 4.75385584e-03 1.66021262e-03] [-1.09830852e-02 -2.93723492e-03 1.86528869e-03] [ 1.09830853e-02 2.93723492e-03 1.86528869e-03] [-3.14058598e-03 -7.40204608e-04 -1.77841074e-03] [ 3.14058598e-03 7.40204610e-04 -1.77841075e-03] [ 2.39812340e-03 8.77097867e-04 1.89641587e-03] [-2.39812339e-03 -8.77097863e-04 1.89641587e-03] [-1.37117570e-03 -8.72933912e-03 -3.20788708e-04] [ 1.37117570e-03 8.72933911e-03 -3.20788711e-04] [-3.48069315e-03 -6.62994004e-04 -3.70862177e-03] [ 3.48069315e-03 6.62993997e-04 -3.70862176e-03] [ 3.45192267e-03 -3.31532658e-03 -7.95052473e-03] [-3.45192266e-03 3.31532660e-03 -7.95052475e-03] [ 3.22875364e-03 -3.27597959e-03 9.34314758e-03] [-3.22875365e-03 3.27597961e-03 9.34314760e-03] [-2.42297124e-03 2.20864988e-03 2.22185532e-03] [ 2.42297124e-03 -2.20864989e-03 2.22185533e-03] [-7.80126017e-03 2.97127176e-03 -4.59730125e-03] [ 7.80126017e-03 -2.97127176e-03 -4.59730125e-03] [-5.96369145e-03 -2.88800478e-03 -4.44974693e-05] [ 5.96369145e-03 2.88800477e-03 -4.44974626e-05] [-5.62856601e-03 -7.27657410e-06 -2.72854686e-03] [ 5.62856601e-03 7.27656671e-06 -2.72854686e-03] [ 2.66655250e-03 -1.36510736e-04 1.95143199e-03] [-2.66655250e-03 1.36510736e-04 1.95143199e-03] [-4.42933058e-03 -7.55339078e-03 7.12796017e-03] [ 4.42933058e-03 7.55339078e-03 7.12796017e-03] [ 7.79318589e-03 9.40107309e-04 -5.76024058e-03] [-7.79318587e-03 -9.40107276e-04 -5.76024055e-03] [ 2.66481324e-03 1.41736548e-03 4.82672756e-03] [-2.66481327e-03 -1.41736544e-03 4.82672754e-03] [ 2.23498038e-03 2.92134086e-03 -6.49615904e-05] [-2.23498037e-03 -2.92134087e-03 -6.49615943e-05] [-9.55273796e-03 -8.94254579e-03 -7.14552064e-04] [ 9.55273795e-03 8.94254579e-03 -7.14552058e-04] [-8.06711523e-04 -8.33264737e-03 7.04029493e-03] [ 8.06711516e-04 8.33264737e-03 7.04029493e-03] [-8.33636698e-03 -1.63972904e-02 -8.86971606e-03] [ 8.33636698e-03 1.63972904e-02 -8.86971607e-03] [-1.16213315e-03 -5.59070147e-03 -5.13133511e-03] [ 1.16213315e-03 5.59070147e-03 -5.13133512e-03] [-8.19797320e-03 2.48605072e-03 -8.85531932e-03] [ 8.19797320e-03 -2.48605072e-03 -8.85531932e-03] [ 8.26199373e-03 8.04356429e-04 9.01931070e-05] [-8.26199373e-03 -8.04356417e-04 9.01931154e-05] [ 4.18434302e-03 -9.24022977e-04 1.24964537e-03] [-4.18434302e-03 9.24022978e-04 1.24964536e-03] [-2.21729391e-03 3.79158938e-03 3.40548616e-03] [ 2.21729391e-03 -3.79158938e-03 3.40548616e-03] [ 4.57011129e-03 -4.11729506e-03 -3.54078262e-04] [-4.57011129e-03 4.11729507e-03 -3.54078256e-04] [-4.58096324e-03 -5.13811156e-03 1.96672244e-03] [ 4.58096324e-03 5.13811143e-03 1.96672245e-03] [-2.06319737e-03 -2.50250488e-03 1.40207283e-03] [ 2.06319737e-03 2.50250488e-03 1.40207283e-03] [ 3.82378546e-03 2.26087529e-03 2.03638882e-03] [-3.82378546e-03 -2.26087528e-03 2.03638882e-03] [-3.41663370e-03 -1.84091878e-03 6.41091557e-05] [ 3.41663370e-03 1.84091875e-03 6.41091584e-05] [-3.17540984e-03 3.15385460e-03 4.00514529e-03] [ 3.17540985e-03 -3.15385462e-03 4.00514532e-03] [ 1.01096131e-02 -1.20901499e-03 1.58886257e-03] [-1.01096131e-02 1.20901497e-03 1.58886254e-03] [ 2.10959892e-03 1.75285987e-03 1.11640809e-03] [-2.10959892e-03 -1.75285987e-03 1.11640812e-03] [ 4.94462007e-03 5.82437619e-03 2.82346542e-03] [-4.94462007e-03 -5.82437619e-03 2.82346539e-03]] Final stress: [-2.14279669e-04 -7.48542257e-06 -4.77471563e-04 -5.88856493e-15 -2.15411977e-15 -3.27540537e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.55890582e-03 2.94103578e-03 4.05424378e-03] [-1.55890582e-03 -2.94103568e-03 4.05424375e-03] [ 1.85930372e-03 6.29681520e-03 -6.59083053e-03] [-1.85930372e-03 -6.29681522e-03 -6.59083052e-03] [-1.32646439e-03 -8.16815257e-03 4.08297433e-03] [ 1.32646439e-03 8.16815256e-03 4.08297433e-03] [ 1.51550074e-03 1.30562842e-02 -1.26255305e-02] [-1.51550074e-03 -1.30562843e-02 -1.26255306e-02] [-1.77835498e-03 1.27868900e-03 2.95436275e-04] [ 1.77835498e-03 -1.27868901e-03 2.95436281e-04] [ 2.81291353e-03 2.71703122e-03 -4.69465721e-03] [-2.81291353e-03 -2.71703122e-03 -4.69465722e-03] [ 4.09286508e-04 3.02018584e-03 1.49206641e-03] [-4.09286509e-04 -3.02018583e-03 1.49206642e-03] [ 8.97921160e-03 -5.98915371e-03 1.93841774e-03] [-8.97921160e-03 5.98915369e-03 1.93841772e-03] [-6.39634231e-03 -3.87322859e-03 2.10629275e-03] [ 6.39634231e-03 3.87322859e-03 2.10629275e-03] [-2.46060446e-03 -2.61735919e-03 1.00511742e-03] [ 2.46060446e-03 2.61735920e-03 1.00511743e-03] [-3.19572626e-03 -7.21307280e-04 -6.83393870e-04] [ 3.19572626e-03 7.21307280e-04 -6.83393868e-04] [ 5.30100975e-03 2.70555102e-03 -4.02371851e-03] [-5.30100974e-03 -2.70555095e-03 -4.02371853e-03] [-6.41272235e-03 -7.88113712e-04 3.51022484e-04] [ 6.41272235e-03 7.88113689e-04 3.51022454e-04] [-2.50883096e-03 5.30638775e-03 -7.89049134e-03] [ 2.50883096e-03 -5.30638776e-03 -7.89049135e-03] [ 3.75556546e-04 -7.68705039e-03 1.13539827e-02] [-3.75556547e-04 7.68705039e-03 1.13539827e-02] [-9.99983784e-04 8.02351975e-03 -4.24317438e-03] [ 9.99983784e-04 -8.02351975e-03 -4.24317438e-03] [-5.45775937e-03 -7.04192833e-03 5.77840417e-03] [ 5.45775937e-03 7.04192831e-03 5.77840419e-03] [-1.24425522e-02 3.39955004e-03 1.92652299e-03] [ 1.24425522e-02 -3.39955005e-03 1.92652299e-03] [-4.06141330e-03 5.36279468e-03 1.79220128e-03] [ 4.06141330e-03 -5.36279469e-03 1.79220128e-03] [ 2.66949863e-03 -9.50832658e-04 2.20039255e-03] [-2.66949865e-03 9.50832672e-04 2.20039256e-03] [-3.51109878e-03 7.55593777e-04 -2.01270826e-03] [ 3.51109880e-03 -7.55593763e-04 -2.01270827e-03] [-4.07744621e-03 5.15392485e-04 -3.90095565e-03] [ 4.07744621e-03 -5.15392489e-04 -3.90095565e-03] [-1.77854939e-03 9.75549675e-03 5.42016034e-06] [ 1.77854939e-03 -9.75549676e-03 5.42016058e-06] [ 3.66097702e-03 3.65660715e-03 1.03207328e-02] [-3.66097702e-03 -3.65660713e-03 1.03207328e-02] [ 4.01715042e-03 3.62546826e-03 -8.80108767e-03] [-4.01715042e-03 -3.62546824e-03 -8.80108765e-03] [-8.92769663e-03 -3.28631180e-03 -5.06252889e-03] [ 8.92769663e-03 3.28631180e-03 -5.06252889e-03] [-3.17473794e-03 -2.51882810e-03 2.52181649e-03] [ 3.17473794e-03 2.51882810e-03 2.52181649e-03] [-6.52739711e-03 -2.72708408e-05 -2.77277633e-03] [ 6.52739711e-03 2.72708324e-05 -2.77277633e-03] [-6.80096081e-03 3.22467932e-03 1.32950817e-04] [ 6.80096082e-03 -3.22467933e-03 1.32950811e-04] [-4.93125161e-03 8.36471600e-03 7.82313270e-03] [ 4.93125161e-03 -8.36471601e-03 7.82313270e-03] [ 2.83281466e-03 5.26243759e-05 2.11212976e-03] [-2.83281466e-03 -5.26243812e-05 2.11212976e-03] [ 2.90704478e-03 -1.63245271e-03 5.31647881e-03] [-2.90704477e-03 1.63245273e-03 5.31647882e-03] [ 8.82237944e-03 -8.90165265e-04 -6.54084275e-03] [-8.82237946e-03 8.90165284e-04 -6.54084276e-03] [-1.05414937e-02 9.92206983e-03 -6.19463761e-04] [ 1.05414937e-02 -9.92206983e-03 -6.19463765e-04] [ 2.42129788e-03 -3.22374400e-03 -1.68800529e-04] [-2.42129788e-03 3.22374400e-03 -1.68800525e-04] [-9.45354415e-03 1.83937590e-02 -9.92120479e-03] [ 9.45354415e-03 -1.83937590e-02 -9.92120478e-03] [-9.57316017e-04 9.24289935e-03 7.64139493e-03] [ 9.57316018e-04 -9.24289935e-03 7.64139493e-03] [-9.07925000e-03 -2.85050447e-03 -9.88222282e-03] [ 9.07925000e-03 2.85050447e-03 -9.88222282e-03] [-1.29645327e-03 6.33032585e-03 -5.75607721e-03] [ 1.29645327e-03 -6.33032585e-03 -5.75607720e-03] [-9.01484623e-03 8.84949168e-04 2.52819604e-04] [ 9.01484623e-03 -8.84949160e-04 2.52819612e-04] [-4.57917439e-03 -1.03011096e-03 1.35665057e-03] [ 4.57917439e-03 1.03011096e-03 1.35665056e-03] [ 2.42136968e-03 4.10411501e-03 3.75112826e-03] [-2.42136968e-03 -4.10411501e-03 3.75112825e-03] [-4.97297879e-03 -4.48169785e-03 -5.99150202e-04] [ 4.97297879e-03 4.48169787e-03 -5.99150184e-04] [ 5.21474109e-03 -6.20157076e-03 2.01067349e-03] [-5.21474109e-03 6.20157068e-03 2.01067350e-03] [ 2.13985304e-03 -2.88489255e-03 1.50734472e-03] [-2.13985304e-03 2.88489255e-03 1.50734472e-03] [-4.23819655e-03 2.54156138e-03 2.29316938e-03] [ 4.23819655e-03 -2.54156138e-03 2.29316937e-03] [ 3.97501620e-03 -1.90149782e-03 1.65971792e-04] [-3.97501620e-03 1.90149776e-03 1.65971793e-04] [ 1.11449900e-02 1.48092346e-03 1.92110047e-03] [-1.11449900e-02 -1.48092347e-03 1.92110050e-03] [-3.66498829e-03 -3.36768474e-03 4.66457261e-03] [ 3.66498829e-03 3.36768473e-03 4.66457258e-03] [ 5.48038792e-03 -6.41125520e-03 3.21112857e-03] [-5.48038792e-03 6.41125520e-03 3.21112860e-03] [ 2.18049762e-03 -1.88213068e-03 1.40392438e-03] [-2.18049762e-03 1.88213068e-03 1.40392436e-03]] Final stress: [-2.33345727e-04 8.97877423e-06 -5.02855116e-04 2.28083270e-15 2.81637413e-15 3.60954824e-04] Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 135 steps. Minimization converged after 139 steps. Minimization converged after 137 steps. Minimization converged after 133 steps. Minimization converged after 55 steps. Minimization converged after 54 steps. Minimization converged after 141 steps. Minimization converged after 142 steps. Minimization converged after 146 steps. Minimization converged after 143 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 4.85754392e-03 -2.21660166e-03 -2.32265307e-03] [-4.85754392e-03 2.21660174e-03 -2.32265309e-03] [ 5.10102468e-03 9.29643532e-04 -1.36777642e-03] [-5.10102468e-03 -9.29643539e-04 -1.36777642e-03] [ 6.58063495e-03 -9.90507048e-04 -4.93711288e-04] [-6.58063495e-03 9.90507044e-04 -4.93711293e-04] [-1.47243256e-02 6.58020817e-03 -8.61561142e-03] [ 1.47243256e-02 -6.58020819e-03 -8.61561145e-03] [-5.62846000e-03 7.61301099e-04 1.93570084e-03] [ 5.62846000e-03 -7.61301102e-04 1.93570085e-03] [ 1.06240015e-03 3.08933621e-04 -1.72774875e-03] [-1.06240015e-03 -3.08933625e-04 -1.72774876e-03] [ 2.43978883e-03 -4.38498553e-04 -3.25296694e-03] [-2.43978883e-03 4.38498556e-04 -3.25296694e-03] [-1.28015886e-02 -2.12036969e-03 -1.66745730e-03] [ 1.28015886e-02 2.12036967e-03 -1.66745732e-03] [-2.54885575e-03 -7.63465947e-04 -8.63154814e-04] [ 2.54885575e-03 7.63465947e-04 -8.63154815e-04] [-2.00183339e-03 -1.14817241e-03 1.41401619e-03] [ 2.00183339e-03 1.14817242e-03 1.41401619e-03] [ 1.11888368e-02 -5.31689693e-04 -1.43547917e-03] [-1.11888368e-02 5.31689690e-04 -1.43547917e-03] [-1.98779980e-03 -1.03280334e-02 -1.66226515e-03] [ 1.98779981e-03 1.03280335e-02 -1.66226516e-03] [-2.68537865e-03 -6.32063677e-03 4.48580361e-03] [ 2.68537865e-03 6.32063677e-03 4.48580360e-03] [-4.23600981e-03 6.70405491e-03 2.55667614e-04] [ 4.23600981e-03 -6.70405491e-03 2.55667611e-04] [ 1.22731671e-02 2.45284227e-03 -1.19245192e-03] [-1.22731671e-02 -2.45284227e-03 -1.19245192e-03] [-6.24960776e-03 -5.31744028e-04 -1.43993494e-03] [ 6.24960776e-03 5.31744029e-04 -1.43993493e-03] [-7.70777921e-03 -7.31723732e-04 7.66470368e-04] [ 7.70777921e-03 7.31723719e-04 7.66470374e-04] [-1.01359059e-02 9.10712918e-03 5.96106768e-04] [ 1.01359059e-02 -9.10712918e-03 5.96106767e-04] [ 4.24401583e-03 1.14796226e-02 -9.09380228e-04] [-4.24401583e-03 -1.14796226e-02 -9.09380226e-04] [ 4.01744379e-03 -3.73197521e-03 1.24882331e-02] [-4.01744380e-03 3.73197522e-03 1.24882331e-02] [-4.11304420e-03 2.30218418e-06 -7.54293205e-03] [ 4.11304421e-03 -2.30217627e-06 -7.54293205e-03] [-5.35725277e-03 -7.43965192e-03 -6.53137890e-03] [ 5.35725277e-03 7.43965192e-03 -6.53137890e-03] [ 2.80186132e-03 -1.96705758e-03 1.06929170e-02] [-2.80186132e-03 1.96705757e-03 1.06929170e-02] [-1.09454034e-02 6.76206172e-03 7.24815431e-03] [ 1.09454034e-02 -6.76206170e-03 7.24815430e-03] [ 1.20335673e-02 7.85452772e-03 -8.96296782e-03] [-1.20335673e-02 -7.85452770e-03 -8.96296781e-03] [-5.42402280e-03 -5.04886061e-03 -6.52092737e-03] [ 5.42402280e-03 5.04886061e-03 -6.52092737e-03] [ 1.47191154e-03 -9.61511769e-03 8.12052140e-03] [-1.47191154e-03 9.61511768e-03 8.12052140e-03] [ 1.12344877e-02 -5.61284945e-03 4.22020187e-03] [-1.12344877e-02 5.61284945e-03 4.22020188e-03] [-6.83061910e-03 -1.38933821e-02 -4.13933394e-04] [ 6.83061911e-03 1.38933821e-02 -4.13933400e-04] [ 8.64915158e-03 3.28712847e-03 -7.81485369e-04] [-8.64915158e-03 -3.28712847e-03 -7.81485368e-04] [-1.02931908e-02 1.91692636e-03 1.46225748e-04] [ 1.02931908e-02 -1.91692636e-03 1.46225746e-04] [ 6.81356551e-03 1.48342511e-03 1.56367902e-02] [-6.81356550e-03 -1.48342509e-03 1.56367902e-02] [-8.25754037e-03 4.75834488e-03 -1.48764510e-02] [ 8.25754036e-03 -4.75834487e-03 -1.48764510e-02] [-2.06738130e-03 2.66467146e-03 2.44111242e-03] [ 2.06738129e-03 -2.66467146e-03 2.44111242e-03] [ 1.93457211e-03 1.64993862e-03 -2.74703025e-03] [-1.93457212e-03 -1.64993862e-03 -2.74703025e-03] [ 1.09887278e-02 6.19035065e-03 -8.71459279e-03] [-1.09887278e-02 -6.19035065e-03 -8.71459279e-03] [-1.14841426e-02 5.43077230e-03 7.68183850e-03] [ 1.14841426e-02 -5.43077230e-03 7.68183850e-03] [-1.70292722e-04 4.38832345e-04 -7.91163932e-03] [ 1.70292723e-04 -4.38832345e-04 -7.91163933e-03] [ 7.93680976e-04 1.53355690e-03 4.32089692e-03] [-7.93680975e-04 -1.53355690e-03 4.32089692e-03] [ 4.85987818e-03 1.47847340e-03 1.43214496e-03] [-4.85987818e-03 -1.47847340e-03 1.43214496e-03] [-7.50284640e-03 -5.30462196e-04 7.06750890e-04] [ 7.50284640e-03 5.30462198e-04 7.06750886e-04] [ 6.99256763e-03 -1.81943166e-03 -3.21363825e-04] [-6.99256763e-03 1.81943166e-03 -3.21363826e-04] [-5.57543172e-03 -3.89297187e-03 2.44714329e-03] [ 5.57543172e-03 3.89297188e-03 2.44714330e-03] [ 4.24795360e-03 -4.27142066e-03 -1.31901483e-03] [-4.24795359e-03 4.27142059e-03 -1.31901482e-03] [ 1.31578978e-02 -5.15074247e-04 -1.00983896e-04] [-1.31578978e-02 5.15074247e-04 -1.00983900e-04] [-1.36238503e-02 2.02558101e-03 -4.52306942e-04] [ 1.36238503e-02 -2.02558101e-03 -4.52306943e-04] [-4.94501074e-04 9.69037415e-03 1.06747848e-03] [ 4.94501074e-04 -9.69037418e-03 1.06747848e-03] [ 8.13390458e-03 -3.30124002e-03 1.19155089e-03] [-8.13390458e-03 3.30124001e-03 1.19155091e-03] [-8.83691468e-03 -4.69037577e-03 5.96031784e-03] [ 8.83691468e-03 4.69037576e-03 5.96031782e-03] [-9.64104126e-03 -7.40470677e-03 -2.49402192e-03] [ 9.64104126e-03 7.40470677e-03 -2.49402191e-03] [ 1.24596853e-02 -1.25970985e-02 1.38557788e-03] [-1.24596853e-02 1.25970985e-02 1.38557787e-03]] Final stress: [-9.26396220e-05 7.01107835e-05 1.74957362e-06 4.88442825e-15 1.37916080e-15 -1.50521718e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-4.43875733e-03 -2.19031238e-03 -2.09052183e-03] [ 4.43875732e-03 2.19031251e-03 -2.09052186e-03] [-4.71366126e-03 8.23181756e-04 -1.13063295e-03] [ 4.71366126e-03 -8.23181771e-04 -1.13063295e-03] [-6.13349333e-03 -8.06267843e-04 -4.00028813e-04] [ 6.13349333e-03 8.06267838e-04 -4.00028818e-04] [ 1.35388652e-02 5.89056802e-03 -7.71354571e-03] [-1.35388652e-02 -5.89056805e-03 -7.71354575e-03] [ 5.14897854e-03 6.48890622e-04 1.72796009e-03] [-5.14897854e-03 -6.48890623e-04 1.72796010e-03] [-1.07500112e-03 2.32515822e-04 -1.57403480e-03] [ 1.07500112e-03 -2.32515830e-04 -1.57403482e-03] [-2.19093188e-03 -3.68237484e-04 -2.90764573e-03] [ 2.19093188e-03 3.68237492e-04 -2.90764572e-03] [ 1.17614243e-02 -1.86039360e-03 -1.51952867e-03] [-1.17614243e-02 1.86039357e-03 -1.51952869e-03] [ 2.27572100e-03 -6.49175064e-04 -7.44966626e-04] [-2.27572100e-03 6.49175067e-04 -7.44966625e-04] [ 1.96726501e-03 -1.04842938e-03 1.26512466e-03] [-1.96726501e-03 1.04842940e-03 1.26512466e-03] [-1.02936079e-02 -4.56586516e-04 -1.23859307e-03] [ 1.02936079e-02 4.56586515e-04 -1.23859307e-03] [ 1.95483461e-03 -9.28838008e-03 -1.47834212e-03] [-1.95483461e-03 9.28838014e-03 -1.47834213e-03] [ 2.50937594e-03 -5.56918561e-03 3.94271851e-03] [-2.50937594e-03 5.56918558e-03 3.94271848e-03] [ 3.94809092e-03 6.04299664e-03 2.98579833e-04] [-3.94809092e-03 -6.04299665e-03 2.98579824e-04] [-1.12352395e-02 2.11880306e-03 -1.03294709e-03] [ 1.12352395e-02 -2.11880305e-03 -1.03294708e-03] [ 5.62512892e-03 -4.46734779e-04 -1.28516910e-03] [-5.62512893e-03 4.46734782e-04 -1.28516909e-03] [ 7.19234719e-03 -5.76663891e-04 6.91827932e-04] [-7.19234719e-03 5.76663871e-04 6.91827943e-04] [ 4.10239781e-03 -1.05335853e-02 -8.42329057e-04] [-4.10239781e-03 1.05335852e-02 -8.42329058e-04] [-9.06991421e-03 -8.44699698e-03 5.34298374e-04] [ 9.06991421e-03 8.44699698e-03 5.34298377e-04] [-3.78105839e-03 4.98050476e-05 -7.00116292e-03] [ 3.78105838e-03 -4.98050368e-05 -7.00116291e-03] [ 3.69235483e-03 3.40609677e-03 1.14016065e-02] [-3.69235481e-03 -3.40609676e-03 1.14016065e-02] [ 2.57374224e-03 2.00660629e-03 9.72778327e-03] [-2.57374224e-03 -2.00660629e-03 9.72778327e-03] [-4.85781159e-03 6.73101467e-03 -6.20680925e-03] [ 4.85781159e-03 -6.73101468e-03 -6.20680925e-03] [ 1.09183625e-02 -7.25592770e-03 -8.34036393e-03] [-1.09183625e-02 7.25592772e-03 -8.34036395e-03] [-1.00711779e-02 -6.17343916e-03 6.67361526e-03] [ 1.00711779e-02 6.17343918e-03 6.67361528e-03] [ 1.44441012e-03 8.75016026e-03 7.48575134e-03] [-1.44441012e-03 -8.75016027e-03 7.48575134e-03] [-4.77152738e-03 4.66797822e-03 -6.04059176e-03] [ 4.77152738e-03 -4.66797822e-03 -6.04059176e-03] [-6.23397285e-03 1.26992385e-02 -4.41274477e-04] [ 6.23397285e-03 -1.26992385e-02 -4.41274471e-04] [ 1.03485900e-02 5.07883624e-03 3.84313097e-03] [-1.03485900e-02 -5.07883624e-03 3.84313096e-03] [-9.51916076e-03 -1.85875596e-03 1.57094476e-04] [ 9.51916076e-03 1.85875596e-03 1.57094476e-04] [ 8.03232236e-03 -3.06780938e-03 -6.41238723e-04] [-8.03232236e-03 3.06780937e-03 -6.41238724e-04] [-7.54423110e-03 -4.45430101e-03 -1.36497356e-02] [ 7.54423112e-03 4.45430103e-03 -1.36497356e-02] [ 6.22872406e-03 -1.49054312e-03 1.44865674e-02] [-6.22872408e-03 1.49054314e-03 1.44865674e-02] [ 1.66945044e-03 -1.45725137e-03 -2.46541846e-03] [-1.66945044e-03 1.45725137e-03 -2.46541846e-03] [-1.83341985e-03 -2.40202268e-03 2.22304534e-03] [ 1.83341985e-03 2.40202268e-03 2.22304534e-03] [-1.04941010e-02 -5.15547732e-03 7.07448714e-03] [ 1.04941010e-02 5.15547732e-03 7.07448714e-03] [ 1.02122224e-02 -5.59786302e-03 -7.99089807e-03] [-1.02122224e-02 5.59786302e-03 -7.99089807e-03] [ 7.50209735e-04 -1.45931424e-03 4.02498438e-03] [-7.50209735e-04 1.45931424e-03 4.02498437e-03] [-1.80067845e-04 -4.50505993e-04 -7.31846961e-03] [ 1.80067846e-04 4.50505992e-04 -7.31846960e-03] [-4.56743982e-03 1.36756862e-03 1.15783549e-03] [ 4.56743982e-03 -1.36756861e-03 1.15783550e-03] [ 6.94525437e-03 -5.16776287e-04 6.10146972e-04] [-6.94525437e-03 5.16776288e-04 6.10146966e-04] [-6.37725022e-03 -1.62278655e-03 -2.66013201e-04] [ 6.37725022e-03 1.62278655e-03 -2.66013202e-04] [ 5.04604645e-03 -3.59188578e-03 2.31374044e-03] [-5.04604645e-03 3.59188579e-03 2.31374046e-03] [-3.98748447e-03 -3.44010224e-03 -1.12134567e-03] [ 3.98748447e-03 3.44010215e-03 -1.12134566e-03] [-1.20985678e-02 -4.10455072e-04 -9.09164586e-05] [ 1.20985678e-02 4.10455073e-04 -9.09164624e-05] [ 1.26266341e-02 1.77178489e-03 -4.30360102e-04] [-1.26266341e-02 -1.77178489e-03 -4.30360104e-04] [ 4.29251196e-04 8.60972506e-03 9.37563520e-04] [-4.29251196e-04 -8.60972511e-03 9.37563522e-04] [-8.06443913e-03 4.22285848e-03 5.38290517e-03] [ 8.06443914e-03 -4.22285850e-03 5.38290520e-03] [ 7.52931301e-03 3.10441778e-03 9.81180390e-04] [-7.52931301e-03 -3.10441780e-03 9.81180358e-04] [ 1.14458926e-02 1.15835163e-02 1.30612203e-03] [-1.14458926e-02 -1.15835163e-02 1.30612205e-03] [-8.87475340e-03 6.78457891e-03 -2.28518563e-03] [ 8.87475340e-03 -6.78457891e-03 -2.28518566e-03]] Final stress: [-8.07203138e-05 6.09830854e-05 3.92306408e-07 -1.79506025e-15 2.78939455e-15 1.38802478e-04] Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 19 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 17 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 52 steps. Minimization converged after 116 steps. Minimization converged after 116 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 113 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.52113218e-03 6.10448031e-04 -1.37123894e-04] [-2.52113218e-03 -6.10448033e-04 -1.37123896e-04] [ 3.61843703e-03 4.92273422e-03 -4.35425706e-04] [-3.61843703e-03 -4.92273422e-03 -4.35425706e-04] [ 1.45139542e-03 -3.31370624e-03 -3.40953797e-03] [-1.45139542e-03 3.31370624e-03 -3.40953797e-03] [-5.36938947e-03 -5.39662164e-03 -1.73883592e-03] [ 5.36938947e-03 5.39662165e-03 -1.73883592e-03] [ 3.03223464e-04 2.96534852e-03 -2.57881800e-03] [-3.03223464e-04 -2.96534852e-03 -2.57881801e-03] [ 6.89785197e-04 9.80613591e-04 3.89013824e-03] [-6.89785198e-04 -9.80613590e-04 3.89013824e-03] [-3.89590953e-03 -2.43433854e-04 -3.95758776e-03] [ 3.89590953e-03 2.43433854e-04 -3.95758776e-03] [-7.34065233e-03 -4.21225208e-03 -7.05145225e-03] [ 7.34065233e-03 4.21225208e-03 -7.05145224e-03] [-7.46283344e-04 5.04146558e-03 -5.59381865e-03] [ 7.46283344e-04 -5.04146558e-03 -5.59381865e-03] [ 2.31743281e-03 7.93693986e-05 3.33402459e-03] [-2.31743281e-03 -7.93694010e-05 3.33402459e-03] [ 7.41773224e-03 -3.75926435e-03 8.18386707e-04] [-7.41773224e-03 3.75926435e-03 8.18386708e-04] [-5.64746001e-03 1.29908653e-03 2.00857083e-03] [ 5.64746001e-03 -1.29908655e-03 2.00857083e-03] [ 1.63382131e-03 1.81374310e-03 -7.82616256e-04] [-1.63382132e-03 -1.81374309e-03 -7.82616245e-04] [-1.34774119e-04 4.06145357e-03 8.94302003e-03] [ 1.34774120e-04 -4.06145357e-03 8.94302004e-03] [ 4.33663642e-03 2.71020306e-03 -3.62757662e-03] [-4.33663642e-03 -2.71020306e-03 -3.62757662e-03] [-1.99634830e-04 2.67153678e-03 2.09068261e-03] [ 1.99634832e-04 -2.67153678e-03 2.09068261e-03] [-5.19382783e-03 -4.67143396e-03 -1.07812344e-04] [ 5.19382783e-03 4.67143396e-03 -1.07812347e-04] [-6.60159859e-03 1.53351984e-03 2.62065157e-04] [ 6.60159859e-03 -1.53351984e-03 2.62065156e-04] [-6.69862512e-05 4.41111570e-03 2.39700730e-03] [ 6.69862511e-05 -4.41111569e-03 2.39700730e-03] [-1.26333537e-03 1.53747539e-03 5.88436011e-03] [ 1.26333538e-03 -1.53747539e-03 5.88436010e-03] [ 8.56790575e-04 -2.36600520e-04 -1.80356917e-03] [-8.56790581e-04 2.36600516e-04 -1.80356917e-03] [-2.82914869e-03 -4.02549865e-03 -2.85386045e-03] [ 2.82914869e-03 4.02549864e-03 -2.85386045e-03] [-5.11274662e-04 -5.09335561e-03 5.08406069e-03] [ 5.11274663e-04 5.09335561e-03 5.08406069e-03] [-1.61623783e-03 5.14099512e-03 1.46948634e-03] [ 1.61623783e-03 -5.14099512e-03 1.46948634e-03] [ 7.08945067e-04 -6.60207118e-04 -3.71065626e-03] [-7.08945067e-04 6.60207113e-04 -3.71065627e-03] [ 1.36805531e-03 -2.45755307e-03 -1.36502300e-03] [-1.36805531e-03 2.45755306e-03 -1.36502300e-03] [-3.95474865e-03 -1.54615604e-04 -1.00103927e-03] [ 3.95474865e-03 1.54615604e-04 -1.00103927e-03] [ 3.13783488e-03 -1.39970905e-03 2.62665169e-03] [-3.13783488e-03 1.39970905e-03 2.62665169e-03] [-5.49287060e-03 1.29245859e-03 -2.79602014e-03] [ 5.49287060e-03 -1.29245859e-03 -2.79602014e-03] [ 4.06127027e-03 2.97645568e-03 -3.01043803e-03] [-4.06127027e-03 -2.97645568e-03 -3.01043803e-03] [-3.84660038e-03 -3.12085576e-03 8.51190255e-05] [ 3.84660038e-03 3.12085577e-03 8.51190255e-05] [ 2.06202911e-03 5.89678699e-04 3.41281298e-03] [-2.06202912e-03 -5.89678701e-04 3.41281298e-03] [-1.95550974e-03 5.20479832e-03 -9.96295031e-03] [ 1.95550974e-03 -5.20479833e-03 -9.96295031e-03] [-4.83233277e-03 -8.95575158e-04 3.47702585e-03] [ 4.83233277e-03 8.95575157e-04 3.47702585e-03] [-2.37584912e-03 3.77214377e-03 -5.37318664e-03] [ 2.37584912e-03 -3.77214377e-03 -5.37318664e-03] [ 5.81218977e-03 3.48018339e-03 4.75818094e-05] [-5.81218977e-03 -3.48018339e-03 4.75818088e-05] [-1.01325071e-02 -1.27116373e-03 3.72651978e-03] [ 1.01325071e-02 1.27116373e-03 3.72651978e-03] [ 2.88930376e-03 -1.97819742e-03 2.15966498e-03] [-2.88930375e-03 1.97819742e-03 2.15966498e-03] [-4.68285554e-03 3.88393955e-03 6.32975729e-03] [ 4.68285554e-03 -3.88393955e-03 6.32975729e-03] [ 1.50666156e-03 -2.15599952e-03 1.74893375e-03] [-1.50666157e-03 2.15599952e-03 1.74893375e-03] [ 2.10314768e-03 -8.47984666e-03 -2.11907604e-05] [-2.10314768e-03 8.47984666e-03 -2.11907573e-05] [ 5.75327460e-04 -2.95430241e-03 -1.52934943e-03] [-5.75327460e-04 2.95430242e-03 -1.52934944e-03] [-1.83315779e-03 7.95487684e-06 6.25610257e-04] [ 1.83315779e-03 -7.95488347e-06 6.25610254e-04] [-2.19437932e-04 3.63669587e-04 -1.46590521e-03] [ 2.19437931e-04 -3.63669582e-04 -1.46590521e-03] [ 5.41880812e-04 6.54979282e-03 -2.27392606e-03] [-5.41880815e-04 -6.54979283e-03 -2.27392605e-03] [-6.37591548e-03 -2.83810035e-03 2.63870317e-03] [ 6.37591548e-03 2.83810035e-03 2.63870318e-03] [ 1.07727915e-03 7.52512091e-04 1.19346807e-03] [-1.07727915e-03 -7.52512071e-04 1.19346807e-03] [-1.93102376e-04 -2.18809128e-03 -4.40271344e-04] [ 1.93102378e-04 2.18809128e-03 -4.40271346e-04] [-1.75761571e-03 1.96519023e-03 4.07919093e-03] [ 1.75761571e-03 -1.96519023e-03 4.07919093e-03] [-4.80337808e-03 4.21632796e-04 -1.31536496e-03] [ 4.80337808e-03 -4.21632794e-04 -1.31536497e-03] [ 2.92210226e-03 2.37863682e-04 1.05142169e-05] [-2.92210226e-03 -2.37863679e-04 1.05142231e-05]] Final stress: [-1.07538526e-04 -8.80657642e-05 1.85904813e-06 7.92480901e-16 -4.29350135e-15 -1.00207321e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-8.39288891e-04 2.71785343e-04 6.41650911e-05] [ 8.39288891e-04 -2.71785354e-04 6.41650934e-05] [-1.07679525e-03 1.28743265e-03 1.80883702e-04] [ 1.07679525e-03 -1.28743265e-03 1.80883701e-04] [-5.65737943e-04 -6.55720465e-04 -9.19923704e-04] [ 5.65737943e-04 6.55720464e-04 -9.19923703e-04] [ 1.49751985e-03 -1.84108496e-03 1.50077264e-04] [-1.49751985e-03 1.84108496e-03 1.50077270e-04] [-2.15131971e-04 8.28578280e-04 -7.28544405e-04] [ 2.15131971e-04 -8.28578280e-04 -7.28544406e-04] [-2.78074844e-04 9.13770597e-05 1.11192184e-03] [ 2.78074844e-04 -9.13770593e-05 1.11192184e-03] [ 1.27676812e-03 1.23741874e-04 -1.06959894e-03] [-1.27676812e-03 -1.23741876e-04 -1.06959894e-03] [ 2.36789203e-03 -1.61211849e-03 -1.47017464e-03] [-2.36789203e-03 1.61211849e-03 -1.47017464e-03] [-9.45184367e-05 1.51894911e-03 -1.49512409e-03] [ 9.45184374e-05 -1.51894911e-03 -1.49512409e-03] [-4.37126150e-04 -7.77549229e-05 8.03705729e-04] [ 4.37126150e-04 7.77549218e-05 8.03705727e-04] [-1.93845811e-03 -1.08115401e-03 1.99057211e-04] [ 1.93845811e-03 1.08115401e-03 1.99057211e-04] [ 1.43740455e-03 1.36782996e-04 6.75057428e-04] [-1.43740455e-03 -1.36782995e-04 6.75057429e-04] [-1.27514625e-04 5.34665615e-04 -2.22330386e-04] [ 1.27514625e-04 -5.34665611e-04 -2.22330381e-04] [ 1.67949232e-04 1.51471532e-03 2.26672378e-03] [-1.67949232e-04 -1.51471532e-03 2.26672378e-03] [-1.15776166e-03 4.71834501e-04 -8.46897167e-04] [ 1.15776166e-03 -4.71834501e-04 -8.46897168e-04] [-9.99313356e-05 9.26419729e-04 6.31464101e-04] [ 9.99313352e-05 -9.26419729e-04 6.31464100e-04] [ 1.44331232e-03 -9.86067578e-04 -1.94283102e-04] [-1.44331232e-03 9.86067579e-04 -1.94283102e-04] [ 4.42002216e-04 -1.13466817e-03 6.35113011e-04] [-4.42002216e-04 1.13466817e-03 6.35113012e-04] [-1.58211930e-03 -4.90996868e-04 9.73455768e-05] [ 1.58211930e-03 4.90996868e-04 9.73455764e-05] [ 1.91499811e-04 2.49728983e-04 -9.05374117e-04] [-1.91499809e-04 -2.49728984e-04 -9.05374117e-04] [ 7.60578131e-05 -2.90412030e-04 1.70647019e-03] [-7.60578143e-05 2.90412030e-04 1.70647018e-03] [-1.19181191e-04 1.60262467e-03 1.14240395e-03] [ 1.19181192e-04 -1.60262467e-03 1.14240395e-03] [-5.76019792e-04 8.62416226e-04 -1.05571155e-03] [ 5.76019791e-04 -8.62416226e-04 -1.05571155e-03] [-7.23240923e-05 6.55756646e-05 -1.51091777e-03] [ 7.23240915e-05 -6.55756653e-05 -1.51091777e-03] [-2.94537225e-04 -1.37382812e-03 7.06291800e-04] [ 2.94537225e-04 1.37382812e-03 7.06291799e-04] [-9.14672697e-04 1.16233474e-04 -2.47440081e-04] [ 9.14672696e-04 -1.16233474e-04 -2.47440080e-04] [ 4.98280528e-04 9.10967512e-04 -6.12575341e-04] [-4.98280528e-04 -9.10967512e-04 -6.12575342e-04] [-1.15485270e-03 3.16874918e-04 -5.56678831e-04] [ 1.15485270e-03 -3.16874917e-04 -5.56678832e-04] [ 5.05742984e-04 4.65286003e-04 5.63276382e-04] [-5.05742986e-04 -4.65286001e-04 5.63276384e-04] [-1.03968660e-03 7.52468979e-04 1.46214369e-04] [ 1.03968660e-03 -7.52468979e-04 1.46214368e-04] [ 1.42123255e-03 -8.69225234e-04 -7.03668809e-04] [-1.42123255e-03 8.69225235e-04 -7.03668808e-04] [-7.20046685e-04 -1.73026805e-03 -2.47734074e-03] [ 7.20046683e-04 1.73026804e-03 -2.47734074e-03] [ 6.59592063e-04 -3.23974910e-04 1.14011137e-03] [-6.59592061e-04 3.23974908e-04 1.14011137e-03] [-9.45372837e-04 -5.97486822e-04 -1.29477878e-03] [ 9.45372837e-04 5.97486822e-04 -1.29477878e-03] [-1.24405126e-03 5.67474156e-04 7.78941571e-04] [ 1.24405126e-03 -5.67474156e-04 7.78941570e-04] [-2.04508053e-03 -5.16119675e-04 8.08041946e-04] [ 2.04508053e-03 5.16119676e-04 8.08041946e-04] [ 9.91958902e-04 -1.11400289e-03 2.78953033e-04] [-9.91958902e-04 1.11400289e-03 2.78953034e-04] [-1.05641095e-03 -1.04723232e-03 1.81547329e-03] [ 1.05641095e-03 1.04723232e-03 1.81547330e-03] [ 5.14306223e-04 6.59527568e-04 6.05839266e-04] [-5.14306223e-04 -6.59527568e-04 6.05839265e-04] [-1.03466844e-03 -3.46478686e-04 9.03941721e-05] [ 1.03466844e-03 3.46478684e-04 9.03941701e-05] [-6.85099711e-04 -2.31748500e-03 -7.62473259e-05] [ 6.85099712e-04 2.31748500e-03 -7.62473249e-05] [ 1.64411417e-06 -7.70906310e-04 -5.45490158e-04] [-1.64411373e-06 7.70906310e-04 -5.45490159e-04] [ 1.61245435e-04 -1.23859469e-04 2.36989373e-04] [-1.61245434e-04 1.23859466e-04 2.36989372e-04] [ 4.58216060e-04 9.07402502e-04 -2.42645867e-04] [-4.58216059e-04 -9.07402494e-04 -2.42645867e-04] [-9.56921302e-05 1.91020371e-03 -4.50309808e-04] [ 9.56921303e-05 -1.91020371e-03 -4.50309808e-04] [ 1.65155067e-03 -7.97299914e-04 8.70935239e-04] [-1.65155067e-03 7.97299914e-04 8.70935240e-04] [ 3.16377256e-05 7.99591514e-05 2.90824712e-04] [-3.16377263e-05 -7.99591516e-05 2.90824713e-04] [-2.76896110e-04 -8.58624037e-04 9.45004117e-04] [ 2.76896110e-04 8.58624038e-04 9.45004114e-04] [ 1.46285638e-05 6.95202337e-04 -6.83849291e-04] [-1.46285645e-05 -6.95202336e-04 -6.83849288e-04] [ 1.16766871e-03 4.80174658e-04 -1.48501396e-04] [-1.16766871e-03 -4.80174659e-04 -1.48501398e-04] [-1.15986803e-03 9.07022102e-05 -4.83273227e-04] [ 1.15986803e-03 -9.07022109e-05 -4.83273224e-04]] Final stress: [-8.40938248e-05 -1.30512256e-04 -5.85323170e-05 1.69373369e-15 8.34316243e-16 2.62651743e-05] Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.60395886e-04 7.20655758e-04 -6.28515091e-04] [ 1.60395886e-04 -7.20655768e-04 -6.28515088e-04] [-3.64400850e-04 -1.22316190e-03 1.98225116e-04] [ 3.64400850e-04 1.22316190e-03 1.98225116e-04] [ 1.21440418e-03 1.69984666e-03 -1.52104531e-04] [-1.21440418e-03 -1.69984666e-03 -1.52104529e-04] [-7.72471565e-04 -1.55328423e-04 -1.47936786e-04] [ 7.72471565e-04 1.55328427e-04 -1.47936779e-04] [ 5.55561149e-04 6.52998263e-04 9.09058274e-04] [-5.55561150e-04 -6.52998263e-04 9.09058273e-04] [-7.25759506e-04 -5.56232265e-04 5.46381637e-04] [ 7.25759507e-04 5.56232266e-04 5.46381637e-04] [-9.22430477e-04 -8.52981091e-04 1.78899743e-04] [ 9.22430478e-04 8.52981091e-04 1.78899744e-04] [-3.24020374e-03 1.08484540e-04 5.66959534e-04] [ 3.24020374e-03 -1.08484538e-04 5.66959537e-04] [ 1.28236027e-03 1.45141007e-04 2.11280510e-04] [-1.28236027e-03 -1.45141008e-04 2.11280509e-04] [ 1.13244778e-03 8.70860987e-04 3.51367631e-05] [-1.13244778e-03 -8.70860988e-04 3.51367622e-05] [ 5.59442679e-04 -1.81275024e-04 2.59310874e-05] [-5.59442679e-04 1.81275024e-04 2.59310881e-05] [-1.68822362e-03 -9.98584947e-04 1.25873297e-04] [ 1.68822362e-03 9.98584943e-04 1.25873298e-04] [ 2.09185424e-05 1.49877892e-04 -8.03941686e-04] [-2.09185424e-05 -1.49877894e-04 -8.03941690e-04] [ 6.13749783e-04 5.61862909e-04 -5.94473154e-06] [-6.13749783e-04 -5.61862909e-04 -5.94473333e-06] [ 6.03116572e-04 1.79779939e-03 -2.58826924e-03] [-6.03116572e-04 -1.79779939e-03 -2.58826924e-03] [ 8.69058474e-04 -1.65353534e-03 4.03734402e-04] [-8.69058474e-04 1.65353534e-03 4.03734402e-04] [ 1.32072708e-03 5.85905251e-04 -3.76589975e-04] [-1.32072708e-03 -5.85905249e-04 -3.76589975e-04] [ 1.33315880e-03 4.24944590e-04 -8.10779046e-04] [-1.33315880e-03 -4.24944590e-04 -8.10779046e-04] [-6.25559066e-05 -6.18772761e-04 -7.62679331e-04] [ 6.25559068e-05 6.18772762e-04 -7.62679331e-04] [-3.03368943e-04 1.03977316e-03 -9.17144906e-04] [ 3.03368943e-04 -1.03977316e-03 -9.17144906e-04] [-3.21318312e-04 -3.81909452e-04 3.99806159e-04] [ 3.21318310e-04 3.81909450e-04 3.99806160e-04] [ 8.27872062e-05 -2.90288293e-05 1.23978463e-03] [-8.27872072e-05 2.90288289e-05 1.23978463e-03] [-2.19933983e-04 -1.72286581e-03 1.00850258e-03] [ 2.19933983e-04 1.72286581e-03 1.00850258e-03] [-1.03615874e-03 -8.33296979e-04 -1.80633178e-03] [ 1.03615874e-03 8.33296978e-04 -1.80633178e-03] [ 4.42046662e-04 -1.32469874e-03 1.53314501e-03] [-4.42046662e-04 1.32469874e-03 1.53314501e-03] [ 7.00533792e-04 6.74804677e-04 1.41199721e-03] [-7.00533792e-04 -6.74804678e-04 1.41199721e-03] [-7.23928977e-04 3.24943153e-04 -1.82690295e-04] [ 7.23928977e-04 -3.24943153e-04 -1.82690295e-04] [ 8.67628654e-05 4.65629718e-04 1.51471189e-03] [-8.67628682e-05 -4.65629717e-04 1.51471189e-03] [ 4.24430764e-04 -1.24745044e-03 4.98335989e-04] [-4.24430765e-04 1.24745044e-03 4.98335990e-04] [ 9.57854948e-04 -1.61352187e-03 -1.81644712e-03] [-9.57854947e-04 1.61352187e-03 -1.81644712e-03] [-1.26876624e-03 1.68730316e-04 -6.04011303e-04] [ 1.26876624e-03 -1.68730315e-04 -6.04011303e-04] [-1.81029053e-03 -5.08948922e-05 -1.01345864e-03] [ 1.81029053e-03 5.08948912e-05 -1.01345864e-03] [ 7.92118045e-04 3.05971278e-04 6.38909445e-04] [-7.92118045e-04 -3.05971279e-04 6.38909446e-04] [ 2.24519335e-03 -1.75016409e-03 1.47757462e-03] [-2.24519335e-03 1.75016409e-03 1.47757462e-03] [-1.09831154e-03 4.41993031e-04 -4.32701020e-04] [ 1.09831154e-03 -4.41993031e-04 -4.32701020e-04] [ 7.18641711e-04 -2.69432952e-03 1.52639257e-03] [-7.18641710e-04 2.69432952e-03 1.52639257e-03] [ 2.17264499e-04 -1.23632170e-03 -2.52705642e-03] [-2.17264499e-04 1.23632170e-03 -2.52705642e-03] [ 1.94018678e-03 -1.21787505e-04 1.45222703e-03] [-1.94018678e-03 1.21787506e-04 1.45222703e-03] [ 1.87581861e-04 -7.12743844e-04 1.99030997e-05] [-1.87581861e-04 7.12743844e-04 1.99030977e-05] [ 2.94840131e-03 -4.30760782e-04 3.33707898e-04] [-2.94840131e-03 4.30760783e-04 3.33707898e-04] [ 2.53333778e-03 6.01578156e-05 -3.38375662e-04] [-2.53333778e-03 -6.01578157e-05 -3.38375662e-04] [-6.32406250e-04 -1.19639266e-03 -7.87377247e-04] [ 6.32406251e-04 1.19639266e-03 -7.87377248e-04] [ 1.03152084e-03 6.84470058e-05 6.70532529e-04] [-1.03152084e-03 -6.84470086e-05 6.70532526e-04] [-2.20960907e-05 -6.56579517e-04 -1.00144770e-03] [ 2.20960900e-05 6.56579523e-04 -1.00144770e-03] [-2.64523505e-03 1.29836084e-04 -6.32082163e-04] [ 2.64523505e-03 -1.29836084e-04 -6.32082162e-04] [ 1.06173990e-03 -1.85120379e-04 -8.99533277e-05] [-1.06173990e-03 1.85120379e-04 -8.99533275e-05] [ 9.74510980e-04 -2.41583072e-04 2.91905942e-04] [-9.74510979e-04 2.41583076e-04 2.91905943e-04] [-1.95995096e-03 2.07125240e-04 2.93466939e-04] [ 1.95995096e-03 -2.07125238e-04 2.93466936e-04] [ 6.34962338e-04 2.08644413e-03 1.82408939e-04] [-6.34962337e-04 -2.08644413e-03 1.82408944e-04] [-1.00429223e-03 1.80766023e-03 -3.11692491e-04] [ 1.00429223e-03 -1.80766022e-03 -3.11692489e-04] [-6.46384409e-04 5.27780000e-04 1.04273765e-03] [ 6.46384409e-04 -5.27780001e-04 1.04273765e-03]] Final stress: [ 6.65847504e-05 5.97856821e-05 1.95602709e-04 -2.78418866e-15 1.26662660e-16 -1.10471385e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 1.38004057e-04 1.10666176e-03 -6.07619009e-04] [-1.38004056e-04 -1.10666177e-03 -6.07619007e-04] [ 3.64793690e-04 -1.32602171e-03 2.56407827e-04] [-3.64793690e-04 1.32602171e-03 2.56407826e-04] [-1.20906827e-03 1.63374008e-03 -1.28806522e-04] [ 1.20906827e-03 -1.63374008e-03 -1.28806521e-04] [ 6.90146470e-04 -1.74946440e-04 -5.60813430e-05] [-6.90146471e-04 1.74946440e-04 -5.60813401e-05] [-6.22018014e-04 6.90544219e-04 9.50297664e-04] [ 6.22018014e-04 -6.90544218e-04 9.50297664e-04] [ 7.09603677e-04 -5.10727792e-04 5.77853735e-04] [-7.09603677e-04 5.10727792e-04 5.77853735e-04] [ 9.32384988e-04 -7.94080507e-04 2.68358755e-04] [-9.32384988e-04 7.94080507e-04 2.68358755e-04] [ 3.21600685e-03 5.40097074e-05 9.27341021e-04] [-3.21600685e-03 -5.40097043e-05 9.27341022e-04] [-1.34768716e-03 1.43049802e-04 2.31816365e-04] [ 1.34768716e-03 -1.43049801e-04 2.31816366e-04] [-1.04634895e-03 8.02419264e-04 2.85131424e-05] [ 1.04634895e-03 -8.02419265e-04 2.85131416e-05] [-4.28494709e-04 -1.84398585e-04 -7.99722844e-05] [ 4.28494709e-04 1.84398586e-04 -7.99722850e-05] [ 1.59372016e-03 -6.58210371e-04 2.71192106e-04] [-1.59372017e-03 6.58210364e-04 2.71192106e-04] [ 6.56629565e-05 -4.61403866e-06 -6.38059317e-04] [-6.56629562e-05 4.61404031e-06 -6.38059315e-04] [-6.23595814e-04 4.45783472e-04 -2.46373622e-04] [ 6.23595813e-04 -4.45783471e-04 -2.46373619e-04] [-5.00981014e-04 1.85536921e-03 -2.50737829e-03] [ 5.00981014e-04 -1.85536921e-03 -2.50737829e-03] [-9.17898900e-04 -1.74207720e-03 4.16783174e-04] [ 9.17898900e-04 1.74207720e-03 4.16783174e-04] [-1.32407567e-03 5.13276219e-04 -5.21662580e-04] [ 1.32407567e-03 -5.13276217e-04 -5.21662580e-04] [-9.88263997e-05 6.35670405e-04 -7.42795089e-04] [ 9.88263997e-05 -6.35670404e-04 -7.42795088e-04] [ 1.27964651e-03 -3.48152138e-04 -7.27051962e-04] [-1.27964651e-03 3.48152139e-04 -7.27051962e-04] [-4.43976586e-04 4.40430601e-04 3.80310795e-04] [ 4.43976586e-04 -4.40430601e-04 3.80310795e-04] [-2.68220022e-04 -1.11763584e-03 -1.09988172e-03] [ 2.68220020e-04 1.11763584e-03 -1.09988172e-03] [-1.72907373e-04 1.63713453e-03 9.50024246e-04] [ 1.72907372e-04 -1.63713453e-03 9.50024246e-04] [ 1.87594217e-04 -2.60651613e-05 1.26256103e-03] [-1.87594217e-04 2.60651611e-05 1.26256103e-03] [ 2.96602900e-04 1.47848139e-03 1.57340000e-03] [-2.96602901e-04 -1.47848139e-03 1.57340000e-03] [-1.05201147e-03 7.73999755e-04 -1.58985460e-03] [ 1.05201147e-03 -7.73999757e-04 -1.58985460e-03] [-7.36272135e-04 -3.04714232e-04 -1.99167844e-04] [ 7.36272136e-04 3.04714232e-04 -1.99167844e-04] [ 6.85816951e-04 -6.91139184e-04 1.36456224e-03] [-6.85816952e-04 6.91139184e-04 1.36456224e-03] [ 3.64528214e-04 1.28649557e-03 5.23454681e-04] [-3.64528212e-04 -1.28649557e-03 5.23454680e-04] [-8.05433881e-05 -4.63256505e-04 1.47079201e-03] [ 8.05433893e-05 4.63256506e-04 1.47079201e-03] [-1.19511029e-03 -1.68020086e-04 -6.47706888e-04] [ 1.19511029e-03 1.68020086e-04 -6.47706888e-04] [ 1.03712655e-03 1.53735185e-03 -1.79015126e-03] [-1.03712655e-03 -1.53735185e-03 -1.79015126e-03] [ 7.95320894e-04 -3.15743961e-04 7.14140225e-04] [-7.95320896e-04 3.15743959e-04 7.14140224e-04] [-1.90209373e-03 -8.38980000e-05 -1.22423949e-03] [ 1.90209373e-03 8.38979986e-05 -1.22423948e-03] [-1.14347888e-03 -3.50668739e-04 -2.38578158e-04] [ 1.14347888e-03 3.50668739e-04 -2.38578158e-04] [ 2.47697792e-03 1.84820148e-03 1.46862678e-03] [-2.47697792e-03 -1.84820148e-03 1.46862678e-03] [ 3.55266590e-04 1.04844586e-03 -2.59716800e-03] [-3.55266590e-04 -1.04844586e-03 -2.59716800e-03] [ 5.38829760e-04 2.79280300e-03 1.49369167e-03] [-5.38829759e-04 -2.79280300e-03 1.49369167e-03] [ 3.49177768e-04 7.78787041e-04 5.20491119e-06] [-3.49177768e-04 -7.78787041e-04 5.20491109e-06] [ 1.89151945e-03 8.27655848e-05 1.42927057e-03] [-1.89151945e-03 -8.27655847e-05 1.42927057e-03] [-2.95487392e-03 -2.56742277e-04 1.63754928e-04] [ 2.95487392e-03 2.56742276e-04 1.63754927e-04] [-2.60112393e-03 1.13126990e-04 -2.95820669e-04] [ 2.60112393e-03 -1.13126990e-04 -2.95820668e-04] [ 6.66886748e-04 -1.11583850e-03 -9.70694355e-04] [-6.66886749e-04 1.11583850e-03 -9.70694355e-04] [-1.13735529e-03 6.75659152e-05 6.58495809e-04] [ 1.13735529e-03 -6.75659159e-05 6.58495809e-04] [ 9.44851318e-05 -9.13817049e-04 -1.06538050e-03] [-9.44851313e-05 9.13817058e-04 -1.06538050e-03] [ 2.75393341e-03 1.33337966e-04 -7.01229676e-04] [-2.75393341e-03 -1.33337966e-04 -7.01229676e-04] [-1.10196983e-03 -2.27705604e-04 -1.94296061e-05] [ 1.10196983e-03 2.27705604e-04 -1.94296065e-05] [-8.83376776e-04 -4.99781656e-04 3.11834582e-04] [ 8.83376778e-04 4.99781660e-04 3.11834581e-04] [ 7.37753275e-04 -2.08037664e-03 1.18550354e-04] [-7.37753276e-04 2.08037664e-03 1.18550352e-04] [-1.90114988e-03 -1.75872493e-04 2.49083395e-04] [ 1.90114988e-03 1.75872494e-04 2.49083397e-04] [-6.71213860e-04 -5.43941711e-04 1.01475983e-03] [ 6.71213860e-04 5.43941712e-04 1.01475983e-03] [-1.00616123e-03 -1.66617568e-03 -3.85979072e-04] [ 1.00616123e-03 1.66617569e-03 -3.85979070e-04]] Final stress: [ 6.62771444e-05 5.96089142e-05 1.94165968e-04 2.03018736e-15 -9.89402667e-16 1.09174544e-04] Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.83097414e-03 5.24643722e-04 3.32426337e-03] [-1.83097414e-03 -5.24643668e-04 3.32426335e-03] [ 1.30670073e-03 4.98471919e-03 -4.62237936e-03] [-1.30670073e-03 -4.98471921e-03 -4.62237935e-03] [-1.43235661e-03 -6.40344694e-03 2.69896202e-03] [ 1.43235661e-03 6.40344693e-03 2.69896202e-03] [ 1.42138125e-03 6.68835118e-03 -6.09315853e-03] [-1.42138125e-03 -6.68835120e-03 -6.09315855e-03] [-1.67642521e-03 3.67360769e-05 -1.06687328e-03] [ 1.67642521e-03 -3.67360776e-05 -1.06687328e-03] [ 2.05094369e-03 2.42609987e-03 -3.67919600e-03] [-2.05094369e-03 -2.42609988e-03 -3.67919600e-03] [ 5.06844761e-04 2.38696315e-03 3.10618345e-04] [-5.06844760e-04 -2.38696314e-03 3.10618356e-04] [ 8.04422328e-03 -3.50876278e-03 -4.33144009e-05] [-8.04422328e-03 3.50876277e-03 -4.33144086e-05] [-4.59404357e-03 -2.08813946e-03 4.94452828e-04] [ 4.59404357e-03 2.08813947e-03 4.94452833e-04] [-2.26046249e-03 -1.70813914e-03 2.23476775e-04] [ 2.26046249e-03 1.70813915e-03 2.23476778e-04] [-1.88040562e-03 3.97942200e-05 -5.75218386e-04] [ 1.88040562e-03 -3.97942204e-05 -5.75218382e-04] [ 4.49350566e-03 2.83982644e-03 -2.98887556e-03] [-4.49350566e-03 -2.83982635e-03 -2.98887559e-03] [-3.35134439e-03 -1.25907577e-03 2.38331719e-03] [ 3.35134439e-03 1.25907574e-03 2.38331715e-03] [-2.48365509e-03 2.24726635e-03 -3.75806092e-03] [ 2.48365509e-03 -2.24726636e-03 -3.75806093e-03] [-2.16281337e-04 -6.01034409e-03 8.81701929e-03] [ 2.16281338e-04 6.01034409e-03 8.81701929e-03] [-1.56323667e-03 6.48796371e-03 -2.54502143e-03] [ 1.56323667e-03 -6.48796370e-03 -2.54502142e-03] [-4.16770038e-03 -4.69183827e-03 4.12452520e-03] [ 4.16770038e-03 4.69183825e-03 4.12452521e-03] [-8.64926565e-03 1.69761976e-03 1.78969616e-03] [ 8.64926564e-03 -1.69761976e-03 1.78969615e-03] [-2.30455553e-03 4.18738837e-03 1.29566149e-03] [ 2.30455553e-03 -4.18738837e-03 1.29566149e-03] [ 2.85940316e-03 -1.72899545e-03 2.77144121e-03] [-2.85940317e-03 1.72899547e-03 2.77144122e-03] [-2.20142075e-03 1.24897619e-03 -1.78279337e-03] [ 2.20142076e-03 -1.24897617e-03 -1.78279338e-03] [-3.06467014e-03 5.79293356e-04 -3.19019832e-03] [ 3.06467014e-03 -5.79293358e-04 -3.19019832e-03] [-1.32963877e-03 7.78717374e-03 -2.30498300e-04] [ 1.32963877e-03 -7.78717374e-03 -2.30498301e-04] [ 3.48550716e-03 2.70117827e-03 7.08931194e-03] [-3.48550716e-03 -2.70117826e-03 7.08931193e-03] [ 1.79450011e-03 3.40143612e-03 -6.07491922e-03] [-1.79450011e-03 -3.40143611e-03 -6.07491920e-03] [-6.11612668e-03 -2.48424166e-03 -4.17958241e-03] [ 6.11612668e-03 2.48424165e-03 -4.17958241e-03] [-1.46859061e-03 -1.74534007e-03 1.50965266e-03] [ 1.46859061e-03 1.74534006e-03 1.50965266e-03] [-4.52665614e-03 -1.88905879e-03 -2.86383751e-03] [ 4.52665614e-03 1.88905879e-03 -2.86383751e-03] [-3.59890020e-03 3.48510703e-03 1.35918741e-04] [ 3.59890020e-03 -3.48510704e-03 1.35918736e-04] [-3.37893006e-03 6.55588394e-03 6.11084656e-03] [ 3.37893007e-03 -6.55588395e-03 6.11084656e-03] [ 2.35427101e-03 5.70387026e-04 2.09917109e-03] [-2.35427101e-03 -5.70387031e-04 2.09917109e-03] [ 3.46361735e-03 -1.44747449e-05 3.83986576e-03] [-3.46361734e-03 1.44747555e-05 3.83986576e-03] [ 3.98606249e-03 1.22557720e-04 -4.21513218e-03] [-3.98606251e-03 -1.22557707e-04 -4.21513219e-03] [-8.46651808e-03 7.57861434e-03 -1.28247787e-03] [ 8.46651808e-03 -7.57861434e-03 -1.28247788e-03] [ 3.29785761e-03 -2.19344739e-03 1.58153842e-04] [-3.29785762e-03 2.19344740e-03 1.58153847e-04] [-6.55073336e-03 1.40905945e-02 -6.96664003e-03] [ 6.55073336e-03 -1.40905945e-02 -6.96664003e-03] [-8.16033195e-04 6.57589843e-03 6.72559979e-03] [ 8.16033193e-04 -6.57589843e-03 6.72559979e-03] [-6.86282100e-03 -1.40025912e-03 -6.75722387e-03] [ 6.86282100e-03 1.40025912e-03 -6.75722388e-03] [-1.27868148e-03 4.80582478e-03 -3.35618440e-03] [ 1.27868148e-03 -4.80582478e-03 -3.35618440e-03] [-6.95640316e-03 9.95406401e-04 -4.04137098e-04] [ 6.95640316e-03 -9.95406385e-04 -4.04137085e-04] [-4.18390738e-03 -6.07537348e-04 1.04003476e-03] [ 4.18390738e-03 6.07537350e-04 1.04003476e-03] [ 2.03034052e-03 3.36678380e-03 3.27976877e-03] [-2.03034052e-03 -3.36678380e-03 3.27976876e-03] [-3.64324395e-03 -1.55634387e-03 -1.72971751e-03] [ 3.64324395e-03 1.55634388e-03 -1.72971750e-03] [ 1.95818953e-03 -3.14326440e-03 1.66586294e-03] [-1.95818953e-03 3.14326436e-03 1.66586294e-03] [ 3.02247237e-03 -1.52740591e-03 1.63434319e-03] [-3.02247237e-03 1.52740591e-03 1.63434319e-03] [-3.82562095e-03 1.69162502e-03 1.44948808e-03] [ 3.82562096e-03 -1.69162502e-03 1.44948808e-03] [ 9.15522651e-04 -5.34939982e-04 -8.85092005e-05] [-9.15522653e-04 5.34939916e-04 -8.85091959e-05] [ 8.02489415e-03 1.16747727e-03 3.17421706e-04] [-8.02489415e-03 -1.16747727e-03 3.17421724e-04] [-3.07876819e-03 -3.38376131e-03 2.24027863e-03] [ 3.07876820e-03 3.38376131e-03 2.24027861e-03] [ 3.86663951e-03 -5.41343457e-03 2.16698147e-03] [-3.86663951e-03 5.41343456e-03 2.16698150e-03] [ 2.60713311e-03 -1.59347459e-03 -1.20218461e-03] [-2.60713310e-03 1.59347459e-03 -1.20218464e-03]] Final stress: [-1.47853642e-04 1.78559842e-05 -3.68686650e-04 -8.03119031e-15 -3.27510961e-16 2.90481778e-04] Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 136 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-7.23414528e-04 -5.85273496e-05 3.42072015e-04] [ 7.12537049e-04 -1.70001078e-04 -6.02766567e-04] [-9.42007515e-04 -9.86112162e-04 -5.50100719e-05] [ 9.91522778e-04 -1.05687531e-03 -1.35785632e-04] [-1.29790145e-03 -3.07341276e-04 -2.22238408e-03] [ 1.38420383e-03 -1.18453348e-04 2.15518549e-03] [ 7.15352155e-04 -1.68666934e-04 1.39057506e-03] [-6.33358861e-04 -6.38097800e-04 -1.85339738e-03] [-3.67107021e-04 4.34686370e-04 1.35352930e-03] [ 3.87604745e-04 4.62520905e-04 -1.40586955e-03] [-9.15756024e-04 -3.95667935e-04 1.58213079e-03] [ 8.94597510e-04 -4.57469372e-04 -1.68138964e-03] [ 8.84734547e-04 9.37682957e-04 7.46476467e-04] [-8.64264946e-04 9.68932268e-04 -9.59199891e-04] [ 3.42093033e-03 3.71001669e-04 1.04605385e-03] [-3.38427395e-03 5.29338403e-04 -1.12490901e-03] [-5.40368004e-04 3.40887538e-05 6.68336272e-04] [ 5.14038974e-04 1.78664996e-05 -8.16659179e-04] [ 1.79102654e-04 -7.21987566e-04 -1.04030454e-03] [-1.72535672e-04 -6.73955480e-04 1.20838951e-03] [-1.53363050e-03 -1.13478508e-03 -1.12894060e-03] [ 1.48742203e-03 -1.20009049e-03 1.10516586e-03] [ 5.23438575e-04 -1.22071191e-03 -4.54113922e-04] [-5.36911671e-04 -1.24946151e-03 6.19909584e-04] [ 4.90984232e-04 -2.24421187e-03 7.17530779e-04] [-5.50217304e-04 -1.68557369e-03 -3.13834691e-04] [ 6.68783790e-05 -1.43969077e-04 -1.00225141e-03] [-8.90692337e-05 -3.21577571e-04 1.08630430e-03] [-7.67203646e-04 2.15713452e-03 2.76839099e-03] [ 7.37825675e-04 1.97038878e-03 -2.61636688e-03] [-7.25235923e-04 -1.37174439e-03 4.53109583e-04] [ 6.91987400e-04 -1.27869222e-03 -6.36289146e-04] [ 1.62751832e-03 -1.17701200e-03 -1.35085935e-04] [-1.64411003e-03 -8.87662080e-04 9.96994681e-05] [ 1.16757453e-03 4.79791484e-04 5.87135779e-05] [-6.77764818e-04 2.83427715e-03 -7.78827054e-04] [-1.57742054e-03 6.67655796e-04 1.10401279e-04] [ 8.39928306e-04 2.74312385e-03 8.33269247e-04] [-8.78410917e-04 4.99416627e-04 5.17707961e-04] [ 1.28314257e-03 1.14910252e-03 -9.62712288e-04] [ 7.37701450e-04 4.56211382e-04 -4.55763627e-04] [-1.26833058e-03 1.11014787e-03 1.11299915e-03] [ 1.48386060e-03 5.15672526e-04 2.47835922e-03] [ 1.01360474e-03 7.16591609e-04 1.64797151e-03] [-1.52285660e-03 8.51901059e-04 -2.28089903e-03] [-9.38992057e-04 3.56113585e-04 -1.44130063e-03] [ 4.26301964e-04 -9.31575788e-04 -1.03594541e-03] [ 1.41333556e-03 -7.98167268e-04 1.32860072e-04] [-3.97397883e-04 -1.01115348e-03 1.19979440e-03] [-1.38521999e-03 -6.73834852e-04 -5.51183754e-05] [ 5.41716257e-04 2.74041101e-04 1.48512776e-03] [ 1.94184863e-03 4.29870499e-04 -1.46263802e-03] [-7.01274221e-04 1.83112411e-04 -1.51671035e-03] [-1.67200002e-03 5.70106863e-04 1.40645102e-03] [ 6.04114811e-05 1.63762762e-03 3.30493767e-04] [ 1.77877968e-03 1.05124777e-04 6.33968840e-04] [ 1.96180083e-05 1.58208141e-03 -2.55905544e-04] [-1.90502829e-03 2.13089704e-04 -5.41099642e-04] [ 2.94455315e-04 -1.48929069e-03 1.26227576e-03] [ 3.97933804e-03 5.83019955e-05 1.12963350e-03] [-3.06929871e-04 -1.69938296e-03 -1.27126829e-03] [-3.93329434e-03 2.30429501e-04 -1.17041504e-03] [ 8.40996380e-06 -2.47495294e-03 -3.45527501e-04] [ 2.53731199e-04 1.28749604e-03 -2.97702228e-04] [-4.55386728e-05 -2.46702256e-03 1.51261439e-04] [-1.85338392e-04 1.28777859e-03 1.29829761e-04] [-1.35667767e-03 -8.17363402e-04 1.86682627e-04] [ 4.72805979e-04 7.82980786e-04 -1.56234420e-03] [ 1.46380544e-03 -8.04272022e-04 -1.79205426e-04] [-5.35218041e-04 7.73097754e-04 1.56193754e-03] [ 9.96644299e-04 -2.15451433e-03 8.69594013e-04] [ 2.13129038e-03 6.69031153e-04 1.00713561e-03] [-9.71018090e-04 -2.18438525e-03 -8.54020296e-04] [-2.16558836e-03 8.53199090e-04 -1.03970837e-03] [-3.14121800e-04 -3.06724030e-04 1.17110429e-03] [-3.58446170e-05 5.52768774e-04 2.04880378e-04] [ 3.67588518e-04 -2.97614578e-04 -1.27850364e-03] [-5.35149476e-05 5.39834339e-04 -3.40439856e-04] [-2.69897802e-03 9.92496696e-04 1.34441592e-03] [ 2.70687629e-03 9.49035797e-04 -1.15710598e-03] [-1.04948608e-03 9.49409924e-04 8.38370965e-04] [ 1.09770294e-03 9.06918008e-04 -7.75533804e-04] [-6.88541551e-04 -4.57484799e-04 -1.56749064e-03] [ 6.83221952e-04 -4.25412059e-04 1.55755992e-03] [ 7.67223152e-05 7.02831129e-04 -2.12831125e-03] [-4.21474858e-05 7.62501853e-04 2.06562113e-03] [ 2.44000301e-03 -5.37772790e-04 8.21081241e-04] [-2.54593037e-03 1.03654626e-04 -1.01896640e-03] [ 5.97584074e-04 -1.30633394e-03 -8.07007095e-04] [-6.09566078e-04 -1.21475574e-03 7.82201080e-04] [ 1.41678790e-03 9.12321863e-04 1.63092626e-03] [-1.37539381e-03 8.41278191e-04 -1.70345081e-03] [-1.63683928e-04 4.30152507e-04 -2.10252501e-03] [ 2.18575595e-04 2.81810420e-04 2.20807276e-03] [ 1.19162277e-04 1.00010150e-03 1.96924275e-03] [-4.57322348e-04 2.76634666e-03 1.06600717e-03] [-9.08523339e-05 9.28457372e-04 -1.65274731e-03] [ 4.42233792e-04 2.82968319e-03 -8.03955749e-04] [ 1.06941652e-03 -1.16390978e-03 -7.59745034e-04] [-7.27428540e-04 -1.80835898e-03 1.41066395e-03] [-1.02250421e-03 -1.15069777e-03 6.10401526e-04] [ 7.32122990e-04 -1.80699123e-03 -1.48242473e-03]] Final stress: [-5.21637863e-06 1.60153642e-06 -5.57865533e-06 8.28978730e-05 -1.83395505e-07 4.43672658e-05] Minimization converged after 139 steps. Minimization converged after 139 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 146 steps. Minimization converged after 147 steps. Minimization converged after 148 steps. Minimization converged after 144 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 3.01849480e-03 -7.98179442e-04 -4.91308124e-04] [-3.01849480e-03 7.98179566e-04 -4.91308152e-04] [ 2.38322588e-03 -6.46208437e-04 -8.71156966e-04] [-2.38322588e-03 6.46208420e-04 -8.71156955e-04] [ 3.33123217e-03 -7.89937045e-04 4.87997012e-04] [-3.33123217e-03 7.89937040e-04 4.87997007e-04] [-5.44030174e-03 9.73361772e-04 -1.01746763e-03] [ 5.44030174e-03 -9.73361800e-04 -1.01746767e-03] [-1.64032955e-03 1.58775431e-04 9.09840494e-05] [ 1.64032955e-03 -1.58775435e-04 9.09840538e-05] [ 9.32726839e-04 4.13430196e-04 -3.93462575e-04] [-9.32726839e-04 -4.13430204e-04 -3.93462587e-04] [ 1.45801540e-04 4.86804070e-04 -1.99429349e-04] [-1.45801541e-04 -4.86804061e-04 -1.99429340e-04] [-6.01222530e-03 2.84756161e-04 -2.85863116e-04] [ 6.01222530e-03 -2.84756192e-04 -2.85863134e-04] [-9.75609368e-04 2.25164784e-05 -2.86615391e-04] [ 9.75609367e-04 -2.25164738e-05 -2.86615386e-04] [-7.47161509e-04 -5.08109905e-04 3.58336984e-04] [ 7.47161509e-04 5.08109919e-04 3.58336992e-04] [ 5.89652408e-03 5.91653445e-05 -4.72797294e-04] [-5.89652408e-03 -5.91653471e-05 -4.72797290e-04] [-1.02770604e-03 5.35722838e-03 1.19856615e-03] [ 1.02770604e-03 -5.35722830e-03 1.19856613e-03] [-8.05499932e-04 -1.57779595e-03 2.19178591e-03] [ 8.05499933e-04 1.57779592e-03 2.19178588e-03] [-1.99747405e-03 -1.19605746e-03 4.35996969e-04] [ 1.99747405e-03 1.19605745e-03 4.35996957e-04] [ 4.36406804e-03 6.56186171e-04 -3.05718696e-05] [-4.36406804e-03 -6.56186167e-04 -3.05718625e-05] [-2.22613168e-03 -4.29107954e-04 3.08033788e-05] [ 2.22613168e-03 4.29107958e-04 3.08033845e-05] [-4.47496131e-03 -5.83989930e-04 -2.71891479e-04] [ 4.47496131e-03 5.83989908e-04 -2.71891467e-04] [-4.22866568e-03 4.57762509e-03 4.84254656e-04] [ 4.22866568e-03 -4.57762509e-03 4.84254655e-04] [ 2.34980635e-03 5.17324883e-03 -1.28299240e-04] [-2.34980635e-03 -5.17324883e-03 -1.28299238e-04] [ 1.85623050e-03 -1.53875492e-04 4.23846956e-03] [-1.85623052e-03 1.53875505e-04 4.23846957e-03] [-3.44134607e-03 -1.90544745e-03 -5.06165774e-03] [ 3.44134608e-03 1.90544747e-03 -5.06165775e-03] [-1.94186873e-03 -3.33603535e-03 -3.27436350e-03] [ 1.94186873e-03 3.33603535e-03 -3.27436350e-03] [ 9.14732278e-04 -1.69334246e-03 4.31629679e-03] [-9.14732276e-04 1.69334245e-03 4.31629679e-03] [-2.17189953e-03 3.76291304e-03 5.09246722e-03] [ 2.17189953e-03 -3.76291301e-03 5.09246720e-03] [ 1.00358343e-03 2.29516833e-03 -3.25839828e-03] [-1.00358343e-03 -2.29516831e-03 -3.25839826e-03] [-1.20939366e-03 -2.30920562e-03 -3.14277070e-03] [ 1.20939366e-03 2.30920562e-03 -3.14277070e-03] [ 2.89795429e-04 -2.71292239e-03 3.06865719e-03] [-2.89795428e-04 2.71292239e-03 3.06865719e-03] [ 3.47464954e-03 -4.56756900e-03 8.41931369e-04] [-3.47464954e-03 4.56756899e-03 8.41931374e-04] [-4.20326406e-03 -3.49773069e-03 -6.84765408e-04] [ 4.20326406e-03 3.49773068e-03 -6.84765413e-04] [ 4.65769533e-03 1.64278337e-03 -4.77084885e-04] [-4.65769533e-03 -1.64278337e-03 -4.77084884e-04] [-5.22101791e-03 6.54008182e-04 1.52551167e-04] [ 5.22101791e-03 -6.54008185e-04 1.52551166e-04] [ 3.77284496e-03 2.94068306e-03 4.41673967e-03] [-3.77284494e-03 -2.94068304e-03 4.41673969e-03] [-4.48221824e-03 2.97088586e-03 -6.05249359e-03] [ 4.48221823e-03 -2.97088584e-03 -6.05249360e-03] [-2.66201858e-04 1.35326730e-03 1.99253205e-03] [ 2.66201861e-04 -1.35326730e-03 1.99253204e-03] [ 1.07530372e-03 1.39834031e-03 -1.65009334e-03] [-1.07530372e-03 -1.39834031e-03 -1.65009333e-03] [ 5.17398977e-03 3.19659494e-03 -3.88177303e-03] [-5.17398977e-03 -3.19659494e-03 -3.88177303e-03] [-6.00553394e-03 2.74660657e-03 3.71796675e-03] [ 6.00553394e-03 -2.74660657e-03 3.71796675e-03] [ 2.63326350e-04 7.59570928e-04 -2.86837496e-03] [-2.63326350e-04 -7.59570927e-04 -2.86837497e-03] [ 5.92409061e-05 7.85844483e-04 2.88424792e-03] [-5.92409056e-05 -7.85844481e-04 2.88424793e-03] [ 2.34536817e-03 3.29292624e-04 4.18997702e-06] [-2.34536817e-03 -3.29292614e-04 4.18998529e-06] [-2.04182507e-03 -6.84956106e-05 6.90046569e-05] [ 2.04182507e-03 6.84956120e-05 6.90046503e-05] [ 2.80725481e-03 -2.43004643e-04 -5.94079120e-05] [-2.80725481e-03 2.43004643e-04 -5.94079143e-05] [-2.15987353e-03 1.94942002e-04 -1.97938031e-04] [ 2.15987353e-03 -1.94941987e-04 -1.97938018e-04] [-3.09610602e-03 -9.38550492e-04 -3.99325514e-04] [ 3.09610602e-03 9.38550396e-04 -3.99325508e-04] [ 5.24999184e-03 1.00944444e-04 -1.20831685e-04] [-5.24999184e-03 -1.00944442e-04 -1.20831690e-04] [-6.77963782e-03 2.47709037e-04 -1.61149869e-05] [ 6.77963782e-03 -2.47709035e-04 -1.61149895e-05] [-1.73824527e-03 -3.82632849e-03 4.24627332e-05] [ 1.73824527e-03 3.82632843e-03 4.24627368e-05] [ 2.78907242e-03 -9.84931806e-04 -1.14527099e-03] [-2.78907241e-03 9.84931791e-04 -1.14527096e-03] [-3.14817521e-03 -1.73894788e-03 2.69301296e-03] [ 3.14817521e-03 1.73894787e-03 2.69301293e-03] [-5.43980023e-03 -5.19432498e-03 -1.33575317e-03] [ 5.43980023e-03 5.19432497e-03 -1.33575314e-03] [ 4.68959175e-03 -3.33304895e-03 -7.33974332e-04] [-4.68959175e-03 3.33304895e-03 -7.33974361e-04]] Final stress: [-1.57100349e-05 6.25108978e-06 -4.93350268e-07 -8.95139766e-16 7.05116772e-16 -8.05144801e-05] Minimization converged after 108 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 16 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 16 steps. Minimization converged after 30 steps. Minimization converged after 25 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 119 steps. Minimization converged after 116 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.45170553e-03 2.38961696e-03 -8.49583359e-04] [-2.45170553e-03 -2.38961696e-03 -8.49583358e-04] [ 2.43814520e-03 -1.49377830e-03 8.29542351e-04] [-2.43814520e-03 1.49377830e-03 8.29542350e-04] [ 1.86771322e-03 -1.96723428e-03 1.24495406e-03] [-1.86771322e-03 1.96723428e-03 1.24495406e-03] [-4.44791079e-03 4.45130047e-04 1.45326176e-03] [ 4.44791079e-03 -4.45130048e-04 1.45326175e-03] [-6.28495527e-05 -5.65766147e-03 2.39995576e-03] [ 6.28495514e-05 5.65766147e-03 2.39995576e-03] [ 5.35546549e-04 2.95773143e-03 1.56150536e-04] [-5.35546550e-04 -2.95773143e-03 1.56150536e-04] [-3.00994306e-03 -9.93216467e-04 -8.87613963e-05] [ 3.00994306e-03 9.93216466e-04 -8.87613956e-05] [-3.72098665e-03 -2.33367530e-03 -2.69944763e-03] [ 3.72098665e-03 2.33367529e-03 -2.69944763e-03] [ 1.01190534e-03 -1.30607102e-03 1.00607844e-03] [-1.01190534e-03 1.30607102e-03 1.00607844e-03] [-7.92599539e-04 2.78321634e-03 -3.64570319e-04] [ 7.92599537e-04 -2.78321634e-03 -3.64570319e-04] [ 5.71282532e-03 4.71806147e-03 -3.39830554e-03] [-5.71282532e-03 -4.71806147e-03 -3.39830554e-03] [-5.65207421e-03 -1.29659666e-04 1.20040018e-03] [ 5.65207421e-03 1.29659660e-04 1.20040018e-03] [ 1.53763857e-03 -1.05992543e-03 3.19023398e-04] [-1.53763857e-03 1.05992543e-03 3.19023398e-04] [-7.57282196e-04 3.24251923e-04 1.50039511e-03] [ 7.57282196e-04 -3.24251920e-04 1.50039511e-03] [ 2.07175789e-03 -4.25673635e-03 2.27855733e-03] [-2.07175789e-03 4.25673635e-03 2.27855733e-03] [ 5.34539483e-04 3.74902196e-03 -3.24040580e-03] [-5.34539482e-04 -3.74902196e-03 -3.24040580e-03] [-4.48806173e-03 -1.15437610e-04 -1.36519445e-04] [ 4.48806172e-03 1.15437610e-04 -1.36519444e-04] [-2.31742843e-03 1.57751984e-03 -3.53159972e-03] [ 2.31742843e-03 -1.57751984e-03 -3.53159972e-03] [ 8.74156845e-04 1.85032571e-03 4.49927145e-04] [-8.74156845e-04 -1.85032571e-03 4.49927144e-04] [-9.68293977e-04 -1.96053844e-03 2.88607170e-03] [ 9.68293975e-04 1.96053844e-03 2.88607170e-03] [ 4.70472934e-04 -2.59985578e-04 -5.35492541e-03] [-4.70472931e-04 2.59985580e-04 -5.35492541e-03] [ 8.17531324e-04 -1.91164663e-03 -2.25751547e-03] [-8.17531325e-04 1.91164663e-03 -2.25751547e-03] [ 3.46128016e-03 -5.88680418e-03 3.61829631e-03] [-3.46128016e-03 5.88680418e-03 3.61829631e-03] [-4.76181003e-05 2.11423785e-03 4.13260043e-03] [ 4.76181011e-05 -2.11423785e-03 4.13260043e-03] [ 1.88827534e-03 2.35500631e-03 -2.24057803e-03] [-1.88827534e-03 -2.35500631e-03 -2.24057803e-03] [-7.55017613e-05 -7.43720504e-04 1.01371994e-03] [ 7.55017610e-05 7.43720503e-04 1.01371994e-03] [-2.20247915e-03 -1.43329208e-04 3.97938857e-03] [ 2.20247915e-03 1.43329210e-04 3.97938857e-03] [ 2.60902017e-03 1.24159816e-04 -1.64652177e-03] [-2.60902017e-03 -1.24159815e-04 -1.64652177e-03] [ 9.42297629e-04 -8.10467327e-04 -5.46684305e-03] [-9.42297627e-04 8.10467330e-04 -5.46684305e-03] [ 5.00462640e-03 -1.12064737e-03 -1.58661144e-05] [-5.00462640e-03 1.12064737e-03 -1.58661113e-05] [-6.11319470e-04 1.70776544e-03 6.49396180e-04] [ 6.11319472e-04 -1.70776544e-03 6.49396179e-04] [ 1.55630850e-03 1.56572765e-03 7.27657832e-03] [-1.55630850e-03 -1.56572766e-03 7.27657832e-03] [-9.07010592e-04 1.28654217e-03 -7.26924231e-03] [ 9.07010589e-04 -1.28654217e-03 -7.26924231e-03] [ 6.60375324e-04 2.28679191e-04 1.04118060e-03] [-6.60375325e-04 -2.28679192e-04 1.04118060e-03] [ 1.40801306e-03 -1.62157442e-03 -2.28990084e-03] [-1.40801306e-03 1.62157442e-03 -2.28990084e-03] [ 9.19280899e-03 1.88474042e-03 2.41730989e-03] [-9.19280898e-03 -1.88474042e-03 2.41730989e-03] [-4.34290651e-03 -1.38362921e-03 3.65684781e-03] [ 4.34290651e-03 1.38362921e-03 3.65684781e-03] [ 1.53088623e-03 1.11272682e-03 -2.13484602e-03] [-1.53088623e-03 -1.11272681e-03 -2.13484601e-03] [-2.12553455e-03 -3.87099539e-04 2.45562738e-03] [ 2.12553455e-03 3.87099539e-04 2.45562738e-03] [ 2.34911340e-03 -1.91209477e-03 1.06024752e-03] [-2.34911340e-03 1.91209477e-03 1.06024752e-03] [-1.37545295e-03 -6.09680914e-04 -4.91808039e-04] [ 1.37545295e-03 6.09680912e-04 -4.91808039e-04] [-1.14840244e-03 -2.27480714e-03 1.56402290e-03] [ 1.14840244e-03 2.27480713e-03 1.56402290e-03] [-1.40350435e-03 2.32667892e-03 -7.25036097e-04] [ 1.40350435e-03 -2.32667893e-03 -7.25036097e-04] [ 5.80409169e-04 -3.29273202e-03 6.96243053e-05] [-5.80409168e-04 3.29273201e-03 6.96243091e-05] [ 2.65902469e-03 3.74241809e-04 2.38495366e-04] [-2.65902469e-03 -3.74241810e-04 2.38495365e-04] [-5.39898816e-03 2.62189926e-03 -1.26956700e-03] [ 5.39898816e-03 -2.62189926e-03 -1.26956700e-03] [ 3.01443133e-04 -1.27809750e-03 -1.30809910e-03] [-3.01443132e-04 1.27809750e-03 -1.30809911e-03] [-1.74084366e-03 1.13138959e-03 -3.95157606e-04] [ 1.74084366e-03 -1.13138959e-03 -3.95157605e-04] [-3.08463425e-03 -3.55539069e-03 2.52295911e-03] [ 3.08463425e-03 3.55539069e-03 2.52295910e-03] [-5.26121323e-03 -1.99819807e-03 -2.35327608e-03] [ 5.26121323e-03 1.99819807e-03 -2.35327608e-03] [ 1.00451618e-03 6.85258806e-04 -1.89223626e-03] [-1.00451618e-03 -6.85258807e-04 -1.89223626e-03]] Final stress: [-1.11989972e-04 -4.72321495e-05 -8.42248807e-05 2.99045810e-15 -1.07068440e-14 -9.39275877e-05] Minimization converged after 115 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 117 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.95944972e-03 7.23826603e-04 -1.20591859e-03] [ 1.95944972e-03 -7.23826603e-04 -1.20591859e-03] [-3.14802328e-03 -4.13531281e-03 -1.08824375e-03] [ 3.14802328e-03 4.13531282e-03 -1.08824375e-03] [-1.34352883e-03 9.20606961e-04 2.43764443e-03] [ 1.34352883e-03 -9.20606961e-04 2.43764443e-03] [ 4.52433010e-03 5.84236375e-03 5.99718393e-04] [-4.52433010e-03 -5.84236375e-03 5.99718388e-04] [-3.43813106e-04 -1.96294689e-03 2.48317447e-03] [ 3.43813104e-04 1.96294689e-03 2.48317447e-03] [-4.90687930e-04 4.51621035e-04 -4.26275893e-03] [ 4.90687928e-04 -4.51621033e-04 -4.26275893e-03] [ 3.90871027e-03 -1.26220655e-05 2.95158020e-03] [-3.90871027e-03 1.26220645e-05 2.95158020e-03] [ 6.03211400e-03 1.76242496e-03 8.17872301e-03] [-6.03211400e-03 -1.76242495e-03 8.17872300e-03] [ 9.40133735e-04 -4.61711814e-03 3.88546868e-03] [-9.40133734e-04 4.61711814e-03 3.88546868e-03] [-2.15692067e-03 1.05143130e-04 -3.29862294e-03] [ 2.15692068e-03 -1.05143133e-04 -3.29862293e-03] [-7.64761922e-03 2.83582650e-03 -1.76687062e-03] [ 7.64761922e-03 -2.83582650e-03 -1.76687062e-03] [ 5.98348198e-03 -1.14643764e-03 -1.58066095e-03] [-5.98348198e-03 1.14643763e-03 -1.58066095e-03] [-2.17192605e-03 -5.85673708e-03 3.97377181e-03] [ 2.17192605e-03 5.85673708e-03 3.97377181e-03] [-1.82870130e-04 -1.68543809e-03 -9.90572939e-03] [ 1.82870130e-04 1.68543809e-03 -9.90572938e-03] [-3.74452483e-03 -7.66740469e-04 3.95797859e-03] [ 3.74452483e-03 7.66740468e-04 3.95797859e-03] [-2.25881630e-04 -3.70985118e-03 -2.90332946e-03] [ 2.25881629e-04 3.70985118e-03 -2.90332945e-03] [ 4.60666293e-03 2.42191588e-03 -7.63024206e-05] [-4.60666293e-03 -2.42191588e-03 -7.63024206e-05] [ 2.12152526e-03 -1.85035857e-03 1.01585422e-03] [-2.12152526e-03 1.85035857e-03 1.01585422e-03] [-3.30536715e-03 -2.40458622e-03 -2.04131775e-03] [ 3.30536715e-03 2.40458622e-03 -2.04131775e-03] [ 1.43733855e-03 -1.21928988e-03 -4.39570082e-03] [-1.43733855e-03 1.21928988e-03 -4.39570082e-03] [-2.01512471e-03 -3.09284758e-04 2.37453757e-03] [ 2.01512471e-03 3.09284758e-04 2.37453756e-03] [ 2.44723480e-03 1.45434385e-03 5.33148506e-03] [-2.44723481e-03 -1.45434385e-03 5.33148506e-03] [-5.42761347e-04 8.01407865e-03 -2.97079657e-03] [ 5.42761346e-04 -8.01407864e-03 -2.97079657e-03] [ 1.81511284e-03 -4.40304256e-03 -3.36667881e-04] [-1.81511284e-03 4.40304255e-03 -3.36667876e-04] [-1.41272912e-03 -2.24385797e-04 4.21230290e-03] [ 1.41272912e-03 2.24385795e-04 4.21230290e-03] [-3.93450137e-03 2.46313146e-03 4.94206631e-04] [ 3.93450137e-03 -2.46313146e-03 4.94206630e-04] [ 1.30969803e-03 -8.46556123e-04 7.24917134e-04] [-1.30969803e-03 8.46556125e-04 7.24917137e-04] [-4.09446819e-03 6.37708984e-04 -1.50222526e-03] [ 4.09446819e-03 -6.37708986e-04 -1.50222525e-03] [ 4.49657956e-03 -1.31195266e-03 3.71781225e-03] [-4.49657956e-03 1.31195266e-03 3.71781225e-03] [-3.67397585e-03 -1.65892820e-03 2.40266382e-03] [ 3.67397585e-03 1.65892820e-03 2.40266382e-03] [ 3.48385267e-03 1.70493304e-03 -1.03832096e-03] [-3.48385267e-03 -1.70493304e-03 -1.03832096e-03] [-2.64539083e-03 -1.19730335e-03 -5.39579829e-03] [ 2.64539083e-03 1.19730335e-03 -5.39579829e-03] [ 5.64663678e-04 -3.71623460e-03 9.51919173e-03] [-5.64663678e-04 3.71623460e-03 9.51919173e-03] [ 4.56420550e-03 1.22840957e-03 -2.87471205e-03] [-4.56420550e-03 -1.22840957e-03 -2.87471205e-03] [ 2.33682753e-03 -3.45028257e-03 4.96410046e-03] [-2.33682753e-03 3.45028257e-03 4.96410046e-03] [-8.86962913e-03 8.52090079e-04 2.11877809e-04] [ 8.86962913e-03 -8.52090078e-04 2.11877808e-04] [ 1.01512631e-02 2.44803434e-03 -3.94935957e-03] [-1.01512631e-02 -2.44803434e-03 -3.94935957e-03] [-3.28905719e-03 1.98432214e-03 -2.42323992e-03] [ 3.28905719e-03 -1.98432214e-03 -2.42323992e-03] [ 3.85860182e-03 -2.99479414e-03 -6.45539653e-03] [-3.85860182e-03 2.99479414e-03 -6.45539653e-03] [-7.12282991e-04 2.34497389e-03 2.22922558e-04] [ 7.12282992e-04 -2.34497390e-03 2.22922556e-04] [-1.39876458e-03 8.67450487e-03 9.90982182e-04] [ 1.39876458e-03 -8.67450487e-03 9.90982185e-04] [ 1.53958765e-05 2.18478276e-03 9.00575230e-04] [-1.53958788e-05 -2.18478276e-03 9.00575232e-04] [ 2.70177475e-03 1.27886379e-03 -2.25347680e-03] [-2.70177475e-03 -1.27886379e-03 -2.25347680e-03] [-2.95446605e-05 -4.41497651e-03 -6.68048296e-04] [ 2.95446618e-05 4.41497651e-03 -6.68048298e-04] [-7.57673878e-04 -6.89487753e-03 1.01682922e-03] [ 7.57673874e-04 6.89487753e-03 1.01682922e-03] [ 5.86740646e-03 3.57529584e-03 -2.82707794e-03] [-5.86740645e-03 -3.57529584e-03 -2.82707794e-03] [-1.89378457e-03 7.39926116e-05 2.17875308e-05] [ 1.89378456e-03 -7.39926103e-05 2.17875294e-05] [-1.00185938e-04 4.98497396e-03 9.72902273e-04] [ 1.00185939e-04 -4.98497397e-03 9.72902274e-04] [ 8.12689351e-04 -1.75601942e-03 -2.27540964e-03] [-8.12689353e-04 1.75601942e-03 -2.27540964e-03] [ 4.02494715e-03 -1.62567998e-03 8.36789632e-04] [-4.02494715e-03 1.62567998e-03 8.36789632e-04] [-2.81250534e-03 2.94531672e-04 -9.03812471e-04] [ 2.81250534e-03 -2.94531671e-04 -9.03812472e-04]] Final stress: [ 2.49019279e-06 8.59329733e-05 -4.42310474e-05 3.23127759e-15 8.62311357e-15 1.04559557e-04] Minimization converged after 112 steps. Minimization converged after 118 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-5.90624053e-04 -7.27849435e-04 -2.56049057e-03] [ 5.90624053e-04 7.27849415e-04 -2.56049057e-03] [-5.62269517e-04 -2.13155923e-03 7.47047427e-04] [ 5.62269516e-04 2.13155923e-03 7.47047424e-04] [ 2.77092020e-03 3.46644124e-03 4.70081184e-04] [-2.77092020e-03 -3.46644124e-03 4.70081188e-04] [-7.31330686e-04 4.32153389e-04 -2.63194583e-03] [ 7.31330685e-04 -4.32153383e-04 -2.63194583e-03] [ 2.08789795e-03 2.40618204e-03 3.87139444e-03] [-2.08789795e-03 -2.40618204e-03 3.87139444e-03] [-1.39454701e-03 -2.34169193e-04 1.43258714e-04] [ 1.39454701e-03 2.34169194e-04 1.43258716e-04] [-2.25476239e-03 -1.67630231e-03 1.37985044e-03] [ 2.25476239e-03 1.67630231e-03 1.37985043e-03] [-9.36017450e-03 2.18078411e-03 6.71667766e-03] [ 9.36017450e-03 -2.18078410e-03 6.71667766e-03] [ 3.94771059e-03 -4.94877833e-04 1.16798963e-03] [-3.94771059e-03 4.94877832e-04 1.16798963e-03] [ 2.68515307e-03 1.03323777e-03 -8.72297257e-04] [-2.68515307e-03 -1.03323777e-03 -8.72297259e-04] [ 6.25669154e-04 -1.92268500e-03 -2.02687793e-03] [-6.25669154e-04 1.92268500e-03 -2.02687793e-03] [-2.18321282e-03 -5.45629943e-03 -2.79428862e-04] [ 2.18321281e-03 5.45629941e-03 -2.79428860e-04] [-7.90077230e-04 -2.30689276e-03 1.27308474e-03] [ 7.90077232e-04 2.30689277e-03 1.27308475e-03] [ 1.41203520e-03 8.49562638e-04 -5.58852066e-03] [-1.41203520e-03 -8.49562635e-04 -5.58852066e-03] [ 9.15896310e-04 6.11208072e-03 -6.96236710e-03] [-9.15896313e-04 -6.11208072e-03 -6.96236710e-03] [ 2.89876835e-03 -5.03998176e-03 9.22338741e-04] [-2.89876836e-03 5.03998176e-03 9.22338739e-04] [ 3.21598150e-03 1.03155549e-03 -7.56192675e-04] [-3.21598150e-03 -1.03155549e-03 -7.56192677e-04] [ 1.01535625e-03 1.60160241e-03 -1.36859642e-03] [-1.01535625e-03 -1.60160241e-03 -1.36859642e-03] [-1.15564063e-03 -1.66420722e-03 -2.42940188e-03] [ 1.15564063e-03 1.66420722e-03 -2.42940188e-03] [-6.54446135e-05 2.06417459e-03 -1.27898081e-03] [ 6.54446154e-05 -2.06417459e-03 -1.27898081e-03] [-2.00301729e-03 -9.57555236e-04 2.10329948e-03] [ 2.00301729e-03 9.57555233e-04 2.10329947e-03] [-5.78722034e-05 -1.06191025e-04 4.62848410e-03] [ 5.78722041e-05 1.06191027e-04 4.62848410e-03] [-1.64170588e-03 -3.56844318e-03 2.76224230e-03] [ 1.64170588e-03 3.56844318e-03 2.76224229e-03] [-1.11657960e-03 -2.55178516e-03 -5.30391686e-03] [ 1.11657960e-03 2.55178516e-03 -5.30391686e-03] [-7.84521785e-04 -2.91720883e-03 3.20133706e-03] [ 7.84521787e-04 2.91720883e-03 3.20133706e-03] [ 1.82170507e-04 1.39785828e-03 3.06975286e-03] [-1.82170508e-04 -1.39785829e-03 3.06975286e-03] [-4.20109177e-03 1.32368857e-03 -7.62045049e-04] [ 4.20109178e-03 -1.32368857e-03 -7.62045050e-04] [-3.71694167e-03 2.91269101e-04 3.41311634e-03] [ 3.71694167e-03 -2.91269097e-04 3.41311633e-03] [-1.07988940e-03 -4.79390902e-03 2.70146527e-03] [ 1.07988939e-03 4.79390902e-03 2.70146527e-03] [ 2.25752566e-03 -5.33884863e-03 -4.91538834e-03] [-2.25752566e-03 5.33884863e-03 -4.91538834e-03] [-3.18770300e-03 -2.78566954e-04 -1.64185509e-03] [ 3.18770300e-03 2.78566954e-04 -1.64185509e-03] [-5.23708666e-03 -1.22037053e-03 -4.78022254e-03] [ 5.23708666e-03 1.22037052e-03 -4.78022254e-03] [ 1.16398809e-04 2.65820405e-03 4.21537842e-03] [-1.16398804e-04 -2.65820405e-03 4.21537842e-03] [ 7.61081636e-03 -4.35142983e-03 4.41589479e-03] [-7.61081636e-03 4.35142983e-03 4.41589479e-03] [-2.84952671e-03 1.73996283e-03 3.36481685e-04] [ 2.84952671e-03 -1.73996283e-03 3.36481684e-04] [-2.67030501e-03 -5.32870281e-03 3.42852306e-03] [ 2.67030501e-03 5.32870281e-03 3.42852306e-03] [ 7.25383607e-04 -9.10328432e-04 -7.16825600e-03] [-7.25383605e-04 9.10328432e-04 -7.16825600e-03] [ 5.05228531e-03 6.25661857e-04 2.83061050e-03] [-5.05228531e-03 -6.25661858e-04 2.83061050e-03] [ 1.65420954e-03 -1.99987846e-03 -7.26512403e-04] [-1.65420955e-03 1.99987846e-03 -7.26512405e-04] [ 7.57634761e-03 6.26560249e-04 -1.20111977e-03] [-7.57634761e-03 -6.26560252e-04 -1.20111977e-03] [ 6.78917940e-03 2.92364036e-04 -3.27076941e-04] [-6.78917939e-03 -2.92364036e-04 -3.27076941e-04] [-1.23001002e-03 -1.94073234e-03 -3.51057773e-03] [ 1.23001002e-03 1.94073235e-03 -3.51057773e-03] [ 5.03569411e-03 4.43091302e-04 2.55654652e-03] [-5.03569411e-03 -4.43091305e-04 2.55654652e-03] [-2.68974397e-03 -2.99641491e-04 -2.71570990e-03] [ 2.68974397e-03 2.99641504e-04 -2.71570990e-03] [-6.81810409e-03 2.01861116e-04 -2.25100921e-03] [ 6.81810409e-03 -2.01861117e-04 -2.25100922e-03] [ 2.98050486e-03 -1.21435090e-03 4.14133289e-04] [-2.98050486e-03 1.21435090e-03 4.14133289e-04] [ 1.42594692e-04 2.41349082e-03 1.01372921e-03] [-1.42594694e-04 -2.41349080e-03 1.01372921e-03] [-5.94977704e-03 2.61123246e-03 2.46807275e-04] [ 5.94977704e-03 -2.61123245e-03 2.46807271e-04] [ 2.55005040e-03 4.78794546e-03 1.99145764e-03] [-2.55005039e-03 -4.78794546e-03 1.99145765e-03] [-1.26650512e-03 2.91598426e-03 -7.26830676e-04] [ 1.26650512e-03 -2.91598427e-03 -7.26830685e-04] [-1.70311832e-03 6.90477351e-04 2.76463775e-03] [ 1.70311832e-03 -6.90477349e-04 2.76463775e-03]] Final stress: [ 1.84018511e-05 1.16251062e-05 2.99240270e-04 9.44049296e-16 3.48939740e-15 -2.26315156e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 5.83748960e-04 -7.18519118e-04 -2.56288660e-03] [-5.83748965e-04 7.18519094e-04 -2.56288659e-03] [ 5.67434760e-04 -2.14212419e-03 7.48348449e-04] [-5.67434760e-04 2.14212420e-03 7.48348446e-04] [-2.78285634e-03 3.46949928e-03 4.68074436e-04] [ 2.78285634e-03 -3.46949928e-03 4.68074439e-04] [ 7.34399075e-04 4.40116221e-04 -2.65851417e-03] [-7.34399075e-04 -4.40116216e-04 -2.65851417e-03] [-2.08902815e-03 2.41342193e-03 3.88406143e-03] [ 2.08902815e-03 -2.41342193e-03 3.88406144e-03] [ 1.39526414e-03 -2.32873085e-04 1.41389812e-04] [-1.39526414e-03 2.32873087e-04 1.41389817e-04] [ 2.26648588e-03 -1.68875462e-03 1.37152611e-03] [-2.26648588e-03 1.68875461e-03 1.37152611e-03] [ 9.38761102e-03 2.16446925e-03 6.71204473e-03] [-9.38761102e-03 -2.16446924e-03 6.71204473e-03] [-3.96924533e-03 -4.96481217e-04 1.16554884e-03] [ 3.96924533e-03 4.96481220e-04 1.16554885e-03] [-2.69152511e-03 1.04455423e-03 -8.71738872e-04] [ 2.69152511e-03 -1.04455424e-03 -8.71738871e-04] [-6.24869020e-04 -1.92898771e-03 -2.04015562e-03] [ 6.24869020e-04 1.92898771e-03 -2.04015562e-03] [ 2.18086461e-03 -5.47194259e-03 -2.83329099e-04] [-2.18086461e-03 5.47194257e-03 -2.83329092e-04] [ 8.01014544e-04 -2.32387216e-03 1.30826872e-03] [-8.01014543e-04 2.32387217e-03 1.30826873e-03] [-1.40042473e-03 8.69012305e-04 -5.57678422e-03] [ 1.40042473e-03 -8.69012303e-04 -5.57678422e-03] [-9.20768826e-04 6.12677634e-03 -6.98624290e-03] [ 9.20768825e-04 -6.12677634e-03 -6.98624290e-03] [-2.91087935e-03 -5.04788909e-03 9.32144657e-04] [ 2.91087935e-03 5.04788909e-03 9.32144655e-04] [-3.22956231e-03 1.03549227e-03 -7.62893689e-04] [ 3.22956231e-03 -1.03549226e-03 -7.62893692e-04] [-1.14996882e-03 1.65173463e-03 -2.44433782e-03] [ 1.14996882e-03 -1.65173463e-03 -2.44433782e-03] [ 1.01290068e-03 -1.60654314e-03 -1.36413101e-03] [-1.01290068e-03 1.60654314e-03 -1.36413101e-03] [-2.03394587e-03 9.58032476e-04 2.10672516e-03] [ 2.03394587e-03 -9.58032477e-04 2.10672516e-03] [-4.89946276e-05 -2.06617848e-03 -1.27781924e-03] [ 4.89946267e-05 2.06617848e-03 -1.27781924e-03] [-1.64878757e-03 3.56717166e-03 2.77006325e-03] [ 1.64878758e-03 -3.56717165e-03 2.77006325e-03] [-5.70947845e-05 9.33290969e-05 4.64363432e-03] [ 5.70947845e-05 -9.33290955e-05 4.64363432e-03] [-7.84734606e-04 2.92506437e-03 3.21836439e-03] [ 7.84734607e-04 -2.92506437e-03 3.21836439e-03] [-1.12058371e-03 2.55551681e-03 -5.32447269e-03] [ 1.12058371e-03 -2.55551681e-03 -5.32447270e-03] [-4.20491881e-03 -1.32013082e-03 -7.59782942e-04] [ 4.20491881e-03 1.32013082e-03 -7.59782943e-04] [ 1.79873872e-04 -1.40864356e-03 3.07529432e-03] [-1.79873870e-04 1.40864356e-03 3.07529432e-03] [-1.03929733e-03 4.82724296e-03 2.72233002e-03] [ 1.03929733e-03 -4.82724296e-03 2.72233002e-03] [-3.73206064e-03 -2.79236098e-04 3.41724419e-03] [ 3.73206064e-03 2.79236097e-04 3.41724419e-03] [-3.19595640e-03 2.72582454e-04 -1.64555212e-03] [ 3.19595640e-03 -2.72582455e-04 -1.64555212e-03] [ 2.26745746e-03 5.34912556e-03 -4.92432217e-03] [-2.26745747e-03 -5.34912556e-03 -4.92432217e-03] [ 1.21473345e-04 -2.66905524e-03 4.23315775e-03] [-1.21473348e-04 2.66905524e-03 4.23315776e-03] [-5.26607299e-03 1.21546561e-03 -4.79939769e-03] [ 5.26607299e-03 -1.21546562e-03 -4.79939769e-03] [-2.85017843e-03 -1.74060267e-03 3.39270397e-04] [ 2.85017843e-03 1.74060267e-03 3.39270398e-04] [ 7.62349041e-03 4.35618693e-03 4.41736334e-03] [-7.62349041e-03 -4.35618693e-03 4.41736334e-03] [ 7.56493249e-04 8.88457835e-04 -7.18707869e-03] [-7.56493251e-04 -8.88457833e-04 -7.18707869e-03] [-2.68765804e-03 5.31964343e-03 3.44365441e-03] [ 2.68765804e-03 -5.31964343e-03 3.44365441e-03] [ 1.65552705e-03 1.99504351e-03 -7.29802063e-04] [-1.65552705e-03 -1.99504351e-03 -7.29802061e-04] [ 5.06041228e-03 -6.31856269e-04 2.84073011e-03] [-5.06041228e-03 6.31856268e-04 2.84073011e-03] [-7.61342754e-03 6.33433189e-04 -1.20859497e-03] [ 7.61342754e-03 -6.33433190e-04 -1.20859497e-03] [-6.81514040e-03 2.93687064e-04 -3.26540285e-04] [ 6.81514040e-03 -2.93687066e-04 -3.26540283e-04] [ 1.22853367e-03 -1.94892309e-03 -3.50901181e-03] [-1.22853368e-03 1.94892309e-03 -3.50901181e-03] [-5.07186476e-03 4.35268691e-04 2.57037584e-03] [ 5.07186476e-03 -4.35268694e-04 2.57037583e-03] [ 2.69098065e-03 -3.14093574e-04 -2.72629844e-03] [-2.69098066e-03 3.14093595e-04 -2.72629844e-03] [ 6.84648421e-03 2.03794289e-04 -2.25803441e-03] [-6.84648421e-03 -2.03794291e-04 -2.25803441e-03] [-2.98215665e-03 -1.20997922e-03 4.09364756e-04] [ 2.98215665e-03 1.20997922e-03 4.09364758e-04] [-1.24315259e-04 2.42564966e-03 1.01861858e-03] [ 1.24315256e-04 -2.42564965e-03 1.01861858e-03] [ 2.56175746e-03 -4.81138885e-03 2.00956501e-03] [-2.56175747e-03 4.81138885e-03 2.00956501e-03] [-5.95697984e-03 -2.62825633e-03 2.52675222e-04] [ 5.95697985e-03 2.62825633e-03 2.52675225e-04] [-1.69446151e-03 -6.74198981e-04 2.74835453e-03] [ 1.69446151e-03 6.74198984e-04 2.74835452e-03] [-1.26393330e-03 -2.91657492e-03 -7.40471259e-04] [ 1.26393330e-03 2.91657493e-03 -7.40471257e-04]] Final stress: [1.82294459e-05 1.16919243e-05 2.99787073e-04 1.73155371e-15 2.45452817e-15 2.26851173e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-9.32251718e-04 5.48289296e-03 3.72975662e-03] [ 9.32251715e-04 -5.48289297e-03 3.72975663e-03] [-1.22305231e-03 2.37033176e-03 -4.86938658e-03] [ 1.22305231e-03 -2.37033175e-03 -4.86938658e-03] [ 2.85633144e-03 -5.75795996e-03 -6.24367638e-04] [-2.85633144e-03 5.75795996e-03 -6.24367636e-04] [-1.74446577e-04 2.56302009e-03 7.69045126e-04] [ 1.74446578e-04 -2.56302009e-03 7.69045126e-04] [ 2.57637212e-03 -1.98748982e-03 -4.44725681e-03] [-2.57637212e-03 1.98748982e-03 -4.44725681e-03] [-1.69677834e-03 1.58236519e-03 -1.00729249e-03] [ 1.69677834e-03 -1.58236519e-03 -1.00729249e-03] [-2.57268530e-03 2.04526466e-03 -2.56343353e-03] [ 2.57268530e-03 -2.04526466e-03 -2.56343353e-03] [-1.15936397e-02 -4.07859383e-03 -8.48579760e-03] [ 1.15936397e-02 4.07859383e-03 -8.48579759e-03] [ 5.23097022e-03 -6.54169100e-05 -1.97927335e-03] [-5.23097022e-03 6.54169128e-05 -1.97927335e-03] [ 3.25941598e-03 -7.00238985e-04 1.72195293e-03] [-3.25941598e-03 7.00238985e-04 1.72195293e-03] [ 5.90055893e-04 2.29052969e-03 1.17296230e-03] [-5.90055894e-04 -2.29052969e-03 1.17296230e-03] [-2.56022749e-03 9.55125328e-03 -5.23223056e-05] [ 2.56022749e-03 -9.55125329e-03 -5.23223077e-05] [-9.06768598e-04 -3.59706999e-04 1.58327912e-03] [ 9.06768597e-04 3.59706998e-04 1.58327912e-03] [ 1.64401674e-03 -5.59106613e-04 6.88191336e-03] [-1.64401674e-03 5.59106613e-04 6.88191336e-03] [ 1.02736283e-03 -6.02276819e-03 8.50745454e-03] [-1.02736283e-03 6.02276819e-03 8.50745454e-03] [ 3.61470483e-03 5.88746560e-03 -1.25655593e-03] [-3.61470483e-03 -5.88746561e-03 -1.25655594e-03] [ 4.36003124e-03 -4.30941973e-03 2.03118803e-03] [-4.36003124e-03 4.30941973e-03 2.03118803e-03] [-2.27424255e-03 -3.62474031e-03 2.81139771e-03] [ 2.27424255e-03 3.62474031e-03 2.81139771e-03] [-4.57154159e-03 1.59187712e-03 1.13353298e-03] [ 4.57154159e-03 -1.59187712e-03 1.13353298e-03] [ 2.17139645e-03 -6.17961015e-04 -3.14224265e-03] [-2.17139645e-03 6.17961016e-04 -3.14224265e-03] [ 4.74899533e-04 1.98869049e-03 1.87157213e-03] [-4.74899538e-04 -1.98869049e-03 1.87157213e-03] [ 4.34091926e-04 -6.33208822e-03 1.68216489e-04] [-4.34091919e-04 6.33208822e-03 1.68216488e-04] [-2.25537863e-03 3.46312910e-04 -2.91386863e-03] [ 2.25537863e-03 -3.46312910e-04 -2.91386863e-03] [ 3.25841201e-03 -2.63431256e-03 -2.64470575e-03] [-3.25841201e-03 2.63431255e-03 -2.64470575e-03] [ 2.85100324e-03 -4.49532671e-03 7.91692364e-03] [-2.85100324e-03 4.49532671e-03 7.91692364e-03] [ 1.00231820e-03 2.67062414e-03 1.49901200e-03] [-1.00231820e-03 -2.67062414e-03 1.49901200e-03] [-3.41471120e-03 1.78466168e-03 -4.25641717e-03] [ 3.41471120e-03 -1.78466169e-03 -4.25641718e-03] [-9.61475072e-04 -8.54151069e-03 -2.66145262e-03] [ 9.61475072e-04 8.54151070e-03 -2.66145262e-03] [ 3.28986549e-03 1.84868568e-03 -2.19931568e-03] [-3.28986548e-03 -1.84868567e-03 -2.19931568e-03] [ 3.66267935e-03 8.88150545e-05 1.72254266e-03] [-3.66267935e-03 -8.88150542e-05 1.72254266e-03] [-2.70160896e-03 -7.00544806e-03 5.71090956e-03] [ 2.70160896e-03 7.00544806e-03 5.71090956e-03] [ 1.19467797e-03 3.28864045e-03 -7.55991471e-03] [-1.19467797e-03 -3.28864045e-03 -7.55991470e-03] [ 7.07208091e-03 -1.64183017e-03 3.89091155e-03] [-7.07208091e-03 1.64183017e-03 3.89091155e-03] [ 4.02565483e-03 1.56630995e-03 -1.01756073e-03] [-4.02565483e-03 -1.56630995e-03 -1.01756073e-03] [-9.57327359e-03 -6.40444180e-03 -5.02321627e-03] [ 9.57327359e-03 6.40444180e-03 -5.02321627e-03] [-2.77317559e-03 4.69753014e-04 9.59233668e-03] [ 2.77317559e-03 -4.69753014e-04 9.59233668e-03] [ 3.16167677e-03 -8.40732607e-03 -5.33347703e-03] [-3.16167677e-03 8.40732608e-03 -5.33347703e-03] [-2.59001269e-03 -3.39867892e-03 1.57002547e-03] [ 2.59001269e-03 3.39867892e-03 1.57002547e-03] [-6.83696052e-03 1.30769741e-03 -4.47854503e-03] [ 6.83696052e-03 -1.30769741e-03 -4.47854503e-03] [ 9.68407175e-03 -5.33798335e-04 2.90240448e-03] [-9.68407175e-03 5.33798333e-04 2.90240447e-03] [ 8.59731024e-03 -8.90944261e-05 2.28163458e-04] [-8.59731024e-03 8.90944272e-05 2.28163459e-04] [-1.41819081e-03 2.16837668e-03 4.83890756e-03] [ 1.41819081e-03 -2.16837668e-03 4.83890756e-03] [ 7.37941047e-03 1.46404997e-03 -6.37793071e-03] [-7.37941046e-03 -1.46404998e-03 -6.37793071e-03] [-3.76875178e-03 -9.23442920e-03 1.30277199e-03] [ 3.76875178e-03 9.23442920e-03 1.30277199e-03] [-7.66220713e-03 -1.27543252e-03 2.41820356e-03] [ 7.66220714e-03 1.27543252e-03 2.41820355e-03] [ 4.25843867e-03 2.52374532e-03 -2.12012435e-04] [-4.25843867e-03 -2.52374532e-03 -2.12012433e-04] [-9.90788002e-04 -3.00382877e-03 -5.01858263e-04] [ 9.90788003e-04 3.00382877e-03 -5.01858264e-04] [-4.61411550e-03 6.82517297e-03 -1.50685358e-03] [ 4.61411550e-03 -6.82517297e-03 -1.50685358e-03] [ 7.81576323e-03 2.32580332e-03 1.48731643e-03] [-7.81576323e-03 -2.32580332e-03 1.48731643e-03] [ 1.17386326e-03 -9.87925295e-04 -2.91260449e-03] [-1.17386326e-03 9.87925292e-04 -2.91260449e-03] [ 1.15579822e-03 5.09145663e-03 5.64961579e-04] [-1.15579822e-03 -5.09145663e-03 5.64961581e-04]] Final stress: [-1.00601569e-04 4.50099529e-05 -3.19189660e-04 1.40498941e-14 9.82476642e-16 -2.86772200e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 9.54427881e-04 5.74434234e-03 3.78652922e-03] [-9.54427881e-04 -5.74434239e-03 3.78652922e-03] [ 1.25222579e-03 2.32270893e-03 -4.96030815e-03] [-1.25222579e-03 -2.32270893e-03 -4.96030815e-03] [-2.87497756e-03 -5.79589653e-03 -6.76204027e-04] [ 2.87497756e-03 5.79589653e-03 -6.76204026e-04] [ 1.23035210e-04 2.69695894e-03 7.16519551e-04] [-1.23035213e-04 -2.69695894e-03 7.16519565e-04] [-2.60961196e-03 -1.99152985e-03 -4.51844427e-03] [ 2.60961196e-03 1.99152985e-03 -4.51844428e-03] [ 1.72687992e-03 1.55722916e-03 -9.74388929e-04] [-1.72687992e-03 -1.55722915e-03 -9.74388920e-04] [ 2.52779046e-03 2.07879171e-03 -2.67575593e-03] [-2.52779046e-03 -2.07879171e-03 -2.67575593e-03] [ 1.16369058e-02 -4.26677060e-03 -8.72251365e-03] [-1.16369058e-02 4.26677061e-03 -8.72251363e-03] [-5.19509641e-03 -4.12581146e-05 -2.05576228e-03] [ 5.19509641e-03 4.12581131e-05 -2.05576228e-03] [-3.29017807e-03 -6.81296287e-04 1.79006761e-03] [ 3.29017806e-03 6.81296283e-04 1.79006761e-03] [-6.00919578e-04 2.32799344e-03 1.18321439e-03] [ 6.00919578e-04 -2.32799344e-03 1.18321439e-03] [ 2.61360169e-03 9.78645717e-03 9.81591744e-06] [-2.61360169e-03 -9.78645719e-03 9.81592695e-06] [ 8.60282511e-04 -5.05505011e-04 1.78991153e-03] [-8.60282513e-04 5.05505019e-04 1.78991153e-03] [-1.69268488e-03 -4.90035454e-04 7.15895387e-03] [ 1.69268488e-03 4.90035456e-04 7.15895387e-03] [-1.03932744e-03 -6.11077952e-03 8.59876160e-03] [ 1.03932744e-03 6.11077952e-03 8.59876160e-03] [-3.62104563e-03 5.96454655e-03 -1.24509579e-03] [ 3.62104562e-03 -5.96454655e-03 -1.24509579e-03] [-4.38594853e-03 -4.35274404e-03 2.04673352e-03] [ 4.38594853e-03 4.35274405e-03 2.04673352e-03] [-4.66325352e-03 -1.63958375e-03 1.09736478e-03] [ 4.66325352e-03 1.63958375e-03 1.09736478e-03] [-2.29128075e-03 3.69223328e-03 2.80973402e-03] [ 2.29128075e-03 -3.69223328e-03 2.80973402e-03] [ 5.78280263e-04 -2.02511514e-03 1.92885635e-03] [-5.78280259e-04 2.02511514e-03 1.92885636e-03] [ 2.13428964e-03 5.50458159e-04 -3.30653467e-03] [-2.13428964e-03 -5.50458167e-04 -3.30653467e-03] [-2.25032124e-03 -3.40854830e-04 -2.92386111e-03] [ 2.25032124e-03 3.40854832e-04 -2.92386111e-03] [ 4.24792529e-04 6.41612648e-03 1.96974668e-04] [-4.24792532e-04 -6.41612648e-03 1.96974667e-04] [ 2.87224176e-03 4.59396338e-03 8.08271022e-03] [-2.87224176e-03 -4.59396340e-03 8.08271023e-03] [ 3.32037634e-03 2.64382977e-03 -2.65805504e-03] [-3.32037634e-03 -2.64382978e-03 -2.65805504e-03] [-3.47042489e-03 -1.80715333e-03 -4.29359441e-03] [ 3.47042490e-03 1.80715333e-03 -4.29359441e-03] [ 1.02448936e-03 -2.75627179e-03 1.56788221e-03] [-1.02448936e-03 2.75627180e-03 1.56788221e-03] [ 3.23919080e-03 -1.96615141e-03 -2.24827246e-03] [-3.23919079e-03 1.96615141e-03 -2.24827246e-03] [-7.04065136e-04 8.47078109e-03 -2.62863811e-03] [ 7.04065139e-04 -8.47078109e-03 -2.62863811e-03] [-2.72117764e-03 7.08758736e-03 5.75569077e-03] [ 2.72117764e-03 -7.08758736e-03 5.75569076e-03] [ 3.72715019e-03 -1.02674176e-04 1.76269581e-03] [-3.72715019e-03 1.02674181e-04 1.76269581e-03] [ 7.14084142e-03 1.68797531e-03 3.93309148e-03] [-7.14084143e-03 -1.68797532e-03 3.93309147e-03] [ 1.27138872e-03 -3.37201724e-03 -7.70117300e-03] [-1.27138871e-03 3.37201723e-03 -7.70117300e-03] [-9.71615947e-03 6.43534536e-03 -5.12829249e-03] [ 9.71615947e-03 -6.43534536e-03 -5.12829249e-03] [ 4.05049815e-03 -1.66984573e-03 -1.00622703e-03] [-4.05049815e-03 1.66984574e-03 -1.00622703e-03] [ 3.14985200e-03 8.55149752e-03 -5.31088989e-03] [-3.14985200e-03 -8.55149752e-03 -5.31088989e-03] [-2.65674792e-03 -3.64205965e-04 9.64983549e-03] [ 2.65674792e-03 3.64205960e-04 9.64983549e-03] [-6.95528274e-03 -1.37448927e-03 -4.50987149e-03] [ 6.95528274e-03 1.37448927e-03 -4.50987148e-03] [-2.63174338e-03 3.45822015e-03 1.61485559e-03] [ 2.63174338e-03 -3.45822015e-03 1.61485558e-03] [-9.64496908e-03 -4.66937481e-04 2.96095953e-03] [ 9.64496908e-03 4.66937477e-04 2.96095953e-03] [-8.66064570e-03 -8.80736173e-05 2.16922633e-04] [ 8.66064570e-03 8.80736167e-05 2.16922636e-04] [ 1.38917627e-03 2.14641143e-03 4.90729843e-03] [-1.38917627e-03 -2.14641143e-03 4.90729842e-03] [-7.35860343e-03 1.42599562e-03 -6.49252494e-03] [ 7.35860343e-03 -1.42599562e-03 -6.49252494e-03] [ 3.86705669e-03 -9.51911737e-03 1.29783504e-03] [-3.86705668e-03 9.51911741e-03 1.29783504e-03] [ 7.72661249e-03 -1.29771314e-03 2.46197540e-03] [-7.72661249e-03 1.29771314e-03 2.46197540e-03] [-4.26362676e-03 2.60578615e-03 -2.21021980e-04] [ 4.26362676e-03 -2.60578615e-03 -2.21021978e-04] [ 8.88638427e-04 -3.13057034e-03 -5.20152716e-04] [-8.88638426e-04 3.13057036e-03 -5.20152718e-04] [ 7.91065471e-03 -2.37318354e-03 1.50448397e-03] [-7.91065472e-03 2.37318354e-03 1.50448396e-03] [-4.65067287e-03 -6.82770007e-03 -1.46780092e-03] [ 4.65067287e-03 6.82770007e-03 -1.46780091e-03] [ 1.15844845e-03 -5.21827333e-03 4.69048266e-04] [-1.15844845e-03 5.21827333e-03 4.69048256e-04] [ 1.21247924e-03 8.97661493e-04 -3.05333861e-03] [-1.21247924e-03 -8.97661494e-04 -3.05333861e-03]] Final stress: [-1.01815714e-04 4.66242900e-05 -3.21671322e-04 2.50758637e-15 -4.10919063e-15 2.90098207e-04] Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 44 steps. Minimization converged after 142 steps. Minimization converged after 141 steps. Minimization converged after 145 steps. Minimization converged after 143 steps. Minimization converged after 37 steps. Minimization converged after 42 steps. Minimization converged after 143 steps. Minimization converged after 151 steps. Minimization converged after 146 steps. Minimization converged after 145 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.84936725e-03 -5.51002039e-03 -1.32820420e-03] [-1.84936725e-03 5.51002031e-03 -1.32820418e-03] [ 1.95933209e-03 -1.81527480e-04 -1.16222499e-04] [-1.95933209e-03 1.81527493e-04 -1.16222506e-04] [ 2.58851602e-03 -4.24808869e-04 1.71139447e-04] [-2.58851602e-03 4.24808872e-04 1.71139451e-04] [-3.76275950e-03 2.59856184e-03 -3.57577793e-03] [ 3.76275950e-03 -2.59856181e-03 -3.57577789e-03] [-1.02272093e-03 2.37236297e-04 7.62803320e-04] [ 1.02272093e-03 -2.37236299e-04 7.62803316e-04] [ 4.15760816e-04 3.46621808e-04 -8.06543332e-04] [-4.15760816e-04 -3.46621803e-04 -8.06543327e-04] [ 5.10795714e-04 3.92527819e-04 -1.10253784e-03] [-5.10795713e-04 -3.92527827e-04 -1.10253785e-03] [-3.03547982e-03 1.74215751e-03 -1.24549192e-03] [ 3.03547982e-03 -1.74215749e-03 -1.24549190e-03] [-4.34157410e-04 -1.80509680e-04 -1.59385787e-04] [ 4.34157411e-04 1.80509672e-04 -1.59385794e-04] [-2.04363864e-03 -8.59993629e-04 7.75593692e-04] [ 2.04363863e-03 8.59993618e-04 7.75593683e-04] [ 3.06478168e-03 -2.62073257e-04 -4.83019941e-04] [-3.06478168e-03 2.62073254e-04 -4.83019944e-04] [-8.23839567e-04 1.62878383e-03 3.78371087e-04] [ 8.23839566e-04 -1.62878390e-03 3.78371105e-04] [-1.76522689e-04 -2.17961340e-03 2.24752277e-03] [ 1.76522690e-04 2.17961343e-03 2.24752281e-03] [-1.48992872e-03 -3.57273540e-04 9.34839802e-04] [ 1.48992872e-03 3.57273547e-04 9.34839819e-04] [ 2.68400329e-03 5.44409919e-04 -4.33311877e-04] [-2.68400329e-03 -5.44409922e-04 -4.33311883e-04] [-1.68801205e-03 -2.25249732e-04 -2.85524827e-06] [ 1.68801205e-03 2.25249729e-04 -2.85525457e-06] [-3.47077762e-03 4.91066644e-04 2.82871344e-04] [ 3.47077762e-03 -4.91066629e-04 2.82871338e-04] [-2.27574538e-03 2.78126681e-03 1.22612192e-04] [ 2.27574538e-03 -2.78126681e-03 1.22612195e-04] [ 1.54575783e-03 3.01404658e-03 -3.79351160e-04] [-1.54575783e-03 -3.01404658e-03 -3.79351163e-04] [ 7.25486717e-04 -2.29626192e-04 2.74386475e-03] [-7.25486702e-04 2.29626178e-04 2.74386474e-03] [-2.42202585e-03 -6.41900889e-04 -2.12172607e-03] [ 2.42202584e-03 6.41900879e-04 -2.12172607e-03] [-1.31989255e-03 -2.12260402e-03 -2.62660466e-03] [ 1.31989255e-03 2.12260402e-03 -2.62660466e-03] [ 9.20353059e-04 -7.77234203e-04 3.13311404e-03] [-9.20353061e-04 7.77234206e-04 3.13311404e-03] [-3.01032444e-03 1.36902208e-03 3.27161436e-03] [ 3.01032444e-03 -1.36902209e-03 3.27161437e-03] [ 1.81419521e-03 1.86425680e-03 -4.11552793e-03] [-1.81419521e-03 -1.86425681e-03 -4.11552795e-03] [-8.86650241e-04 -1.49376052e-03 -2.17282315e-03] [ 8.86650242e-04 1.49376053e-03 -2.17282315e-03] [ 3.25494699e-04 -2.20264029e-03 2.63675495e-03] [-3.25494700e-04 2.20264029e-03 2.63675494e-03] [ 3.10363297e-03 -1.88674791e-03 1.29793468e-03] [-3.10363297e-03 1.88674792e-03 1.29793467e-03] [-2.20302553e-03 -3.76446940e-03 -1.87819478e-04] [ 2.20302552e-03 3.76446941e-03 -1.87819472e-04] [ 3.33901010e-03 1.77218703e-03 1.05206066e-04] [-3.33901010e-03 -1.77218703e-03 1.05206065e-04] [-3.71711730e-03 1.10890162e-03 -9.80508787e-05] [ 3.71711730e-03 -1.10890161e-03 -9.80508771e-05] [ 2.01068417e-03 1.65022591e-03 4.18616936e-03] [-2.01068419e-03 -1.65022593e-03 4.18616935e-03] [-4.02186615e-03 3.88585570e-03 -3.06176274e-03] [ 4.02186617e-03 -3.88585572e-03 -3.06176273e-03] [ 1.41837608e-03 1.89253843e-04 6.56507286e-04] [-1.41837609e-03 -1.89253841e-04 6.56507293e-04] [-5.96127385e-04 -5.80430314e-05 -4.64103478e-04] [ 5.96127388e-04 5.80430331e-05 -4.64103486e-04] [ 4.10421101e-03 1.12084731e-03 -3.07666366e-03] [-4.10421101e-03 -1.12084730e-03 -3.07666366e-03] [-4.26777430e-03 8.52699864e-04 2.56494453e-03] [ 4.26777430e-03 -8.52699861e-04 2.56494453e-03] [-1.60946243e-04 5.81733465e-04 -2.57484941e-03] [ 1.60946246e-04 -5.81733466e-04 -2.57484940e-03] [ 1.27775676e-03 7.75927347e-04 1.31400081e-03] [-1.27775676e-03 -7.75927347e-04 1.31400080e-03] [ 8.20128925e-04 6.98584616e-04 -2.86228767e-04] [-8.20128925e-04 -6.98584629e-04 -2.86228780e-04] [-2.01619434e-03 -2.12240756e-04 1.85622101e-04] [ 2.01619434e-03 2.12240755e-04 1.85622103e-04] [ 1.77105176e-03 -1.13143443e-04 -8.87524088e-05] [-1.77105176e-03 1.13143444e-04 -8.87524081e-05] [-6.86895188e-04 -1.49806801e-03 1.40945108e-03] [ 6.86895190e-04 1.49806799e-03 1.40945106e-03] [-8.69444359e-04 3.43218495e-03 -6.54064597e-05] [ 8.69444359e-04 -3.43218489e-03 -6.54064630e-05] [ 3.65943546e-03 -8.29568187e-05 -1.05652951e-04] [-3.65943546e-03 8.29568169e-05 -1.05652948e-04] [-5.16961129e-03 -1.55747710e-05 -1.29331333e-04] [ 5.16961129e-03 1.55747700e-05 -1.29331332e-04] [-5.05916214e-04 -1.19463691e-03 2.11345323e-04] [ 5.05916212e-04 1.19463696e-03 2.11345320e-04] [ 2.23904451e-03 -1.08944887e-03 1.56643982e-03] [-2.23904451e-03 1.08944888e-03 1.56643980e-03] [-2.49911107e-03 -2.44857554e-03 2.64405005e-03] [ 2.49911108e-03 2.44857554e-03 2.64405008e-03] [-3.57691353e-03 -2.88813811e-03 -1.63398993e-03] [ 3.57691353e-03 2.88813811e-03 -1.63398996e-03] [ 4.09225825e-03 -3.30005002e-03 -1.16077784e-03] [-4.09225825e-03 3.30005002e-03 -1.16077781e-03]] Final stress: [-1.03184815e-05 2.27740842e-06 -4.50437607e-06 4.46016211e-15 -2.67705336e-15 -5.83597637e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.51171230e-03 -4.00795932e-03 -1.68863837e-03] [ 2.51171230e-03 4.00795924e-03 -1.68863835e-03] [-3.68417097e-03 -1.75960947e-04 -1.55131340e-03] [ 3.68417097e-03 1.75960950e-04 -1.55131341e-03] [-5.08387508e-03 -1.70976714e-03 2.37175610e-04] [ 5.08387508e-03 1.70976714e-03 2.37175613e-04] [ 1.13579094e-02 2.91007401e-03 -3.88895192e-03] [-1.13579094e-02 -2.91007400e-03 -3.88895190e-03] [ 3.95810019e-03 6.13820301e-04 9.11538503e-04] [-3.95810019e-03 -6.13820298e-04 9.11538501e-04] [-1.41507078e-03 1.15672868e-03 -1.15067609e-03] [ 1.41507078e-03 -1.15672868e-03 -1.15067608e-03] [-5.17597149e-04 4.90875253e-04 -1.09424807e-03] [ 5.17597148e-04 -4.90875257e-04 -1.09424808e-03] [ 9.64536347e-03 1.43425304e-03 -4.52038688e-04] [-9.64536347e-03 -1.43425302e-03 -4.52038677e-04] [-4.73699023e-04 -4.18344798e-04 -6.18383076e-04] [ 4.73699021e-04 4.18344797e-04 -6.18383075e-04] [ 3.64013024e-03 -1.10039761e-03 7.93573836e-04] [-3.64013024e-03 1.10039760e-03 7.93573827e-04] [-7.24646753e-03 -3.37621729e-04 -1.14826440e-03] [ 7.24646754e-03 3.37621737e-04 -1.14826440e-03] [ 5.27331798e-03 3.61179901e-03 6.64343635e-04] [-5.27331798e-03 -3.61179905e-03 6.64343645e-04] [ 3.25980152e-03 -4.28060447e-03 4.00144392e-03] [-3.25980152e-03 4.28060448e-03 4.00144394e-03] [ 2.63693183e-03 -1.00955233e-03 -2.59056922e-04] [-2.63693183e-03 1.00955233e-03 -2.59056909e-04] [-8.93931844e-03 1.88634707e-03 -4.78094390e-04] [ 8.93931844e-03 -1.88634707e-03 -4.78094393e-04] [ 8.32190373e-04 -8.98710376e-04 -5.00640698e-04] [-8.32190377e-04 8.98710378e-04 -5.00640700e-04] [ 5.87668787e-03 -7.69966650e-04 1.92223855e-04] [-5.87668787e-03 7.69966659e-04 1.92223848e-04] [ 2.34856987e-03 -7.25301286e-03 7.57613468e-04] [-2.34856987e-03 7.25301286e-03 7.57613474e-04] [-7.75588009e-03 -6.04286050e-03 -2.56401704e-04] [ 7.75588009e-03 6.04286050e-03 -2.56401708e-04] [-1.72356941e-03 1.53238075e-03 -5.70865107e-03] [ 1.72356942e-03 -1.53238075e-03 -5.70865108e-03] [-3.35693895e-04 7.37285672e-04 6.97157852e-03] [ 3.35693888e-04 -7.37285684e-04 6.97157853e-03] [ 3.14788419e-03 1.91728315e-03 8.38155117e-03] [-3.14788419e-03 -1.91728315e-03 8.38155117e-03] [-4.79659949e-03 6.48373235e-03 -5.14451288e-03] [ 4.79659949e-03 -6.48373235e-03 -5.14451288e-03] [ 1.15663484e-02 -4.95189553e-03 -4.25233133e-03] [-1.15663484e-02 4.95189551e-03 -4.25233131e-03] [-1.23028933e-02 -6.03770650e-03 5.23603050e-03] [ 1.23028933e-02 6.03770648e-03 5.23603049e-03] [ 2.00777653e-04 4.79322534e-03 5.26904198e-03] [-2.00777654e-04 -4.79322534e-03 5.26904198e-03] [-3.83863608e-03 3.47396182e-03 -5.21127057e-03] [ 3.83863608e-03 -3.47396182e-03 -5.21127057e-03] [-6.30704075e-03 4.56382075e-03 -1.78136890e-03] [ 6.30704076e-03 -4.56382075e-03 -1.78136891e-03] [ 4.61959579e-03 5.03646072e-03 3.13262649e-03] [-4.61959580e-03 -5.03646071e-03 3.13262650e-03] [-6.83810693e-03 -1.21479315e-03 -7.27706633e-04] [ 6.83810693e-03 1.21479315e-03 -7.27706635e-04] [ 6.07855444e-03 -2.88132861e-03 -2.26171590e-04] [-6.07855444e-03 2.88132861e-03 -2.26171588e-04] [-1.81643057e-03 -1.74552366e-03 -1.56701519e-02] [ 1.81643056e-03 1.74552364e-03 -1.56701520e-02] [-3.13838378e-04 6.20302713e-04 1.44279399e-02] [ 3.13838388e-04 -6.20302727e-04 1.44279399e-02] [ 3.50095676e-04 1.93966857e-04 -2.03928794e-04] [-3.50095678e-04 -1.93966858e-04 -2.03928790e-04] [ 1.52205720e-03 3.63315646e-04 5.91225704e-04] [-1.52205720e-03 -3.63315646e-04 5.91225700e-04] [-8.23118965e-03 -3.89387263e-03 3.87718592e-03] [ 8.23118965e-03 3.89387263e-03 3.87718592e-03] [ 5.62599206e-03 -6.49786771e-03 -4.60459991e-03] [-5.62599206e-03 6.49786771e-03 -4.60459990e-03] [ 1.13289366e-03 -7.86889665e-04 4.32088328e-03] [-1.13289366e-03 7.86889663e-04 4.32088329e-03] [ 1.21426141e-04 -9.00858872e-04 -5.18797741e-03] [-1.21426141e-04 9.00858874e-04 -5.18797742e-03] [-6.11374189e-03 5.86401256e-04 8.62943772e-04] [ 6.11374189e-03 -5.86401266e-04 8.62943769e-04] [ 7.15706413e-03 1.11068699e-04 5.14959908e-04] [-7.15706413e-03 -1.11068700e-04 5.14959911e-04] [-3.24201838e-03 -2.98887738e-04 -5.80828028e-04] [ 3.24201838e-03 2.98887741e-04 -5.80828027e-04] [ 2.99449332e-03 -1.37869899e-04 -5.40116956e-05] [-2.99449332e-03 1.37869889e-04 -5.40117018e-05] [-1.20881778e-02 -1.06041447e-03 -1.00006857e-03] [ 1.20881778e-02 1.06041454e-03 -1.00006857e-03] [-8.44518583e-03 -5.46052664e-04 -2.42964792e-04] [ 8.44518583e-03 5.46052667e-04 -2.42964789e-04] [ 1.02568577e-02 5.09125959e-04 1.65834796e-04] [-1.02568577e-02 -5.09125960e-04 1.65834796e-04] [-3.72537373e-03 -1.27583280e-03 5.31923099e-04] [ 3.72537373e-03 1.27583284e-03 5.31923098e-04] [-6.15605996e-03 3.68657661e-03 4.30128709e-03] [ 6.15605995e-03 -3.68657660e-03 4.30128707e-03] [ 4.74428048e-03 6.49098225e-04 6.33906279e-04] [-4.74428048e-03 -6.49098216e-04 6.33906299e-04] [ 6.30079879e-03 4.84588638e-03 1.37359306e-03] [-6.30079879e-03 -4.84588638e-03 1.37359304e-03] [-6.63484455e-03 6.77287431e-03 -4.46717247e-03] [ 6.63484455e-03 -6.77287432e-03 -4.46717246e-03]] Final stress: [-5.21892747e-05 3.08500911e-05 2.12855425e-06 3.19453733e-15 -3.85782510e-15 1.40239457e-04] Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 15 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 15 steps. Minimization converged after 23 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 114 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.03233907e-03 9.87339710e-04 3.41746355e-04] [ 2.03233907e-03 -9.87339715e-04 3.41746361e-04] [-2.07269562e-03 2.45063589e-04 -1.25650941e-03] [ 2.07269562e-03 -2.45063587e-04 -1.25650942e-03] [-1.53610180e-03 4.57038914e-04 -1.21620865e-03] [ 1.53610180e-03 -4.57038912e-04 -1.21620865e-03] [ 3.44493735e-03 -8.61764401e-04 -4.38809014e-04] [-3.44493735e-03 8.61764403e-04 -4.38809018e-04] [-7.11800629e-05 4.68752889e-03 -2.57253430e-03] [ 7.11800614e-05 -4.68752889e-03 -2.57253431e-03] [-4.63797707e-04 -1.70133818e-03 -2.03669223e-04] [ 4.63797706e-04 1.70133818e-03 -2.03669222e-04] [ 2.29093529e-03 -2.90660158e-05 -7.95826657e-04] [-2.29093529e-03 2.90660102e-05 -7.95826658e-04] [ 4.03938350e-03 -6.79263046e-04 1.35450961e-03] [-4.03938350e-03 6.79263044e-04 1.35450960e-03] [-1.12592405e-03 1.50457899e-03 -1.72645971e-03] [ 1.12592405e-03 -1.50457900e-03 -1.72645971e-03] [ 5.95383092e-04 -1.35288315e-03 1.94655815e-04] [-5.95383092e-04 1.35288315e-03 1.94655814e-04] [-4.03425839e-03 -3.56828213e-03 2.62038114e-03] [ 4.03425839e-03 3.56828214e-03 2.62038114e-03] [ 3.92616983e-03 1.39709913e-03 5.46279073e-05] [-3.92616983e-03 -1.39709917e-03 5.46279165e-05] [-8.77539402e-04 -1.00806839e-03 1.55246998e-03] [ 8.77539400e-04 1.00806839e-03 1.55246999e-03] [ 2.99765443e-04 1.12124325e-03 2.80669722e-04] [-2.99765443e-04 -1.12124324e-03 2.80669727e-04] [-1.99764195e-03 4.10439164e-03 -8.79516575e-04] [ 1.99764195e-03 -4.10439164e-03 -8.79516576e-04] [-4.59233579e-04 -3.35700044e-03 2.05545188e-03] [ 4.59233578e-04 3.35700044e-03 2.05545188e-03] [ 3.52136023e-03 -2.53681273e-04 -4.38727996e-04] [-3.52136024e-03 2.53681272e-04 -4.38728001e-04] [ 8.50616151e-04 -2.29295920e-03 3.36934041e-03] [-8.50616153e-04 2.29295920e-03 3.36934041e-03] [-1.92612344e-03 -5.65301688e-04 -3.18411145e-05] [ 1.92612344e-03 5.65301686e-04 -3.18411143e-05] [ 4.78897189e-04 1.87054423e-03 -2.37211905e-03] [-4.78897186e-04 -1.87054423e-03 -2.37211906e-03] [-9.82378012e-05 3.96387357e-04 4.86810143e-03] [ 9.82377958e-05 -3.96387365e-04 4.86810144e-03] [-1.03886979e-03 7.07307815e-04 2.50004246e-03] [ 1.03886979e-03 -7.07307818e-04 2.50004246e-03] [-2.71192575e-03 5.99805514e-03 -1.59208086e-03] [ 2.71192575e-03 -5.99805514e-03 -1.59208086e-03] [-3.66409617e-05 -7.64559227e-04 -2.67256325e-03] [ 3.66409675e-05 7.64559220e-04 -2.67256325e-03] [-5.29756306e-04 -2.52663619e-03 2.85659403e-03] [ 5.29756301e-04 2.52663619e-03 2.85659403e-03] [-2.99155891e-04 1.08652513e-03 -1.00316739e-03] [ 2.99155893e-04 -1.08652513e-03 -1.00316739e-03] [ 1.01003592e-03 -2.60749071e-04 -3.44744153e-03] [-1.01003592e-03 2.60749069e-04 -3.44744152e-03] [-7.81710004e-04 1.11135081e-04 1.63894307e-03] [ 7.81709999e-04 -1.11135088e-04 1.63894307e-03] [-2.66267879e-04 1.73671678e-03 3.89439050e-03] [ 2.66267882e-04 -1.73671679e-03 3.89439049e-03] [-3.72184645e-03 1.90944643e-03 -1.74261047e-04] [ 3.72184644e-03 -1.90944643e-03 -1.74261047e-04] [ 6.11992263e-04 -1.34460253e-03 -8.72401191e-04] [-6.11992264e-04 1.34460253e-03 -8.72401192e-04] [-1.81504095e-03 -9.64112729e-04 -6.06646557e-03] [ 1.81504095e-03 9.64112733e-04 -6.06646557e-03] [ 7.76588150e-04 -1.23744528e-03 3.97514593e-03] [-7.76588148e-04 1.23744528e-03 3.97514593e-03] [-1.11468652e-03 2.05867206e-04 -1.52183616e-03] [ 1.11468652e-03 -2.05867206e-04 -1.52183617e-03] [-8.45235742e-04 1.34207793e-03 1.46647465e-03] [ 8.45235739e-04 -1.34207792e-03 1.46647466e-03] [-5.06819139e-03 -2.18489898e-03 -1.84432201e-03] [ 5.06819139e-03 2.18489898e-03 -1.84432201e-03] [ 2.08074995e-03 -1.32044535e-03 -1.53342209e-03] [-2.08074995e-03 1.32044535e-03 -1.53342209e-03] [-1.64577381e-03 -1.06416228e-03 1.87430428e-03] [ 1.64577380e-03 1.06416228e-03 1.87430428e-03] [ 6.82175998e-04 7.51521812e-04 -1.18230214e-03] [-6.82175999e-04 -7.51521813e-04 -1.18230214e-03] [-3.01033160e-03 1.08007093e-03 4.32616501e-04] [ 3.01033160e-03 -1.08007093e-03 4.32616505e-04] [ 6.42507311e-04 7.01394585e-04 4.57453059e-04] [-6.42507311e-04 -7.01394583e-04 4.57453058e-04] [ 8.84085882e-04 1.25728987e-03 -1.24651705e-03] [-8.84085880e-04 -1.25728987e-03 -1.24651705e-03] [ 4.82127538e-04 -4.61982883e-04 -1.31506143e-03] [-4.82127538e-04 4.61982886e-04 -1.31506142e-03] [ 8.02459000e-04 -7.42500750e-04 -1.32697536e-03] [-8.02458996e-04 7.42500752e-04 -1.32697537e-03] [-2.25220029e-03 -4.86809287e-04 -3.03123935e-04] [ 2.25220029e-03 4.86809286e-04 -3.03123931e-04] [ 3.56933168e-03 -1.08564176e-03 7.60012011e-04] [-3.56933169e-03 1.08564175e-03 7.60012010e-04] [-4.83438043e-05 3.27619711e-04 1.77331853e-03] [ 4.83438043e-05 -3.27619676e-04 1.77331853e-03] [ 1.75989297e-03 -1.54418333e-03 1.07032050e-03] [-1.75989296e-03 1.54418333e-03 1.07032050e-03] [ 2.10426291e-03 1.34316237e-03 -2.39504539e-03] [-2.10426292e-03 -1.34316236e-03 -2.39504539e-03] [ 4.21887795e-03 1.27791235e-03 5.37394786e-04] [-4.21887794e-03 -1.27791234e-03 5.37394786e-04] [-3.91683537e-04 2.80845759e-05 5.00243527e-04] [ 3.91683535e-04 -2.80845685e-05 5.00243535e-04]] Final stress: [4.66584462e-05 4.94149616e-05 2.92064020e-05 5.43983044e-15 9.13967996e-15 6.88948462e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 7.73706018e-04 -3.96025317e-04 -3.33196357e-04] [-7.73706019e-04 3.96025318e-04 -3.33196358e-04] [ 7.74759157e-04 -2.89039427e-04 2.79094647e-04] [-7.74759158e-04 2.89039428e-04 2.79094647e-04] [ 5.98247741e-04 -7.26915207e-04 4.56182978e-04] [-5.98247741e-04 7.26915206e-04 4.56182980e-04] [-1.42579323e-03 7.37853778e-05 2.69494988e-04] [ 1.42579323e-03 -7.37853762e-05 2.69494990e-04] [ 1.90183400e-05 -1.97737928e-03 7.41396271e-04] [-1.90183393e-05 1.97737928e-03 7.41396268e-04] [ 2.44280126e-04 9.96483870e-04 1.08410274e-05] [-2.44280124e-04 -9.96483869e-04 1.08410287e-05] [-8.27381182e-04 -6.03846470e-04 -1.41002930e-04] [ 8.27381183e-04 6.03846469e-04 -1.41002930e-04] [-1.19113132e-03 6.62226792e-06 -1.72931285e-03] [ 1.19113132e-03 -6.62226961e-06 -1.72931285e-03] [-9.83718322e-06 -5.38016892e-04 5.46007724e-04] [ 9.83718290e-06 5.38016891e-04 5.46007724e-04] [-5.24852441e-05 9.68094395e-04 -1.26050120e-04] [ 5.24852452e-05 -9.68094394e-04 -1.26050119e-04] [ 1.82943236e-03 1.47237643e-03 -1.18878269e-03] [-1.82943236e-03 -1.47237643e-03 -1.18878269e-03] [-1.74881943e-03 -7.50930355e-04 7.10395969e-05] [ 1.74881943e-03 7.50930348e-04 7.10395991e-05] [ 4.08714432e-04 1.76286726e-04 -1.52701279e-05] [-4.08714433e-04 -1.76286724e-04 -1.52701258e-05] [-2.02122974e-04 -1.67796548e-04 1.18353668e-03] [ 2.02122974e-04 1.67796548e-04 1.18353668e-03] [ 8.36127820e-04 -1.46594827e-03 7.62617992e-04] [-8.36127822e-04 1.46594827e-03 7.62617991e-04] [-8.03096585e-06 1.40919801e-03 -1.04244034e-03] [ 8.03096626e-06 -1.40919801e-03 -1.04244034e-03] [-1.49133190e-03 2.36082977e-04 1.71511793e-04] [ 1.49133190e-03 -2.36082977e-04 1.71511792e-04] [-4.81182070e-04 5.25272628e-04 -1.26156700e-03] [ 4.81182070e-04 -5.25272629e-04 -1.26156700e-03] [ 6.37609186e-04 9.35329203e-04 -9.43185944e-05] [-6.37609184e-04 -9.35329202e-04 -9.43185931e-05] [-5.55084674e-05 -7.95180826e-04 9.27354301e-04] [ 5.55084679e-05 7.95180824e-04 9.27354299e-04] [ 1.99341928e-04 4.79631167e-04 -1.22356507e-03] [-1.99341929e-04 -4.79631168e-04 -1.22356507e-03] [ 3.18960309e-04 -4.66340262e-04 -8.83842235e-04] [-3.18960307e-04 4.66340262e-04 -8.83842236e-04] [ 1.18170277e-03 -2.17132061e-03 1.02449102e-03] [-1.18170277e-03 2.17132061e-03 1.02449102e-03] [-8.51321048e-05 4.69469517e-04 1.17000074e-03] [ 8.51321052e-05 -4.69469519e-04 1.17000074e-03] [ 6.18873029e-04 9.52485990e-04 -9.11091240e-04] [-6.18873030e-04 -9.52485991e-04 -9.11091242e-04] [ 2.96149124e-04 -1.33300421e-04 4.41018845e-04] [-2.96149124e-04 1.33300420e-04 4.41018846e-04] [-4.78559711e-04 -2.88948424e-04 1.43673927e-03] [ 4.78559709e-04 2.88948425e-04 1.43673927e-03] [ 1.73570864e-03 3.53726015e-04 -6.65844798e-04] [-1.73570864e-03 -3.53726014e-04 -6.65844798e-04] [ 5.77039061e-05 -2.14122533e-04 -2.06379221e-03] [-5.77039089e-05 2.14122534e-04 -2.06379221e-03] [ 1.84033282e-03 -5.10441354e-04 1.56057211e-04] [-1.84033282e-03 5.10441353e-04 1.56057210e-04] [-2.80058958e-04 7.41288194e-04 2.25629285e-04] [ 2.80058958e-04 -7.41288193e-04 2.25629284e-04] [ 5.20384404e-04 7.56490288e-04 2.22876381e-03] [-5.20384404e-04 -7.56490288e-04 2.22876381e-03] [-1.38534914e-04 4.03649866e-04 -2.08692669e-03] [ 1.38534914e-04 -4.03649865e-04 -2.08692669e-03] [ 4.18397152e-04 3.76831102e-04 5.56161320e-04] [-4.18397153e-04 -3.76831102e-04 5.56161320e-04] [ 5.03809187e-04 -2.86846186e-04 -9.72345359e-04] [-5.03809186e-04 2.86846186e-04 -9.72345359e-04] [ 3.46078576e-03 4.62976739e-04 5.53448732e-04] [-3.46078576e-03 -4.62976738e-04 5.53448732e-04] [-1.64735919e-03 -7.18036463e-04 1.65065437e-03] [ 1.64735919e-03 7.18036464e-04 1.65065437e-03] [ 6.67954271e-04 4.09664913e-04 -7.59317524e-04] [-6.67954271e-04 -4.09664912e-04 -7.59317524e-04] [-5.19631176e-04 -8.38828794e-05 7.11464158e-04] [ 5.19631177e-04 8.38828807e-05 7.11464159e-04] [ 3.60033620e-04 -5.76810595e-04 2.21874471e-04] [-3.60033622e-04 5.76810594e-04 2.21874469e-04] [-1.24438929e-04 -8.64603260e-05 -2.07174516e-04] [ 1.24438931e-04 8.64603254e-05 -2.07174516e-04] [-1.47960910e-04 -7.15447723e-04 5.76955578e-04] [ 1.47960911e-04 7.15447723e-04 5.76955578e-04] [-7.11877581e-04 5.97329405e-04 2.96376370e-05] [ 7.11877581e-04 -5.97329407e-04 2.96376381e-05] [ 2.72100059e-06 -3.51255712e-04 3.30438218e-04] [-2.72100058e-06 3.51255713e-04 3.30438217e-04] [ 6.12136159e-04 -2.85053117e-05 1.21150375e-04] [-6.12136160e-04 2.85053099e-05 1.21150375e-04] [-1.86026736e-03 7.00457642e-04 -3.29046418e-04] [ 1.86026736e-03 -7.00457641e-04 -3.29046418e-04] [ 4.53347722e-04 2.37078519e-04 -5.19740972e-04] [-4.53347723e-04 -2.37078511e-04 -5.19740971e-04] [-4.44375867e-04 4.57347750e-04 1.62130475e-04] [ 4.44375870e-04 -4.57347750e-04 1.62130475e-04] [-1.18732397e-03 -1.41369589e-03 8.48858367e-04] [ 1.18732397e-03 1.41369589e-03 8.48858367e-04] [-1.66800696e-03 -3.70131031e-04 -7.95236866e-04] [ 1.66800696e-03 3.70131031e-04 -7.95236868e-04] [ 5.10681433e-04 1.43208801e-04 -5.14686981e-04] [-5.10681433e-04 -1.43208801e-04 -5.14686979e-04]] Final stress: [-5.77878679e-05 -3.47396827e-05 -4.58681931e-05 3.89869120e-15 -1.43422117e-17 -3.16782881e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-3.94203984e-04 -5.07582756e-05 2.41294333e-06] [ 3.94203984e-04 5.07582671e-05 2.41294491e-06] [-3.43956810e-04 -3.19268849e-05 3.47498717e-05] [ 3.43956811e-04 3.19268847e-05 3.47498705e-05] [-3.28453676e-04 -3.22014827e-04 3.49949053e-04] [ 3.28453676e-04 3.22014828e-04 3.49949054e-04] [ 5.55673687e-04 2.97538585e-04 -1.92672803e-04] [-5.55673687e-04 -2.97538586e-04 -1.92672803e-04] [-5.54229132e-05 -7.71214973e-04 3.83192725e-04] [ 5.54229128e-05 7.71214973e-04 3.83192725e-04] [-8.73543193e-05 3.79746086e-04 -3.77457024e-05] [ 8.73543195e-05 -3.79746086e-04 -3.77457020e-05] [ 3.39483939e-04 -2.24908650e-04 7.55707546e-05] [-3.39483939e-04 2.24908650e-04 7.55707540e-05] [ 7.40716494e-04 4.03899933e-04 -5.99122709e-04] [-7.40716493e-04 -4.03899930e-04 -5.99122708e-04] [-8.35447580e-05 -3.60059922e-04 4.07556236e-04] [ 8.35447580e-05 3.60059923e-04 4.07556236e-04] [ 4.25415843e-05 2.64892888e-04 4.80081360e-05] [-4.25415839e-05 -2.64892888e-04 4.80081367e-05] [-6.42053594e-04 4.68994013e-04 -5.79794339e-04] [ 6.42053594e-04 -4.68994012e-04 -5.79794338e-04] [ 5.26901384e-04 -1.34026901e-04 -8.86326947e-05] [-5.26901384e-04 1.34026901e-04 -8.86326949e-05] [-9.85460498e-06 3.06683235e-04 -1.48713976e-04] [ 9.85460503e-06 -3.06683234e-04 -1.48713977e-04] [ 9.23765856e-05 -4.97704710e-04 2.36722626e-04] [-9.23765854e-05 4.97704710e-04 2.36722625e-04] [-3.83921252e-04 -5.64191741e-04 2.84321611e-04] [ 3.83921252e-04 5.64191740e-04 2.84321612e-04] [ 4.37489629e-06 5.53310505e-04 -4.14322014e-04] [-4.37489647e-06 -5.53310506e-04 -4.14322014e-04] [ 5.70701619e-04 -4.84167951e-06 9.20736001e-05] [-5.70701619e-04 4.84168077e-06 9.20736001e-05] [ 3.05525378e-04 -4.26420970e-04 -1.35040438e-04] [-3.05525378e-04 4.26420971e-04 -1.35040438e-04] [-2.73683375e-04 -2.71309731e-04 -4.67148190e-04] [ 2.73683375e-04 2.71309731e-04 -4.67148189e-04] [-1.17314762e-04 -1.47168953e-04 -5.88579018e-04] [ 1.17314760e-04 1.47168953e-04 -5.88579016e-04] [ 8.76804718e-05 3.21842391e-04 3.85862552e-04] [-8.76804716e-05 -3.21842390e-04 3.85862552e-04] [ 4.02814847e-04 8.55539629e-04 3.38092552e-04] [-4.02814848e-04 -8.55539629e-04 3.38092553e-04] [ 2.01702733e-04 6.36117706e-05 -3.72949186e-04] [-2.01702733e-04 -6.36117700e-05 -3.72949187e-04] [ 9.29715283e-05 -2.82707305e-04 -3.80601214e-04] [-9.29715288e-05 2.82707304e-04 -3.80601213e-04] [ 9.99354126e-05 -1.81404615e-04 6.57031491e-04] [-9.99354122e-05 1.81404615e-04 6.57031490e-04] [-1.06921587e-04 1.95747825e-04 6.29770291e-04] [ 1.06921587e-04 -1.95747825e-04 6.29770291e-04] [ 1.16739940e-04 8.10320758e-05 1.83967561e-04] [-1.16739939e-04 -8.10320756e-05 1.83967561e-04] [-8.70409992e-05 2.56821931e-04 -7.81359695e-04] [ 8.70409982e-05 -2.56821932e-04 -7.81359695e-04] [ 3.79407884e-04 5.13076147e-05 -3.91823554e-04] [-3.79407883e-04 -5.13076147e-05 -3.91823554e-04] [-1.65789334e-04 -3.03904065e-04 1.15368155e-04] [ 1.65789334e-04 3.03904065e-04 1.15368155e-04] [ 7.55472370e-04 2.25863429e-04 3.27586273e-05] [-7.55472370e-04 -2.25863429e-04 3.27586274e-05] [ 8.58618551e-06 -1.06049657e-04 -7.63527260e-04] [-8.58618725e-06 1.06049655e-04 -7.63527262e-04] [ 4.34310762e-04 -5.76190797e-04 5.55425646e-04] [-4.34310761e-04 5.76190795e-04 5.55425647e-04] [ 2.56900502e-04 1.69593092e-04 -2.38601320e-04] [-2.56900502e-04 -1.69593092e-04 -2.38601320e-04] [ 3.39668141e-04 -4.97831947e-05 3.47798571e-04] [-3.39668141e-04 4.97831950e-05 3.47798571e-04] [-2.74630422e-04 -1.87780814e-04 3.82958490e-04] [ 2.74630423e-04 1.87780813e-04 3.82958490e-04] [ 8.09765889e-04 -5.05574816e-04 2.11397223e-04] [-8.09765890e-04 5.05574815e-04 2.11397223e-04] [ 2.95221446e-05 9.81173655e-05 1.30817533e-04] [-2.95221454e-05 -9.81173654e-05 1.30817533e-04] [ 3.18103649e-04 -2.01464000e-04 -3.71623574e-04] [-3.18103648e-04 2.01463999e-04 -3.71623574e-04] [-4.54883484e-04 -1.66160218e-04 -2.60875440e-05] [ 4.54883484e-04 1.66160218e-04 -2.60875441e-05] [-9.78014828e-05 -2.49867104e-05 -4.29174168e-05] [ 9.78014829e-05 2.49867108e-05 -4.29174163e-05] [ 2.39553903e-05 -1.65676305e-04 1.41924530e-04] [-2.39553906e-05 1.65676306e-04 1.41924531e-04] [ 1.24236484e-04 6.28599432e-05 2.43418929e-04] [-1.24236483e-04 -6.28599424e-05 2.43418930e-04] [ 3.40351227e-04 -5.04017666e-04 2.21412831e-04] [-3.40351227e-04 5.04017673e-04 2.21412831e-04] [-1.50921205e-04 -5.96675879e-05 -1.66005467e-05] [ 1.50921205e-04 5.96675878e-05 -1.66005462e-05] [ 6.48052715e-04 1.57704017e-04 -8.17904862e-06] [-6.48052716e-04 -1.57704017e-04 -8.17904880e-06] [-2.65592182e-05 5.72860142e-05 -2.45950256e-04] [ 2.65592187e-05 -5.72860149e-05 -2.45950257e-04] [-3.83356723e-04 2.89976870e-04 5.52892898e-04] [ 3.83356722e-04 -2.89976868e-04 5.52892898e-04] [-1.95149860e-04 -3.49668152e-04 1.29433635e-05] [ 1.95149862e-04 3.49668153e-04 1.29433639e-05] [ 1.58816709e-04 -2.20312324e-06 -4.99268108e-05] [-1.58816708e-04 2.20312387e-06 -4.99268104e-05] [-7.38028640e-04 2.99039944e-04 -1.16479494e-04] [ 7.38028639e-04 -2.99039944e-04 -1.16479494e-04]] Final stress: [-5.62455353e-05 -3.48397216e-05 -3.45954238e-05 -6.09543995e-17 8.12725327e-17 1.09938415e-05] Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 115 steps. Minimization converged after 118 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.06337320e-03 5.28648644e-04 -8.52946991e-05] [-1.06337320e-03 -5.28648696e-04 -8.52946868e-05] [ 1.35289427e-03 1.68559534e-03 2.65306478e-04] [-1.35289427e-03 -1.68559534e-03 2.65306474e-04] [ 6.50513983e-04 -9.08877465e-04 -1.27675193e-03] [-6.50513983e-04 9.08877465e-04 -1.27675193e-03] [-1.87421351e-03 -2.40947224e-03 1.27384648e-04] [ 1.87421352e-03 2.40947225e-03 1.27384673e-04] [ 2.44121813e-04 1.13845701e-03 -1.02408000e-03] [-2.44121813e-04 -1.13845701e-03 -1.02408000e-03] [ 3.40203049e-04 2.57714621e-04 1.46370234e-03] [-3.40203049e-04 -2.57714618e-04 1.46370234e-03] [-1.54731637e-03 -4.26817777e-05 -1.41574628e-03] [ 1.54731637e-03 4.26817746e-05 -1.41574629e-03] [-3.14838507e-03 -2.17561424e-03 -1.95148998e-03] [ 3.14838507e-03 2.17561425e-03 -1.95148997e-03] [ 1.94606036e-05 2.00798493e-03 -2.06720644e-03] [-1.94606047e-05 -2.00798493e-03 -2.06720645e-03] [ 7.92245185e-04 1.31303641e-04 1.08742166e-03] [-7.92245183e-04 -1.31303646e-04 1.08742166e-03] [ 2.48950946e-03 -1.39432307e-03 3.80190552e-04] [-2.48950946e-03 1.39432307e-03 3.80190549e-04] [-1.63630249e-03 4.02105082e-05 1.04035127e-03] [ 1.63630249e-03 -4.02105318e-05 1.04035128e-03] [ 2.22187708e-04 5.96145798e-04 -2.34902200e-04] [-2.22187708e-04 -5.96145781e-04 -2.34902183e-04] [-5.42888025e-05 2.01460355e-03 3.01439701e-03] [ 5.42888029e-05 -2.01460355e-03 3.01439702e-03] [ 1.57026148e-03 7.03283135e-04 -8.80675536e-04] [-1.57026148e-03 -7.03283139e-04 -8.80675540e-04] [ 2.99082263e-06 1.04845011e-03 7.21016089e-04] [-2.99082398e-06 -1.04845012e-03 7.21016087e-04] [-1.76484485e-03 -1.43977421e-03 -2.55144894e-04] [ 1.76484485e-03 1.43977422e-03 -2.55144898e-04] [-2.19837980e-03 6.79820983e-04 2.21994105e-04] [ 2.19837980e-03 -6.79820982e-04 2.21994108e-04] [ 4.90666159e-04 1.44155779e-03 8.63752652e-04] [-4.90666159e-04 -1.44155778e-03 8.63752651e-04] [ 7.09082092e-05 4.43742358e-04 2.18724783e-03] [-7.09082031e-05 -4.43742364e-04 2.18724783e-03] [ 8.32346905e-05 -1.59664613e-04 -9.13101416e-04] [-8.32346984e-05 1.59664609e-04 -9.13101416e-04] [-7.41387282e-04 -1.16083686e-03 -1.33406389e-03] [ 7.41387284e-04 1.16083686e-03 -1.33406389e-03] [-1.26977257e-04 -1.84592435e-03 1.51668521e-03] [ 1.26977256e-04 1.84592435e-03 1.51668521e-03] [-5.07244675e-04 1.70923094e-03 7.03946339e-04] [ 5.07244675e-04 -1.70923094e-03 7.03946346e-04] [-1.32888140e-04 -1.69033938e-04 -1.72233830e-03] [ 1.32888140e-04 1.69033930e-04 -1.72233830e-03] [ 4.66139698e-04 -1.14873596e-03 -6.63705747e-04] [-4.66139698e-04 1.14873596e-03 -6.63705744e-04] [-1.19624018e-03 -4.50741561e-05 -3.85667573e-04] [ 1.19624018e-03 4.50741550e-05 -3.85667576e-04] [ 8.61726114e-04 -7.83241951e-04 6.18221306e-04] [-8.61726110e-04 7.83241962e-04 6.18221300e-04] [-1.37627829e-03 -2.98702807e-04 -7.42003475e-04] [ 1.37627829e-03 2.98702819e-04 -7.42003469e-04] [ 1.66622564e-03 1.05555424e-03 -1.05746679e-03] [-1.66622564e-03 -1.05555423e-03 -1.05746679e-03] [-1.25837862e-03 -1.09899730e-03 2.67348228e-04] [ 1.25837862e-03 1.09899730e-03 2.67348229e-04] [ 6.12786517e-04 3.01790888e-04 1.17320303e-03] [-6.12786526e-04 -3.01790898e-04 1.17320302e-03] [-9.50058003e-04 2.12529829e-03 -3.05168813e-03] [ 9.50058013e-04 -2.12529830e-03 -3.05168812e-03] [-1.72414911e-03 -5.45309794e-04 1.08554232e-03] [ 1.72414911e-03 5.45309796e-04 1.08554233e-03] [-1.14462960e-03 1.06239362e-03 -1.76295583e-03] [ 1.14462960e-03 -1.06239362e-03 -1.76295584e-03] [ 1.39622334e-03 1.53937718e-03 3.76705166e-04] [-1.39622335e-03 -1.53937718e-03 3.76705165e-04] [-2.48066050e-03 5.63440397e-04 1.24805824e-03] [ 2.48066050e-03 -5.63440396e-04 1.24805824e-03] [ 6.59217035e-04 -8.10419770e-04 7.94567509e-04] [-6.59217033e-04 8.10419770e-04 7.94567516e-04] [-1.49567560e-03 1.25980208e-03 2.15556325e-03] [ 1.49567560e-03 -1.25980208e-03 2.15556324e-03] [ 1.27258532e-03 -5.55006978e-04 2.55620231e-04] [-1.27258532e-03 5.55006969e-04 2.55620224e-04] [ 1.06672543e-03 -3.03497277e-03 -5.56420930e-06] [-1.06672543e-03 3.03497276e-03 -5.56420515e-06] [ 1.50833917e-04 -9.62252460e-04 -7.17466446e-04] [-1.50833917e-04 9.62252461e-04 -7.17466448e-04] [-3.25500391e-04 1.23100500e-05 1.88330588e-04] [ 3.25500392e-04 -1.23100612e-05 1.88330576e-04] [-7.55259210e-04 1.12439103e-03 -3.89403318e-04] [ 7.55259212e-04 -1.12439099e-03 -3.89403322e-04] [-2.26017557e-05 2.48110315e-03 -7.17829963e-04] [ 2.26017529e-05 -2.48110315e-03 -7.17829963e-04] [-1.96062688e-03 -1.03379794e-03 9.80129579e-04] [ 1.96062688e-03 1.03379794e-03 9.80129581e-04] [ 1.24744089e-05 1.12599846e-04 3.62105625e-04] [-1.24744095e-05 -1.12599825e-04 3.62105623e-04] [ 5.80950378e-05 -6.91010179e-04 -8.22137199e-04] [-5.80950415e-05 6.91010184e-04 -8.22137216e-04] [-3.09464857e-04 1.12359144e-03 1.30670668e-03] [ 3.09464859e-04 -1.12359143e-03 1.30670669e-03] [-1.45248140e-03 -9.73707462e-06 -6.85231280e-04] [ 1.45248140e-03 9.73707204e-06 -6.85231297e-04] [ 1.36049381e-03 -4.55538466e-04 -2.43582431e-04] [-1.36049381e-03 4.55538463e-04 -2.43582417e-04]] Final stress: [-3.39456356e-05 -4.23968629e-05 -1.36028611e-05 4.92176897e-15 -5.73688466e-17 -3.48396445e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-8.10654397e-04 3.44997120e-04 -2.58848936e-05] [ 8.10654398e-04 -3.44997139e-04 -2.58848899e-05] [-1.01380361e-03 1.27209472e-03 2.30504602e-04] [ 1.01380361e-03 -1.27209472e-03 2.30504602e-04] [-4.70285937e-04 -6.55154786e-04 -9.61045538e-04] [ 4.70285937e-04 6.55154785e-04 -9.61045539e-04] [ 1.39567133e-03 -1.82588879e-03 1.17133255e-04] [-1.39567133e-03 1.82588879e-03 1.17133266e-04] [-1.92460362e-04 8.33023956e-04 -7.69403985e-04] [ 1.92460362e-04 -8.33023958e-04 -7.69403988e-04] [-3.01177340e-04 1.72542076e-04 1.10676915e-03] [ 3.01177340e-04 -1.72542075e-04 1.10676915e-03] [ 1.15184947e-03 -1.98898485e-05 -1.04171493e-03] [-1.15184947e-03 1.98898488e-05 -1.04171493e-03] [ 2.32340196e-03 -1.60149808e-03 -1.44506083e-03] [-2.32340196e-03 1.60149809e-03 -1.44506082e-03] [-2.53022031e-05 1.50317129e-03 -1.52515859e-03] [ 2.53022040e-05 -1.50317129e-03 -1.52515859e-03] [-5.62641180e-04 8.34510288e-05 7.99780827e-04] [ 5.62641180e-04 -8.34510329e-05 7.99780823e-04] [-1.84581485e-03 -1.02803205e-03 2.91349823e-04] [ 1.84581485e-03 1.02803205e-03 2.91349825e-04] [ 1.25832952e-03 2.74473848e-05 7.42436806e-04] [-1.25832952e-03 -2.74473726e-05 7.42436805e-04] [-1.61033370e-04 5.00588784e-04 -2.11426213e-04] [ 1.61033372e-04 -5.00588777e-04 -2.11426209e-04] [ 7.08719532e-05 1.49423785e-03 2.24153609e-03] [-7.08719530e-05 -1.49423786e-03 2.24153609e-03] [-1.16760936e-03 4.96067466e-04 -6.61854274e-04] [ 1.16760936e-03 -4.96067466e-04 -6.61854276e-04] [-2.22551523e-05 8.01811812e-04 5.50142861e-04] [ 2.22551516e-05 -8.01811812e-04 5.50142861e-04] [ 1.33274385e-03 -1.05110460e-03 -1.99664041e-04] [-1.33274385e-03 1.05110460e-03 -1.99664040e-04] [ 4.17702602e-04 -1.07491432e-03 6.48221200e-04] [-4.17702602e-04 1.07491432e-03 6.48221201e-04] [-1.58376194e-03 -5.03445489e-04 1.68816948e-04] [ 1.58376194e-03 5.03445489e-04 1.68816945e-04] [ 6.64036135e-05 1.39329127e-04 -6.83959070e-04] [-6.64036105e-05 -1.39329126e-04 -6.83959068e-04] [ 4.63795924e-05 -3.19301076e-04 1.62209018e-03] [-4.63795929e-05 3.19301077e-04 1.62209018e-03] [-6.69157158e-05 1.41411338e-03 1.08053211e-03] [ 6.69157167e-05 -1.41411338e-03 1.08053211e-03] [-5.52610846e-04 8.63185104e-04 -1.02648946e-03] [ 5.52610844e-04 -8.63185102e-04 -1.02648946e-03] [-1.10502552e-04 1.01681400e-04 -1.30247345e-03] [ 1.10502549e-04 -1.01681401e-04 -1.30247345e-03] [-3.74528774e-04 -1.28452748e-03 5.14944673e-04] [ 3.74528776e-04 1.28452748e-03 5.14944673e-04] [-8.65514772e-04 4.46291552e-05 -2.89496184e-04] [ 8.65514773e-04 -4.46291580e-05 -2.89496184e-04] [ 3.88912298e-04 8.50183817e-04 -5.34462862e-04] [-3.88912298e-04 -8.50183818e-04 -5.34462863e-04] [-1.04126040e-03 2.19979775e-04 -5.26666001e-04] [ 1.04126040e-03 -2.19979771e-04 -5.26666002e-04] [ 6.45818430e-04 5.34026923e-04 4.67513953e-04] [-6.45818431e-04 -5.34026916e-04 4.67513956e-04] [-9.61171412e-04 8.14607108e-04 1.91307186e-04] [ 9.61171414e-04 -8.14607110e-04 1.91307184e-04] [ 1.28190265e-03 -7.91959945e-04 -7.38428720e-04] [-1.28190265e-03 7.91959946e-04 -7.38428720e-04] [-7.24726562e-04 -1.59995068e-03 -2.26248647e-03] [ 7.24726559e-04 1.59995068e-03 -2.26248647e-03] [ 4.62968589e-04 -2.26660075e-04 9.02620340e-04] [-4.62968587e-04 2.26660072e-04 9.02620342e-04] [-8.76585565e-04 -7.75655179e-04 -1.29862859e-03] [ 8.76585563e-04 7.75655180e-04 -1.29862859e-03] [-1.27309299e-03 4.01581231e-04 7.99064693e-04] [ 1.27309299e-03 -4.01581229e-04 7.99064693e-04] [-1.85180784e-03 -4.66372581e-04 9.18014870e-04] [ 1.85180784e-03 4.66372582e-04 9.18014869e-04] [ 1.04518378e-03 -1.14312946e-03 2.49729983e-04] [-1.04518378e-03 1.14312946e-03 2.49729984e-04] [-1.09844613e-03 -9.70040165e-04 1.62789636e-03] [ 1.09844613e-03 9.70040167e-04 1.62789636e-03] [ 4.87951911e-04 6.00225600e-04 5.91030535e-04] [-4.87951911e-04 -6.00225601e-04 5.91030532e-04] [-9.36384778e-04 -3.99762701e-04 1.47808097e-04] [ 9.36384777e-04 3.99762696e-04 1.47808094e-04] [-7.74946513e-04 -2.25755878e-03 9.01899777e-06] [ 7.74946512e-04 2.25755878e-03 9.01899878e-06] [-1.09215090e-04 -7.25293949e-04 -5.31354678e-04] [ 1.09215089e-04 7.25293951e-04 -5.31354681e-04] [ 1.99489365e-04 -2.07135488e-05 1.78469999e-04] [-1.99489365e-04 2.07135430e-05 1.78469993e-04] [ 5.60481126e-04 9.27434071e-04 -2.82432712e-04] [-5.60481127e-04 -9.27434058e-04 -2.82432712e-04] [ 5.70165150e-06 1.85510881e-03 -5.45453744e-04] [-5.70165094e-06 -1.85510881e-03 -5.45453745e-04] [ 1.49713762e-03 -7.78554664e-04 7.36416049e-04] [-1.49713762e-03 7.78554664e-04 7.36416047e-04] [-9.59492489e-06 7.28865505e-05 2.78629087e-04] [ 9.59492317e-06 -7.28865582e-05 2.78629086e-04] [-2.34985063e-04 -8.40690465e-04 9.69836936e-04] [ 2.34985063e-04 8.40690468e-04 9.69836931e-04] [ 4.10973013e-05 5.32768469e-04 -6.25005533e-04] [-4.10973010e-05 -5.32768468e-04 -6.25005527e-04] [ 1.02341891e-03 3.63492171e-04 -1.82320632e-04] [-1.02341892e-03 -3.63492174e-04 -1.82320634e-04] [-1.09449853e-03 1.34461604e-05 -5.10744215e-04] [ 1.09449853e-03 -1.34461647e-05 -5.10744215e-04]] Final stress: [-3.33143308e-05 -4.58864778e-05 -1.84474915e-05 1.35055826e-15 -6.25081391e-15 2.58716536e-05] Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-2.18536676e-04 3.83206521e-06 -1.82577744e-04] [ 2.18536675e-04 -3.83205705e-06 -1.82577745e-04] [-6.46679616e-05 -3.91619125e-04 4.91011097e-05] [ 6.46679614e-05 3.91619125e-04 4.91011097e-05] [ 3.15292696e-04 5.57999562e-04 -5.56098546e-05] [-3.15292696e-04 -5.57999562e-04 -5.56098543e-05] [-1.73610519e-04 -1.18664437e-04 -1.11943401e-04] [ 1.73610519e-04 1.18664439e-04 -1.11943399e-04] [ 1.43644425e-04 1.89172038e-04 2.67242930e-04] [-1.43644425e-04 -1.89172038e-04 2.67242929e-04] [-1.39363283e-04 -1.91971467e-04 2.33883091e-04] [ 1.39363283e-04 1.91971467e-04 2.33883090e-04] [-2.61428975e-04 -2.87417593e-04 6.63574118e-05] [ 2.61428975e-04 2.87417593e-04 6.63574119e-05] [-1.02312067e-03 1.43933755e-04 -2.27792007e-05] [ 1.02312067e-03 -1.43933759e-04 -2.27792005e-05] [ 3.45367771e-04 1.47877445e-05 1.02310395e-04] [-3.45367771e-04 -1.47877453e-05 1.02310395e-04] [ 3.45508716e-04 3.04313776e-04 2.98213742e-05] [-3.45508716e-04 -3.04313776e-04 2.98213732e-05] [ 1.98008597e-04 -5.73837478e-05 9.75463101e-05] [-1.98008598e-04 5.73837479e-05 9.75463099e-05] [-5.09767011e-04 -2.41570373e-04 8.29775192e-06] [ 5.09767010e-04 2.41570371e-04 8.29775232e-06] [ 1.14436607e-05 3.03568180e-04 -4.56419248e-04] [-1.14436614e-05 -3.03568181e-04 -4.56419248e-04] [ 2.71765575e-04 1.37374284e-04 1.28179134e-04] [-2.71765575e-04 -1.37374282e-04 1.28179133e-04] [ 1.90891362e-04 5.18392245e-04 -9.41393090e-04] [-1.90891362e-04 -5.18392245e-04 -9.41393089e-04] [ 3.72638260e-04 -4.92972260e-04 1.82116891e-04] [-3.72638261e-04 4.92972260e-04 1.82116891e-04] [ 3.91527453e-04 2.55417678e-04 -5.31186034e-05] [-3.91527453e-04 -2.55417679e-04 -5.31186031e-05] [ 4.29947940e-04 1.68059637e-04 -2.71338929e-04] [-4.29947940e-04 -1.68059637e-04 -2.71338929e-04] [ 6.06862497e-05 -2.41265610e-04 -2.09297255e-04] [-6.06862493e-05 2.41265610e-04 -2.09297255e-04] [-2.45773140e-04 4.16624154e-04 -3.38374888e-04] [ 2.45773140e-04 -4.16624155e-04 -3.38374888e-04] [-1.46237021e-05 -1.33448892e-04 1.45453630e-04] [ 1.46237006e-05 1.33448891e-04 1.45453631e-04] [-5.10368292e-05 -4.45251438e-05 2.93693595e-04] [ 5.10368285e-05 4.45251431e-05 2.93693595e-04] [-6.71332189e-05 -7.49554426e-04 3.33273494e-04] [ 6.71332196e-05 7.49554426e-04 3.33273494e-04] [-4.26125867e-04 -2.10188162e-04 -7.50944366e-04] [ 4.26125868e-04 2.10188163e-04 -7.50944368e-04] [ 2.06581200e-04 -3.28314723e-04 6.01172879e-04] [-2.06581201e-04 3.28314723e-04 6.01172879e-04] [ 3.52114591e-04 2.45295022e-04 5.05960885e-04] [-3.52114591e-04 -2.45295022e-04 5.05960885e-04] [-2.47794490e-04 2.04900982e-04 -9.02467029e-05] [ 2.47794490e-04 -2.04900982e-04 -9.02467038e-05] [ 1.13944437e-04 1.62558400e-04 3.85208709e-04] [-1.13944439e-04 -1.62558401e-04 3.85208709e-04] [ 6.70137555e-05 -3.01726772e-04 1.48504851e-04] [-6.70137558e-05 3.01726772e-04 1.48504850e-04] [ 2.11154982e-04 -6.28521277e-04 -5.93439180e-04] [-2.11154982e-04 6.28521277e-04 -5.93439180e-04] [-4.32821872e-04 2.87622682e-05 -1.59732299e-04] [ 4.32821873e-04 -2.87622678e-05 -1.59732299e-04] [-5.55408643e-04 -8.20704158e-05 -1.83656013e-04] [ 5.55408644e-04 8.20704176e-05 -1.83656012e-04] [ 3.12573066e-04 1.18039259e-04 1.16554298e-04] [-3.12573066e-04 -1.18039258e-04 1.16554297e-04] [ 6.94571010e-04 -4.61455714e-04 3.71778946e-04] [-6.94571009e-04 4.61455714e-04 3.71778946e-04] [-4.54845780e-04 2.76916841e-04 -2.85102864e-04] [ 4.54845780e-04 -2.76916841e-04 -2.85102865e-04] [ 3.46661405e-04 -8.14595472e-04 3.86727337e-04] [-3.46661407e-04 8.14595474e-04 3.86727336e-04] [-3.88887621e-05 -5.31577940e-04 -6.58799584e-04] [ 3.88887630e-05 5.31577942e-04 -6.58799583e-04] [ 6.02327763e-04 2.83961014e-05 5.22830150e-04] [-6.02327761e-04 -2.83961010e-05 5.22830151e-04] [ 2.54210430e-06 -1.55746785e-04 1.00410318e-04] [-2.54210499e-06 1.55746786e-04 1.00410317e-04] [ 7.44059987e-04 -3.34752784e-04 2.15049602e-04] [-7.44059987e-04 3.34752783e-04 2.15049602e-04] [ 6.54221226e-04 -6.63719804e-05 -1.57842746e-04] [-6.54221226e-04 6.63719801e-05 -1.57842746e-04] [-1.36038648e-04 -4.15075229e-04 -1.68186969e-04] [ 1.36038648e-04 4.15075229e-04 -1.68186969e-04] [ 3.77465967e-04 6.02067253e-05 2.25817377e-04] [-3.77465967e-04 -6.02067268e-05 2.25817377e-04] [ 1.78052457e-04 2.42360384e-05 -2.40233214e-04] [-1.78052458e-04 -2.42360447e-05 -2.40233214e-04] [-7.18455421e-04 9.45746567e-05 -1.50779578e-04] [ 7.18455420e-04 -9.45746565e-05 -1.50779578e-04] [ 2.83409639e-04 -6.66567654e-05 -6.52040980e-05] [-2.83409639e-04 6.66567664e-05 -6.52040979e-05] [ 4.23932708e-04 -2.33875818e-04 6.63108840e-05] [-4.23932708e-04 2.33875821e-04 6.63108841e-05] [-7.20234829e-04 1.87458715e-05 7.60357385e-05] [ 7.20234831e-04 -1.87458737e-05 7.60357375e-05] [ 1.95324918e-04 6.14510039e-04 1.24934231e-04] [-1.95324920e-04 -6.14510040e-04 1.24934232e-04] [-2.71859158e-04 6.07288904e-04 -6.11649370e-05] [ 2.71859160e-04 -6.07288903e-04 -6.11649363e-05] [-3.43977918e-04 1.83790961e-04 4.23611444e-04] [ 3.43977918e-04 -1.83790961e-04 4.23611444e-04]] Final stress: [ 2.74940665e-05 2.14027014e-05 7.24696844e-05 -1.97301407e-15 1.28586502e-15 -2.75641024e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 0.00109108 0.00443648 -0.00876869] [-0.00109108 -0.00443648 -0.00876869] [-0.00026493 -0.004624 -0.00062872] [ 0.00026493 0.004624 -0.00062872] [-0.00277291 0.00621351 -0.00521192] [ 0.00277291 -0.00621351 -0.00521192] [ 0.0017444 0.00220011 -0.00749161] [-0.0017444 -0.00220011 -0.00749161] [-0.00508847 0.00405741 0.00756312] [ 0.00508847 -0.00405741 0.00756312] [ 0.00144826 -0.00158281 0.00640797] [-0.00144826 0.00158281 0.00640797] [ 0.001426 -0.00576205 0.00277998] [-0.001426 0.00576205 0.00277998] [ 0.0129691 -0.00266939 0.00377227] [-0.0129691 0.00266939 0.00377227] [-0.0055715 -0.00083364 0.00120767] [ 0.0055715 0.00083364 0.00120767] [-0.00317531 0.00465551 -0.00234987] [ 0.00317531 -0.00465551 -0.00234987] [ 0.00243346 -0.00362043 -0.00426775] [-0.00243346 0.00362043 -0.00426775] [ 0.00427899 -0.00568762 0.00487239] [-0.00427899 0.00568762 0.00487239] [ 0.00373092 -0.00304918 0.00250524] [-0.00373092 0.00304918 0.00250524] [-0.00159107 0.00765874 0.00027469] [ 0.00159107 -0.00765874 0.00027469] [-0.00201858 0.01106681 -0.01417362] [ 0.00201858 -0.01106681 -0.01417362] [-0.0048471 -0.0096759 0.00261526] [ 0.0048471 0.0096759 0.00261526] [-0.00503932 -0.0009578 -0.00192188] [ 0.00503932 0.0009578 -0.00192188] [-0.0016824 0.00171265 -0.00105583] [ 0.0016824 -0.00171265 -0.00105583] [ 0.00337983 -0.00137957 -0.00348664] [-0.00337983 0.00137957 -0.00348664] [-0.00353947 0.00451203 0.00320561] [ 0.00353947 -0.00451203 0.00320561] [ 0.0006126 -0.0015176 -0.00085012] [-0.0006126 0.0015176 -0.00085012] [ 0.00118883 0.00949696 0.00469207] [-0.00118883 -0.00949696 0.00469207] [-0.00053475 0.00244547 0.01085026] [ 0.00053475 -0.00244547 0.01085026] [ 0.00446835 0.00651794 0.00604882] [-0.00446835 -0.00651794 0.00604882] [-0.00298033 0.00354298 -0.0056793 ] [ 0.00298033 -0.00354298 -0.0056793 ] [-0.0055026 0.00046226 0.00086573] [ 0.0055026 -0.00046226 0.00086573] [ 0.00084596 -0.00265055 0.00375276] [-0.00084596 0.00265055 0.00375276] [ 0.00420327 0.00739524 0.00198486] [-0.00420327 -0.00739524 0.00198486] [-0.0013281 0.00300291 0.00541293] [ 0.0013281 -0.00300291 0.00541293] [-0.0050277 0.00377436 -0.00531364] [ 0.0050277 -0.00377436 -0.00531364] [ 0.00650637 0.01234024 -0.00669255] [-0.00650637 -0.01234024 -0.00669255] [ 0.00474727 0.00138563 0.00215792] [-0.00474727 -0.00138563 0.00215792] [-0.00966401 0.00557872 -0.00906463] [ 0.00966401 -0.00557872 -0.00906463] [-0.01105019 -0.00285314 -0.00550038] [ 0.01105019 0.00285314 -0.00550038] [ 0.01539962 0.00804447 0.0053733 ] [-0.01539962 -0.00804447 0.0053733 ] [ 0.00262067 0.00871426 -0.00879976] [-0.00262067 -0.00871426 -0.00879976] [ 0.00343237 0.00866371 0.00833349] [-0.00343237 -0.00866371 0.00833349] [ 0.00265527 0.00265569 -0.00029749] [-0.00265527 -0.00265569 -0.00029749] [ 0.00589414 -0.00071163 0.00886799] [-0.00589414 0.00071163 0.00886799] [-0.00667656 -0.00171509 0.00489875] [ 0.00667656 0.00171509 0.00489875] [-0.01144484 0.0019511 -0.00018491] [ 0.01144484 -0.0019511 -0.00018491] [ 0.00226175 -0.00738511 -0.00296311] [-0.00226175 0.00738511 -0.00296311] [-0.01299403 0.00234705 -0.00134979] [ 0.01299403 -0.00234705 -0.00134979] [-0.00053877 -0.01179812 -0.00658137] [ 0.00053877 0.01179812 -0.00658137] [ 0.0128011 -0.00221517 -0.00514876] [-0.0128011 0.00221517 -0.00514876] [-0.00593158 0.00098347 -0.00251403] [ 0.00593158 -0.00098347 -0.00251403] [-0.00142827 0.00478344 0.00240072] [ 0.00142827 -0.00478344 0.00240072] [ 0.00310018 -0.00434053 0.00525784] [-0.00310018 0.00434053 0.00525784] [-0.01041421 -0.00615648 0.00445067] [ 0.01041421 0.00615648 0.00445067] [-0.0054641 -0.00398999 0.00464555] [ 0.0054641 0.00398999 0.00464555] [-0.00351358 -0.00208856 -0.00490151] [ 0.00351358 0.00208856 -0.00490151]] Final stress: [-3.90115326e-05 1.36937451e-05 4.47762745e-04 -3.47637670e-15 1.84992476e-15 4.06198275e-04] Minimization converged after 117 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 2.94164584e-04 1.25165643e-04 7.11488823e-04] [-2.94164583e-04 -1.25165692e-04 7.11488828e-04] [ 2.64965842e-04 1.02817558e-03 -6.95586863e-04] [-2.64965841e-04 -1.02817559e-03 -6.95586862e-04] [-3.11124463e-04 -1.20712898e-03 6.69398005e-04] [ 3.11124464e-04 1.20712897e-03 6.69398000e-04] [ 4.22137037e-04 1.64203656e-03 -1.49489203e-03] [-4.22137039e-04 -1.64203658e-03 -1.49489204e-03] [-2.86201890e-04 8.04593728e-05 -7.00729349e-05] [ 2.86201890e-04 -8.04593744e-05 -7.00729339e-05] [ 3.85972571e-04 2.89477740e-04 -6.22529355e-04] [-3.85972571e-04 -2.89477737e-04 -6.22529350e-04] [ 1.07233362e-04 5.80211991e-04 2.89944189e-04] [-1.07233361e-04 -5.80211986e-04 2.89944188e-04] [ 1.62790006e-03 -9.05546049e-04 2.30082165e-04] [-1.62790006e-03 9.05546072e-04 2.30082170e-04] [-9.63489887e-04 -5.79647052e-04 3.89271917e-04] [ 9.63489888e-04 5.79647053e-04 3.89271916e-04] [-5.64567775e-04 -4.95805124e-04 1.10680959e-04] [ 5.64567775e-04 4.95805123e-04 1.10680967e-04] [-5.58019334e-04 -1.38718583e-05 2.30413276e-05] [ 5.58019334e-04 1.38718599e-05 2.30413279e-05] [ 8.36304141e-04 4.94007978e-04 -5.37070014e-04] [-8.36304140e-04 -4.94007911e-04 -5.37070029e-04] [-9.85769811e-04 2.29699411e-04 -3.04194459e-04] [ 9.85769811e-04 -2.29699416e-04 -3.04194473e-04] [-3.95077256e-04 7.64488624e-04 -1.12203208e-03] [ 3.95077257e-04 -7.64488644e-04 -1.12203209e-03] [-2.64439054e-05 -1.44601474e-03 1.81098029e-03] [ 2.64439029e-05 1.44601474e-03 1.81098029e-03] [-1.17629974e-04 1.38217587e-03 -5.79576422e-04] [ 1.17629976e-04 -1.38217587e-03 -5.79576419e-04] [-9.19865287e-04 -8.37956260e-04 8.20152756e-04] [ 9.19865288e-04 8.37956264e-04 8.20152757e-04] [-1.63071195e-03 4.32440035e-04 3.36603928e-04] [ 1.63071195e-03 -4.32440033e-04 3.36603928e-04] [-1.76182986e-04 6.69329142e-04 3.54613946e-04] [ 1.76182985e-04 -6.69329141e-04 3.54613945e-04] [ 4.30138304e-04 -1.45397508e-04 1.48169981e-04] [-4.30138312e-04 1.45397522e-04 1.48169993e-04] [-4.59838357e-04 1.72921236e-04 -3.53976445e-04] [ 4.59838371e-04 -1.72921220e-04 -3.53976463e-04] [-5.03229243e-04 2.72660640e-04 -9.85637945e-04] [ 5.03229245e-04 -2.72660638e-04 -9.85637942e-04] [ 2.59047017e-05 1.31961693e-03 -4.04078392e-04] [-2.59047044e-05 -1.31961693e-03 -4.04078394e-04] [ 3.40191718e-04 5.13128823e-04 1.61951013e-03] [-3.40191729e-04 -5.13128820e-04 1.61951012e-03] [ 4.53899687e-04 6.63256490e-04 -1.48361811e-03] [-4.53899676e-04 -6.63256488e-04 -1.48361811e-03] [-1.03731606e-03 -4.56815923e-04 -7.44560406e-04] [ 1.03731606e-03 4.56815923e-04 -7.44560409e-04] [ 7.58728463e-05 -2.20818819e-04 3.87539359e-04] [-7.58728483e-05 2.20818817e-04 3.87539362e-04] [-8.38754337e-04 1.89509215e-04 -7.08481120e-04] [ 8.38754335e-04 -1.89509214e-04 -7.08481119e-04] [-7.38248595e-04 3.15120480e-04 -1.01650790e-04] [ 7.38248594e-04 -3.15120477e-04 -1.01650790e-04] [-7.88373815e-04 1.34359620e-03 1.38247454e-03] [ 7.88373817e-04 -1.34359620e-03 1.38247454e-03] [ 5.25115251e-04 1.51670455e-04 4.09874681e-04] [-5.25115253e-04 -1.51670459e-04 4.09874682e-04] [ 4.51606205e-04 -2.07875604e-04 1.22065435e-03] [-4.51606209e-04 2.07875594e-04 1.22065434e-03] [ 1.44915138e-03 -1.97381358e-04 -8.80080348e-04] [-1.44915138e-03 1.97381349e-04 -8.80080339e-04] [-1.63906621e-03 1.50868790e-03 -2.64032348e-04] [ 1.63906620e-03 -1.50868790e-03 -2.64032352e-04] [ 2.59725887e-04 -6.25326903e-04 7.27872875e-05] [-2.59725886e-04 6.25326903e-04 7.27872899e-05] [-1.33442531e-03 2.73480082e-03 -1.54021598e-03] [ 1.33442531e-03 -2.73480083e-03 -1.54021598e-03] [ 5.41578812e-05 1.67512708e-03 1.25787126e-03] [-5.41578867e-05 -1.67512709e-03 1.25787126e-03] [-1.53508402e-03 -3.77178071e-04 -1.52584739e-03] [ 1.53508402e-03 3.77178071e-04 -1.52584739e-03] [-1.97854645e-04 9.68807877e-04 -9.52122060e-04] [ 1.97854650e-04 -9.68807877e-04 -9.52122055e-04] [-1.52158466e-03 1.14364417e-04 -1.79504986e-04] [ 1.52158466e-03 -1.14364410e-04 -1.79504982e-04] [-8.12717175e-04 -2.71522117e-04 1.99843497e-04] [ 8.12717174e-04 2.71522119e-04 1.99843498e-04] [ 3.88699184e-04 7.24340037e-04 6.04220230e-04] [-3.88699184e-04 -7.24340038e-04 6.04220230e-04] [-7.50192167e-04 -8.92589733e-04 1.91695274e-04] [ 7.50192167e-04 8.92589739e-04 1.91695280e-04] [ 8.62355781e-04 -1.02550002e-05 5.42873972e-04] [-8.62355780e-04 1.02550388e-05 5.42873971e-04] [ 4.61374140e-04 -2.52718946e-04 3.22387608e-04] [-4.61374141e-04 2.52718947e-04 3.22387605e-04] [-7.38652271e-04 3.65276139e-04 3.67579776e-04] [ 7.38652272e-04 -3.65276142e-04 3.67579777e-04] [ 5.72202326e-04 -6.07563244e-04 -1.06229994e-04] [-5.72202331e-04 6.07563186e-04 -1.06229994e-04] [ 1.73757370e-03 4.35641061e-05 -3.44796032e-05] [-1.73757371e-03 -4.35640971e-05 -3.44796025e-05] [-4.16692132e-04 -4.91948410e-04 5.24520981e-04] [ 4.16692139e-04 4.91948419e-04 5.24520976e-04] [ 9.21899459e-04 -8.64308847e-04 5.23637956e-04] [-9.21899465e-04 8.64308840e-04 5.23637968e-04] [ 4.58157876e-04 -4.68211223e-04 1.68570912e-04] [-4.58157872e-04 4.68211215e-04 1.68570900e-04]] Final stress: [-3.53200876e-05 -1.76914006e-05 -1.02399963e-04 5.95201784e-16 -1.82863199e-15 5.92585526e-05] Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 3.92172659e-04 3.28914783e-03 1.05939956e-03] [-3.52941783e-04 -7.25039900e-04 -5.60178431e-04] [ 8.79008487e-04 -1.46749348e-03 -1.47405413e-04] [-9.06156495e-04 -1.53774765e-03 -1.49004238e-04] [ 1.11067304e-03 -8.85995663e-04 -1.76841357e-03] [-1.17880494e-03 -6.59598150e-04 1.61567101e-03] [-4.34846570e-04 1.12914305e-03 7.57463896e-05] [ 4.19173003e-04 1.58644696e-03 1.00901876e-03] [ 3.67642071e-04 7.97551140e-04 1.76711971e-03] [-3.72001439e-04 8.60685610e-04 -2.21112293e-03] [ 1.01436647e-03 -3.03674827e-04 6.76943541e-04] [-1.00870764e-03 -2.23083365e-04 -3.85669454e-04] [-1.31164121e-03 -4.45935420e-05 1.21659468e-03] [ 1.30475655e-03 2.55733522e-04 -1.16033348e-03] [-3.27481675e-03 -2.22204351e-03 -1.18465184e-03] [ 3.26800764e-03 -7.57418116e-04 1.66175404e-03] [ 7.00318145e-04 -7.50023976e-04 1.06839374e-03] [-6.62005407e-04 -8.86545671e-04 -1.23070613e-03] [-2.58166069e-06 4.44855466e-06 1.08138881e-04] [ 8.43132279e-06 -3.65897796e-04 1.55353279e-05] [ 1.34451030e-03 -1.96174375e-03 -1.06135932e-03] [-1.33888196e-03 -2.02162748e-03 1.12357085e-03] [-9.78266417e-04 -1.26320611e-03 -6.65981839e-04] [ 9.68507194e-04 -1.09860937e-03 8.91798430e-04] [-7.10875809e-04 2.24713900e-04 -1.68191697e-03] [ 7.22286086e-04 1.56248917e-04 1.36061027e-03] [ 3.12028417e-04 8.85998238e-04 1.41784177e-04] [-3.08781075e-04 5.04204856e-04 -3.66861894e-04] [ 4.83337837e-04 2.27512367e-03 3.37062838e-03] [-3.98996180e-04 2.31778687e-03 -2.57231557e-03] [ 1.47829037e-03 -1.51031658e-03 4.52392691e-04] [-1.46617716e-03 -1.45161522e-03 -8.01533939e-04] [-1.37514327e-03 -7.96663760e-04 -5.97003907e-04] [ 1.37589640e-03 4.41571530e-05 2.49948282e-04] [-2.44619310e-04 2.11847376e-03 6.73917387e-04] [ 2.01592913e-03 6.62650168e-04 8.92865322e-06] [-1.81445827e-05 2.35809121e-03 -3.70822369e-04] [-1.54794278e-03 3.05198059e-04 3.21147971e-04] [ 1.20536898e-03 1.49834796e-03 4.75082151e-04] [-7.67120921e-04 6.57602144e-04 -9.92243443e-04] [-1.05036810e-03 1.49187326e-03 -6.36478255e-04] [ 5.64447817e-04 6.39257906e-04 8.71972200e-04] [ 5.44229073e-04 2.39787817e-04 -1.06854396e-03] [ 1.41465104e-03 1.37605031e-03 -2.45455326e-03] [-4.83405933e-04 6.09604184e-04 1.16957151e-03] [-1.52271911e-03 1.00922512e-03 2.55634958e-03] [ 1.13145307e-03 -3.52849917e-04 -9.21244779e-05] [ 8.87724107e-04 -9.72760110e-04 9.36012667e-04] [-7.61674729e-04 -8.76577927e-04 7.82786549e-04] [-1.31897764e-03 -4.56720419e-04 -2.42665792e-04] [ 1.96699288e-03 6.70098157e-04 9.59449332e-04] [ 5.51641003e-04 -4.80616167e-04 -6.94109498e-04] [-2.17171475e-03 5.87726781e-04 -1.13188221e-03] [-4.64344741e-04 -4.35706927e-04 4.85146283e-04] [ 6.60649733e-04 1.14297052e-03 -2.91339493e-04] [-4.89083964e-05 2.49458862e-03 -8.20939145e-04] [-6.29858556e-04 1.50876174e-03 1.09652222e-04] [ 7.65769470e-05 2.13909615e-03 6.50196758e-04] [ 3.44053423e-03 4.47993548e-05 -1.06506564e-03] [ 8.40179268e-05 -1.54703471e-03 -1.01184307e-03] [-3.31820942e-03 -2.53568447e-04 1.03407154e-03] [-2.22398986e-04 -1.23609000e-03 1.01124867e-03] [-1.33648366e-03 1.04943956e-03 4.51823399e-04] [ 5.56657887e-04 -2.58556507e-03 -6.05425204e-05] [ 1.74281780e-03 2.75468692e-04 -1.25208637e-03] [-9.53520322e-04 -1.83453159e-03 -7.36708712e-04] [ 7.23286362e-04 6.86310990e-04 1.45625117e-03] [-1.88129307e-03 -7.78976764e-04 1.32209723e-04] [-8.00842361e-04 6.76124367e-04 -1.39461669e-03] [ 1.93151092e-03 -7.89635148e-04 -7.54800235e-05] [ 8.90645244e-04 1.30779778e-03 -6.15420739e-04] [-1.37962719e-03 -4.91417498e-04 -1.13331662e-03] [-7.13737555e-04 1.20180916e-03 6.65383873e-04] [ 1.16175156e-03 -4.94496137e-04 1.21713986e-03] [ 6.67864562e-04 8.68724376e-04 -1.31122714e-03] [ 1.98314707e-04 -5.83616060e-05 2.09391297e-04] [-8.51038513e-04 8.91989987e-04 1.35820294e-03] [-7.90669666e-06 -7.71343175e-05 -1.57026655e-04] [ 2.08603269e-03 -4.43366079e-04 1.89669858e-03] [-2.11084381e-03 -3.22968459e-04 -1.51951939e-03] [ 1.28486115e-03 9.56676341e-04 1.21109445e-03] [-1.31210579e-03 6.43442990e-04 -1.06892672e-03] [ 4.16419758e-04 -8.54763276e-04 -6.40358442e-04] [-4.11621937e-04 -8.31295973e-04 5.84881301e-04] [ 5.27693673e-04 -5.45199539e-04 1.65435758e-04] [-5.21251665e-04 -1.08248448e-03 -9.76654805e-04] [-8.91997348e-04 -2.41189621e-03 5.47127566e-04] [ 9.65606478e-04 1.29349309e-03 -9.44058317e-04] [-1.27891550e-03 -1.79486545e-03 -1.29139108e-03] [ 1.26745232e-03 -1.54619188e-03 1.12139452e-03] [-1.31422903e-03 1.46309694e-03 1.14132116e-03] [ 1.28674977e-03 1.27653454e-03 -1.15980378e-03] [ 8.12793001e-04 -1.87842491e-04 -1.95477040e-03] [-7.36692716e-04 -6.59792467e-04 2.11753152e-03] [ 6.87429735e-05 1.31277634e-03 -5.81567425e-04] [ 7.52279070e-04 1.52660495e-04 -2.61488696e-03] [ 1.44972036e-04 1.58129444e-03 -2.85720109e-05] [-1.00497183e-03 -1.20510619e-04 2.08087302e-03] [-6.76132027e-04 -1.71174851e-03 -5.44375281e-04] [ 4.54634020e-04 -1.30409023e-03 -4.23560080e-04] [ 5.64829751e-04 -1.49882693e-03 9.01741222e-04] [-3.64292906e-04 -1.55241031e-03 7.32856163e-04]] Final stress: [-6.69326991e-06 4.77432732e-06 -1.21271464e-05 3.43245022e-05 1.12529594e-07 -4.68370075e-05] Minimization converged after 138 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 3.73279701e-04 -1.08108232e-04 -3.31939627e-04] [-3.74569069e-04 4.90779942e-04 8.65624843e-05] [ 4.40802433e-04 4.59973630e-04 2.08359593e-05] [-4.30981787e-04 4.47567096e-04 3.95720421e-05] [ 6.20720673e-04 8.24405580e-05 9.43304335e-04] [-6.05045631e-04 1.55088379e-04 -1.01884219e-03] [-2.56140923e-04 3.57071024e-04 -8.57348159e-04] [ 2.73078241e-04 2.35996631e-04 7.24023302e-04] [ 2.02480300e-04 -3.79880632e-04 -6.96372602e-04] [-1.98244002e-04 -3.81774201e-04 6.39402028e-04] [ 3.84922322e-04 1.66348670e-04 -6.96569947e-04] [-3.88096730e-04 1.20986954e-04 6.37974485e-04] [-4.08167463e-04 -4.13645602e-04 -4.86167168e-04] [ 4.11550036e-04 -3.81806159e-04 2.99023449e-04] [-1.60765663e-03 -3.07133382e-04 -5.92742965e-04] [ 1.61416608e-03 -3.50303977e-04 4.32253746e-04] [ 2.69705123e-04 2.84572920e-05 -3.72449267e-04] [-2.74714263e-04 -3.99847428e-05 2.89915887e-04] [-5.68243306e-05 2.58520575e-04 6.30784708e-04] [ 5.82226128e-05 3.21807620e-04 -5.26150072e-04] [ 6.32916770e-04 6.97527354e-04 6.67773054e-04] [-6.40734754e-04 6.99315743e-04 -5.94153850e-04] [-1.54623378e-04 6.38979018e-04 3.29213804e-04] [ 1.50526801e-04 5.84169652e-04 -1.84195756e-04] [-2.73980804e-04 7.89000270e-04 -3.93025823e-04] [ 2.62140200e-04 9.64512500e-04 3.57822587e-04] [-8.84399378e-06 1.82635612e-04 5.03518487e-04] [ 5.04127230e-06 4.22502659e-05 -3.27739989e-04] [ 3.25109751e-04 -9.27978536e-04 -1.07138896e-03] [-3.30732057e-04 -9.69182227e-04 1.26577653e-03] [ 3.08074003e-04 6.14664590e-04 -2.50163373e-04] [-3.15358969e-04 6.45525260e-04 1.25943271e-04] [-7.07804520e-04 4.60143518e-04 -2.36457109e-05] [ 7.03473799e-04 4.46708208e-04 -7.65834673e-06] [-6.80900721e-04 -3.05422032e-04 4.18029161e-05] [ 3.22490518e-04 -1.24655246e-03 4.63073288e-04] [ 6.47124475e-04 -2.43765849e-04 7.03226295e-05] [-3.33158589e-04 -1.29070695e-03 -3.70206012e-04] [ 4.33857877e-04 -2.12797380e-04 -2.05459593e-04] [-5.36134536e-04 -4.57932008e-04 5.62126591e-04] [-5.28486695e-04 -1.99478148e-04 2.78844518e-04] [ 6.00466901e-04 -4.89191916e-04 -4.68674703e-04] [-6.24335402e-04 -3.93354197e-04 -1.01048954e-03] [-4.89639412e-04 -1.61892864e-04 -6.55504087e-04] [ 6.59180127e-04 -1.87059684e-04 9.99279383e-04] [ 4.61173559e-04 -3.72025232e-04 6.46396882e-04] [-2.01412364e-04 4.05031876e-04 5.99942408e-04] [-7.78261452e-04 3.80939064e-04 -1.07001107e-04] [ 1.17026428e-04 4.22061285e-04 -6.31490794e-04] [ 8.73069796e-04 3.72968562e-04 5.62764791e-05] [-3.45914257e-04 -8.95253165e-05 -6.75103415e-04] [-8.22496089e-04 -2.49618299e-04 6.02125040e-04] [ 3.44697362e-04 -1.29227158e-04 6.19360229e-04] [ 8.42808098e-04 -2.01016420e-04 -6.61596940e-04] [-4.78271341e-07 -8.16450658e-04 -1.94436683e-04] [-8.15656945e-04 -1.26503835e-04 -2.42295516e-04] [ 1.52501363e-04 -9.01351231e-04 2.20550954e-04] [ 6.53520007e-04 -3.06386741e-05 2.72806894e-04] [-1.75050817e-04 7.60196210e-04 -5.35492309e-04] [-1.78361183e-03 -1.05757789e-04 -5.27021431e-04] [ 1.93001536e-04 6.00603892e-04 5.57652992e-04] [ 1.77243651e-03 4.74505534e-05 5.43908439e-04] [-2.33534826e-05 1.11267067e-03 -3.02183652e-05] [-3.26813426e-05 -5.05907338e-04 3.40797981e-05] [-1.19012295e-04 1.23754084e-03 8.31160344e-05] [ 1.83600317e-04 -6.31623948e-04 2.68074271e-05] [ 6.48943744e-04 2.68698237e-04 -1.69551827e-04] [-2.10609792e-04 -4.00471339e-04 7.68233864e-04] [-6.49595228e-04 2.42085503e-04 1.49823791e-04] [ 2.20719563e-04 -3.73429554e-04 -7.89604185e-04] [-6.37860479e-04 1.35029787e-03 -2.12796476e-04] [-8.20894819e-04 -3.67592503e-04 -4.54996395e-04] [ 7.30744354e-04 1.29010449e-03 2.39684640e-04] [ 7.27920195e-04 -2.78414931e-04 4.74942255e-04] [ 1.90276108e-04 1.40969573e-04 -5.35294635e-04] [ 5.96288423e-05 -1.66728288e-04 -1.42558660e-04] [-1.67476458e-04 1.79378780e-04 4.53499288e-04] [-9.12530993e-05 -2.05640136e-04 5.50118462e-05] [ 1.30009161e-03 -5.93705213e-04 -4.72894998e-04] [-1.29863042e-03 -5.78898361e-04 5.61716878e-04] [ 5.75245007e-04 -4.91245076e-04 -4.12526240e-04] [-5.65353668e-04 -5.23035176e-04 4.91508113e-04] [ 3.06060593e-04 2.39081647e-04 7.17550260e-04] [-3.07071321e-04 2.65232736e-04 -7.27682756e-04] [ 5.31635542e-05 -3.34744528e-04 9.54793513e-04] [-4.64054282e-05 -2.65757618e-04 -9.65093462e-04] [-1.33775806e-03 2.30153571e-04 -4.15094472e-04] [ 1.31553074e-03 -2.14046995e-04 3.65729354e-04] [-3.29529876e-04 5.69312683e-04 4.17374613e-04] [ 3.28230836e-04 6.47291912e-04 -4.88388478e-04] [-5.55831654e-04 -3.37662311e-04 -7.76992384e-04] [ 5.63895381e-04 -3.41581521e-04 6.97108418e-04] [-2.50926564e-06 -3.56163671e-04 9.59889328e-04] [ 1.70288416e-05 -2.95254086e-04 -8.81760482e-04] [-5.04016062e-05 -3.26720137e-04 -6.82572054e-04] [ 2.72746077e-04 -1.46759042e-03 -4.69362479e-04] [ 4.97781737e-05 -4.58112367e-04 8.86356959e-04] [-2.71324563e-04 -1.33929207e-03 6.66312816e-04] [-4.65094467e-04 5.09294489e-04 2.69524548e-04] [ 2.89867887e-04 8.25549946e-04 -6.53692338e-04] [ 4.85578450e-04 4.84275509e-04 -3.72672224e-04] [-2.97910946e-04 8.52023117e-04 5.67845305e-04]] Final stress: [-1.69874577e-06 -9.04354930e-07 -6.54823038e-06 -3.27864273e-05 -2.80535513e-08 -1.92249352e-05] Minimization converged after 140 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 146 steps. Minimization converged after 149 steps. Minimization converged after 144 steps. Minimization converged after 148 steps. Minimization converged after 111 steps. Minimization converged after 112 steps. Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 15 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 12 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 28 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 113 steps. Minimization converged after 115 steps. Minimization converged after 111 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-2.84357147e-03 -2.18023152e-04 2.33656031e-04] [ 2.84357147e-03 2.18022875e-04 2.33656077e-04] [-2.22881926e-03 3.20202918e-04 -4.82239254e-04] [ 2.22881926e-03 -3.20202929e-04 -4.82239256e-04] [-2.19327747e-03 -2.94873903e-03 2.25018791e-03] [ 2.19327747e-03 2.94873902e-03 2.25018791e-03] [ 3.67207417e-03 2.41197753e-03 -2.05742482e-03] [-3.67207417e-03 -2.41197754e-03 -2.05742481e-03] [-4.69633614e-04 -5.29542195e-03 2.79501598e-03] [ 4.69633613e-04 5.29542194e-03 2.79501599e-03] [-5.82408657e-04 2.59612101e-03 -3.40041204e-04] [ 5.82408661e-04 -2.59612099e-03 -3.40041176e-04] [ 2.12168967e-03 -1.95233390e-03 6.72172201e-04] [-2.12168967e-03 1.95233390e-03 6.72172195e-04] [ 6.18600951e-03 3.64109332e-03 -4.77096066e-03] [-6.18600950e-03 -3.64109323e-03 -4.77096062e-03] [-3.98618867e-04 -3.03800090e-03 3.32116796e-03] [ 3.98618869e-04 3.03800090e-03 3.32116796e-03] [-7.62361316e-04 1.80295975e-03 4.64683795e-04] [ 7.62361318e-04 -1.80295977e-03 4.64683805e-04] [-4.39870753e-03 3.04133154e-03 -4.49645819e-03] [ 4.39870754e-03 -3.04133154e-03 -4.49645818e-03] [ 2.80203005e-03 -7.82500324e-04 -1.61006874e-03] [-2.80203005e-03 7.82500475e-04 -1.61006876e-03] [ 1.26288082e-04 2.75708205e-03 -6.28889955e-04] [-1.26288083e-04 -2.75708205e-03 -6.28889974e-04] [ 9.87741223e-05 -4.34673554e-03 1.72695669e-03] [-9.87741182e-05 4.34673550e-03 1.72695665e-03] [-3.16309504e-03 -3.84947523e-03 1.77092481e-03] [ 3.16309504e-03 3.84947522e-03 1.77092479e-03] [ 4.68870643e-04 3.83442343e-03 -2.82308150e-03] [-4.68870642e-04 -3.83442343e-03 -2.82308149e-03] [ 3.32226287e-03 -8.56241121e-04 5.43850311e-04] [-3.32226287e-03 8.56241170e-04 5.43850314e-04] [ 1.73393762e-03 -3.91436840e-03 -1.18444795e-03] [-1.73393762e-03 3.91436841e-03 -1.18444795e-03] [-2.79841305e-03 -1.41875103e-03 -3.23380845e-03] [ 2.79841305e-03 1.41875104e-03 -3.23380845e-03] [-1.57498791e-03 -1.47893059e-03 -3.47515431e-03] [ 1.57498789e-03 1.47893063e-03 -3.47515427e-03] [ 9.85175531e-04 2.05107718e-03 2.38721029e-03] [-9.85175512e-04 -2.05107714e-03 2.38721025e-03] [ 2.85867034e-03 5.25107893e-03 2.28288634e-03] [-2.85867033e-03 -5.25107892e-03 2.28288635e-03] [ 1.48131653e-03 1.08894005e-03 -2.08421781e-03] [-1.48131654e-03 -1.08894003e-03 -2.08421782e-03] [ 6.52333430e-04 -1.40066048e-03 -1.29174948e-03] [-6.52333472e-04 1.40066047e-03 -1.29174948e-03] [ 9.83644922e-04 -1.40343801e-03 4.19908927e-03] [-9.83644882e-04 1.40343799e-03 4.19908926e-03] [-8.62683689e-04 1.84669279e-03 4.09471581e-03] [ 8.62683701e-04 -1.84669279e-03 4.09471580e-03] [ 1.02137672e-04 -3.76473530e-04 1.55674346e-03] [-1.02137679e-04 3.76473522e-04 1.55674346e-03] [-1.20123350e-03 2.17884866e-03 -4.94457408e-03] [ 1.20123349e-03 -2.17884865e-03 -4.94457409e-03] [ 2.02141349e-03 7.55142226e-04 -2.97856121e-03] [-2.02141349e-03 -7.55142210e-04 -2.97856120e-03] [-6.96150980e-04 -1.16580259e-03 1.10282254e-03] [ 6.96150984e-04 1.16580258e-03 1.10282253e-03] [ 5.21136396e-03 1.99649419e-03 7.98331125e-05] [-5.21136397e-03 -1.99649420e-03 7.98331179e-05] [ 6.08551880e-04 -1.17406677e-04 -4.53574519e-03] [-6.08551913e-04 1.17406615e-04 -4.53574523e-03] [ 2.78959941e-03 -4.09740878e-03 2.27499493e-03] [-2.78959938e-03 4.09740872e-03 2.27499498e-03] [ 2.46734946e-03 2.45745986e-04 -1.78848928e-03] [-2.46734947e-03 -2.45745993e-04 -1.78848928e-03] [ 2.78907440e-03 -1.01745563e-03 3.38497176e-03] [-2.78907439e-03 1.01745562e-03 3.38497177e-03] [-1.80638763e-03 -1.72162718e-03 2.23560299e-03] [ 1.80638764e-03 1.72162716e-03 2.23560299e-03] [ 4.27367405e-03 -4.14461384e-03 1.03205367e-03] [-4.27367409e-03 4.14461380e-03 1.03205366e-03] [ 7.22475142e-04 8.87432556e-04 -4.21074311e-05] [-7.22475154e-04 -8.87432563e-04 -4.21074325e-05] [ 3.01196321e-03 -1.39102555e-03 -2.42585920e-03] [-3.01196319e-03 1.39102555e-03 -2.42585919e-03] [-3.39294102e-03 -6.43875929e-04 -9.21031741e-05] [ 3.39294103e-03 6.43875941e-04 -9.21031710e-05] [-1.91401408e-03 5.55390168e-04 -3.94048988e-04] [ 1.91401408e-03 -5.55390164e-04 -3.94048978e-04] [-4.34018320e-04 -1.21443016e-03 8.13555694e-04] [ 4.34018317e-04 1.21443016e-03 8.13555695e-04] [ 7.70315910e-04 8.18250814e-06 1.73263019e-03] [-7.70315911e-04 -8.18249904e-06 1.73263020e-03] [ 4.06227488e-03 -5.79403409e-03 1.97664904e-03] [-4.06227489e-03 5.79403431e-03 1.97664903e-03] [ 1.71875396e-05 -1.45332443e-03 -2.41119817e-04] [-1.71875376e-05 1.45332443e-03 -2.41119826e-04] [ 3.78548647e-03 9.45848028e-04 6.30119912e-04] [-3.78548647e-03 -9.45848039e-04 6.30119920e-04] [-3.71292277e-04 1.07410427e-03 -1.95813963e-03] [ 3.71292279e-04 -1.07410442e-03 -1.95813964e-03] [-2.35057264e-03 1.55846570e-03 4.64349480e-03] [ 2.35057262e-03 -1.55846566e-03 4.64349477e-03] [-1.52284448e-03 -3.58633731e-03 1.46920110e-04] [ 1.52284450e-03 3.58633735e-03 1.46920131e-04] [ 7.52494282e-04 -4.00030202e-04 -5.55517225e-05] [-7.52494290e-04 4.00030186e-04 -5.55517099e-05] [-4.99896955e-03 1.92515166e-03 -4.18067604e-04] [ 4.99896956e-03 -1.92515168e-03 -4.18067613e-04]] Final stress: [-6.02268469e-05 -1.12103742e-05 -6.59414170e-05 -7.35739010e-15 -2.09152578e-15 8.39511884e-05] Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 19 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.85395417e-04 -2.96512365e-05 -2.46938863e-05] [-1.85395417e-04 2.96512362e-05 -2.46938870e-05] [ 2.16197394e-04 -2.95419726e-04 -3.23830235e-05] [-2.16197394e-04 2.95419725e-04 -3.23830234e-05] [ 1.48369106e-04 7.10801159e-05 1.78249960e-04] [-1.48369106e-04 -7.10801161e-05 1.78249959e-04] [-2.95135477e-04 3.99386466e-04 -6.93421592e-05] [ 2.95135477e-04 -3.99386468e-04 -6.93421617e-05] [ 4.40006104e-05 -1.74695232e-04 1.55312492e-04] [-4.40006103e-05 1.74695231e-04 1.55312494e-04] [ 4.95583910e-05 1.56687362e-06 -2.40077282e-04] [-4.95583910e-05 -1.56687348e-06 -2.40077282e-04] [-2.66938157e-04 -2.53289799e-05 1.86697945e-04] [ 2.66938157e-04 2.53289806e-05 1.86697945e-04] [-5.59030966e-04 3.84593520e-04 2.43533733e-04] [ 5.59030966e-04 -3.84593518e-04 2.43533732e-04] [ 2.53028550e-05 -2.98138283e-04 2.98645749e-04] [-2.53028548e-05 2.98138284e-04 2.98645749e-04] [ 1.19363083e-04 -3.41358605e-05 -1.27869421e-04] [-1.19363083e-04 3.41358603e-05 -1.27869420e-04] [ 4.06596215e-04 2.48806980e-04 -3.39943886e-05] [-4.06596215e-04 -2.48806979e-04 -3.39943882e-05] [-2.72921730e-04 -3.80823296e-06 -1.28281573e-04] [ 2.72921731e-04 3.80823767e-06 -1.28281575e-04] [ 6.86247447e-06 -1.20325641e-04 3.25625765e-06] [-6.86247485e-06 1.20325640e-04 3.25625586e-06] [-2.30692801e-05 -3.63949327e-04 -4.23245659e-04] [ 2.30692799e-05 3.63949327e-04 -4.23245660e-04] [ 2.59011852e-04 -8.24525582e-05 2.53694972e-04] [-2.59011852e-04 8.24525578e-05 2.53694972e-04] [ 2.76008184e-05 -1.91391515e-04 -1.71145297e-04] [-2.76008186e-05 1.91391515e-04 -1.71145296e-04] [-2.67905914e-04 1.85222630e-04 2.31612556e-06] [ 2.67905914e-04 -1.85222631e-04 2.31612549e-06] [-9.58707770e-05 1.98759764e-04 -7.17911036e-05] [ 9.58707772e-05 -1.98759764e-04 -7.17911040e-05] [ 3.23703689e-04 1.80666268e-04 2.04194331e-05] [-3.23703689e-04 -1.80666267e-04 2.04194333e-05] [-1.89649501e-05 -7.39220651e-05 2.24147442e-04] [ 1.89649496e-05 7.39220656e-05 2.24147442e-04] [-7.68528719e-05 9.14247182e-05 -3.10786907e-04] [ 7.68528735e-05 -9.14247168e-05 -3.10786908e-04] [ 4.28486015e-05 -3.92033962e-04 -2.48165339e-04] [-4.28486012e-05 3.92033963e-04 -2.48165339e-04] [ 1.23046146e-04 -1.14999051e-04 2.04909972e-04] [-1.23046146e-04 1.14999052e-04 2.04909972e-04] [ 4.91940932e-05 2.60353323e-06 2.98203119e-04] [-4.91940943e-05 -2.60353282e-06 2.98203119e-04] [ 5.38141619e-05 2.21311341e-04 -1.00956558e-04] [-5.38141613e-05 -2.21311341e-04 -1.00956558e-04] [ 2.03601907e-04 4.18977437e-05 2.04213341e-05] [-2.03601907e-04 -4.18977433e-05 2.04213334e-05] [-6.51828914e-05 -2.21531014e-04 7.21379362e-05] [ 6.51828911e-05 2.21531014e-04 7.21379371e-05] [ 2.28282348e-04 -1.22497977e-04 6.95951777e-05] [-2.28282348e-04 1.22497976e-04 6.95951781e-05] [-5.71936085e-05 -1.17976122e-04 -1.21217476e-04] [ 5.71936087e-05 1.17976120e-04 -1.21217476e-04] [ 2.35549927e-04 -1.17507328e-04 -4.29870236e-05] [-2.35549927e-04 1.17507328e-04 -4.29870240e-05] [-2.91190523e-04 1.08955355e-04 1.67968045e-04] [ 2.91190523e-04 -1.08955355e-04 1.67968045e-04] [ 1.27448428e-04 3.99315413e-04 4.22736548e-04] [-1.27448428e-04 -3.99315413e-04 4.22736547e-04] [-1.26474286e-04 4.39833081e-05 -2.32634983e-04] [ 1.26474284e-04 -4.39833082e-05 -2.32634983e-04] [ 2.22108131e-04 1.26320433e-04 2.82902946e-04] [-2.22108131e-04 -1.26320434e-04 2.82902945e-04] [ 2.82159123e-04 -9.44508496e-05 -2.00681613e-04] [-2.82159124e-04 9.44508496e-05 -2.00681612e-04] [ 3.80909773e-04 1.67144207e-04 -1.28572940e-04] [-3.80909772e-04 -1.67144208e-04 -1.28572940e-04] [-1.30409314e-04 2.47962184e-04 -7.09818854e-05] [ 1.30409313e-04 -2.47962185e-04 -7.09818859e-05] [ 2.42302460e-04 2.25858636e-04 -3.35250402e-04] [-2.42302460e-04 -2.25858635e-04 -3.35250403e-04] [-8.92509749e-05 -1.46419714e-04 -1.42671436e-04] [ 8.92509755e-05 1.46419714e-04 -1.42671435e-04] [ 2.76077227e-04 5.71292989e-05 1.58319553e-05] [-2.76077227e-04 -5.71292981e-05 1.58319567e-05] [ 1.96593189e-04 5.04068493e-04 1.51696551e-05] [-1.96593189e-04 -5.04068493e-04 1.51696542e-05] [ 1.70461019e-05 1.80382469e-04 9.22496691e-05] [-1.70461021e-05 -1.80382470e-04 9.22496686e-05] [-4.59924354e-06 2.15557160e-05 -8.74799664e-05] [ 4.59924387e-06 -2.15557134e-05 -8.74799651e-05] [-1.73937803e-04 -3.07693648e-04 4.19086822e-05] [ 1.73937804e-04 3.07693649e-04 4.19086825e-05] [-2.83323170e-05 -4.39395278e-04 7.83961865e-05] [ 2.83323173e-05 4.39395279e-04 7.83961856e-05] [-3.11804950e-04 1.37804754e-04 -1.70709195e-04] [ 3.11804950e-04 -1.37804755e-04 -1.70709195e-04] [-1.46235196e-05 4.22677449e-05 -3.10955487e-05] [ 1.46235189e-05 -4.22677489e-05 -3.10955479e-05] [ 6.81819305e-05 2.64919377e-04 -1.64903627e-04] [-6.81819312e-05 -2.64919376e-04 -1.64903626e-04] [ 5.80007619e-05 -1.17843806e-04 2.27237182e-04] [-5.80007612e-05 1.17843806e-04 2.27237181e-04] [-2.25904526e-04 -1.22754789e-04 3.74935237e-05] [ 2.25904526e-04 1.22754789e-04 3.74935253e-05] [ 2.38632683e-04 2.40380048e-05 9.84826558e-05] [-2.38632683e-04 -2.40380049e-05 9.84826545e-05]] Final stress: [ 1.83284230e-05 3.09629880e-05 8.82854458e-06 1.76870144e-16 -9.56054835e-17 -5.95383384e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-2.02463731e-03 2.03490220e-04 -2.17446653e-03] [ 2.02463731e-03 -2.03490215e-04 -2.17446653e-03] [-3.41137838e-03 -4.63395026e-03 -8.11568196e-04] [ 3.41137838e-03 4.63395027e-03 -8.11568201e-04] [-1.41336409e-03 7.11045232e-04 2.31405030e-03] [ 1.41336409e-03 -7.11045238e-04 2.31405031e-03] [ 5.44358843e-03 6.81735688e-03 1.90384233e-04] [-5.44358843e-03 -6.81735686e-03 1.90384241e-04] [ 9.22575406e-05 -2.18105063e-03 3.10248373e-03] [-9.22575431e-05 2.18105063e-03 3.10248373e-03] [-3.41676419e-04 8.26302978e-04 -5.01271351e-03] [ 3.41676421e-04 -8.26302978e-04 -5.01271350e-03] [ 4.23372113e-03 -1.80007698e-04 3.29180182e-03] [-4.23372113e-03 1.80007708e-04 3.29180182e-03] [ 6.25902645e-03 9.49426384e-04 1.09119629e-02] [-6.25902645e-03 -9.49426400e-04 1.09119629e-02] [ 1.35044982e-03 -5.33787967e-03 4.51662459e-03] [-1.35044983e-03 5.33787966e-03 4.51662458e-03] [-2.63141049e-03 -2.69706772e-05 -3.97747395e-03] [ 2.63141049e-03 2.69706826e-05 -3.97747395e-03] [-9.49821371e-03 3.07079427e-03 -2.28556141e-03] [ 9.49821371e-03 -3.07079427e-03 -2.28556140e-03] [ 7.75108837e-03 -2.72776623e-03 -1.43315514e-03] [-7.75108837e-03 2.72776622e-03 -1.43315514e-03] [-3.53952674e-03 -7.77842441e-03 5.09546563e-03] [ 3.53952673e-03 7.77842438e-03 5.09546560e-03] [-3.61243770e-04 -4.58519930e-04 -1.27216808e-02] [ 3.61243770e-04 4.58519934e-04 -1.27216808e-02] [-4.45809452e-03 -9.43709386e-04 5.32297118e-03] [ 4.45809452e-03 9.43709395e-04 5.32297117e-03] [-2.36392166e-05 -4.26853585e-03 -3.82300282e-03] [ 2.36392082e-05 4.26853584e-03 -3.82300281e-03] [ 5.30723929e-03 2.98938211e-03 -3.33649551e-04] [-5.30723929e-03 -2.98938210e-03 -3.33649541e-04] [ 1.60703337e-03 -2.03866722e-03 2.26840104e-03] [-1.60703338e-03 2.03866723e-03 2.26840103e-03] [-3.61048068e-03 -2.46412248e-03 -2.13630578e-03] [ 3.61048070e-03 2.46412249e-03 -2.13630577e-03] [ 2.50685935e-03 -1.27755890e-03 -4.96865890e-03] [-2.50685935e-03 1.27755889e-03 -4.96865892e-03] [-3.27535526e-03 1.81940697e-04 3.43255455e-03] [ 3.27535526e-03 -1.81940695e-04 3.43255456e-03] [ 3.43003115e-03 1.68832163e-03 6.07911008e-03] [-3.43003116e-03 -1.68832164e-03 6.07911009e-03] [-4.79362333e-04 1.00865962e-02 -3.53231441e-03] [ 4.79362344e-04 -1.00865962e-02 -3.53231441e-03] [ 1.94872096e-03 -5.32964483e-03 6.65116584e-06] [-1.94872096e-03 5.32964482e-03 6.65117196e-06] [-2.23060523e-03 -4.68529117e-04 4.24031700e-03] [ 2.23060523e-03 4.68529116e-04 4.24031699e-03] [-4.78430138e-03 2.58364975e-03 -1.34328515e-04] [ 4.78430138e-03 -2.58364975e-03 -1.34328526e-04] [ 9.27853793e-04 -1.40214552e-03 3.90913524e-04] [-9.27853782e-04 1.40214551e-03 3.90913519e-04] [-4.96252687e-03 4.90790419e-04 -1.90332075e-03] [ 4.96252685e-03 -4.90790421e-04 -1.90332075e-03] [ 5.17725807e-03 -2.43561855e-03 4.53882160e-03] [-5.17725805e-03 2.43561855e-03 4.53882159e-03] [-3.41969923e-03 -1.51184161e-03 2.92578559e-03] [ 3.41969922e-03 1.51184162e-03 2.92578559e-03] [ 4.09946666e-03 1.94883276e-03 -1.11803790e-03] [-4.09946666e-03 -1.94883276e-03 -1.11803790e-03] [-4.11064180e-03 -1.27725167e-03 -6.92958507e-03] [ 4.11064182e-03 1.27725167e-03 -6.92958507e-03] [ 3.41686980e-04 -2.76043469e-03 1.21405637e-02] [-3.41686982e-04 2.76043469e-03 1.21405637e-02] [ 6.01857274e-03 1.20132283e-03 -3.50628326e-03] [-6.01857274e-03 -1.20132283e-03 -3.50628327e-03] [ 1.77389205e-03 -4.36032323e-03 5.93738785e-03] [-1.77389206e-03 4.36032323e-03 5.93738784e-03] [-1.13269875e-02 2.26776647e-03 4.45604243e-04] [ 1.13269875e-02 -2.26776647e-03 4.45604246e-04] [ 1.31932980e-02 3.43037184e-03 -4.25520554e-03] [-1.31932979e-02 -3.43037185e-03 -4.25520554e-03] [-4.27054927e-03 2.46483695e-03 -2.99160330e-03] [ 4.27054927e-03 -2.46483694e-03 -2.99160331e-03] [ 5.05340191e-03 -3.38955327e-03 -7.74752593e-03] [-5.05340192e-03 3.38955328e-03 -7.74752593e-03] [-4.46110872e-04 3.03756195e-03 1.53850678e-04] [ 4.46110869e-04 -3.03756194e-03 1.53850684e-04] [-4.16352962e-04 1.04018223e-02 1.29705007e-03] [ 4.16352961e-04 -1.04018223e-02 1.29705008e-03] [ 1.49014258e-04 2.73188182e-03 4.97873649e-04] [-1.49014267e-04 -2.73188183e-03 4.97873643e-04] [ 4.09229432e-03 1.32352057e-03 -2.56528901e-03] [-4.09229432e-03 -1.32352058e-03 -2.56528900e-03] [-4.95421380e-04 -3.91308220e-03 -1.03088601e-03] [ 4.95421376e-04 3.91308220e-03 -1.03088601e-03] [-2.21046382e-03 -8.33100573e-03 9.24913316e-04] [ 2.21046380e-03 8.33100574e-03 9.24913320e-04] [ 6.87318159e-03 4.22137389e-03 -3.37013303e-03] [-6.87318159e-03 -4.22137389e-03 -3.37013302e-03] [-2.76327448e-03 8.94229958e-04 2.91852784e-04] [ 2.76327447e-03 -8.94229963e-04 2.91852790e-04] [ 1.51432013e-04 6.67901495e-03 1.39938965e-03] [-1.51432007e-04 -6.67901495e-03 1.39938965e-03] [ 1.26835780e-03 -2.35235962e-03 -2.08244594e-03] [-1.26835782e-03 2.35235961e-03 -2.08244594e-03] [ 5.14995662e-03 -2.51985880e-03 3.43364996e-04] [-5.14995661e-03 2.51985881e-03 3.43365005e-04] [-2.59832510e-03 -7.63426263e-05 -1.21495471e-03] [ 2.59832510e-03 7.63426268e-05 -1.21495473e-03]] Final stress: [-4.42193528e-05 4.19095709e-05 -1.15520375e-04 -2.41523353e-15 8.97974504e-15 1.31380595e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 2.06089644e-03 9.33205177e-04 -6.80476582e-04] [-2.06089644e-03 -9.33205115e-04 -6.80476595e-04] [ 2.09074839e-03 2.49371587e-03 7.54650634e-04] [-2.09074839e-03 -2.49371589e-03 7.54650644e-04] [ 1.20791851e-03 -1.28393064e-03 -2.24607612e-03] [-1.20791851e-03 1.28393063e-03 -2.24607612e-03] [-2.63351049e-03 -4.11927273e-03 1.13580940e-03] [ 2.63351049e-03 4.11927275e-03 1.13580941e-03] [ 5.87481668e-04 1.90615414e-03 -1.64898677e-03] [-5.87481669e-04 -1.90615414e-03 -1.64898678e-03] [ 5.12169254e-04 5.64130095e-04 2.09606920e-03] [-5.12169252e-04 -5.64130100e-04 2.09606919e-03] [-2.25142884e-03 -3.81298649e-05 -2.06388752e-03] [ 2.25142885e-03 3.81298701e-05 -2.06388751e-03] [-5.67935098e-03 -4.97207007e-03 -1.33204807e-03] [ 5.67935098e-03 4.97207006e-03 -1.33204806e-03] [ 4.30633844e-04 3.21875098e-03 -3.42242400e-03] [-4.30633839e-04 -3.21875097e-03 -3.42242399e-03] [ 1.12471308e-03 5.29314509e-04 1.13987105e-03] [-1.12471309e-03 -5.29314505e-04 1.13987104e-03] [ 3.07754155e-03 -2.24847039e-03 5.33838262e-04] [-3.07754155e-03 2.24847038e-03 5.33838274e-04] [-1.39739205e-03 -5.67988048e-04 2.14651204e-03] [ 1.39739205e-03 5.67988136e-04 2.14651201e-03] [-4.75728353e-04 -1.56785281e-04 4.44954722e-04] [ 4.75728358e-04 1.56785251e-04 4.44954665e-04] [-9.73292982e-05 4.71721316e-03 3.51809318e-03] [ 9.73293014e-05 -4.71721319e-03 3.51809316e-03] [ 2.50877171e-03 9.93023745e-04 -7.62611800e-04] [-2.50877171e-03 -9.93023742e-04 -7.62611801e-04] [-6.05116738e-05 1.29023625e-03 8.67766720e-04] [ 6.05116781e-05 -1.29023625e-03 8.67766729e-04] [-2.43776272e-03 -2.06117085e-03 -6.60338745e-04] [ 2.43776272e-03 2.06117083e-03 -6.60338738e-04] [-3.94372077e-03 1.39631086e-03 8.52472976e-04] [ 3.94372078e-03 -1.39631087e-03 8.52472974e-04] [ 8.39960603e-04 2.21850449e-03 1.17052908e-03] [-8.39960607e-04 -2.21850449e-03 1.17052907e-03] [ 1.05617701e-03 8.01284757e-04 3.27939989e-03] [-1.05617700e-03 -8.01284753e-04 3.27939990e-03] [-7.30154030e-04 -5.52719211e-04 -1.51231338e-03] [ 7.30154042e-04 5.52719222e-04 -1.51231339e-03] [-7.07916829e-04 -1.59157314e-03 -1.64990374e-03] [ 7.07916831e-04 1.59157314e-03 -1.64990374e-03] [-2.67938603e-04 -1.97102955e-03 2.10631795e-03] [ 2.67938607e-04 1.97102955e-03 2.10631795e-03] [-7.34245208e-04 2.05365941e-03 1.46299006e-03] [ 7.34245201e-04 -2.05365940e-03 1.46299004e-03] [-1.26929591e-03 -3.31738190e-04 -3.03421214e-03] [ 1.26929590e-03 3.31738207e-04 -3.03421212e-03] [-1.99275377e-04 -2.10032435e-03 -1.31582518e-03] [ 1.99275378e-04 2.10032434e-03 -1.31582517e-03] [-1.89288977e-03 -9.95509168e-05 -6.15665302e-04] [ 1.89288977e-03 9.95509175e-05 -6.15665304e-04] [ 6.77057246e-04 -1.65846912e-03 7.86587225e-04] [-6.77057262e-04 1.65846913e-03 7.86587234e-04] [-1.30664707e-03 -1.83709916e-03 -3.07376662e-04] [ 1.30664706e-03 1.83709918e-03 -3.07376659e-04] [ 2.73452559e-03 1.57293466e-03 -1.57327525e-03] [-2.73452559e-03 -1.57293466e-03 -1.57327525e-03] [-1.67279328e-03 -1.84347005e-03 4.43893227e-04] [ 1.67279328e-03 1.84347005e-03 4.43893225e-04] [ 2.85723617e-04 1.14770269e-04 1.06727678e-03] [-2.85723608e-04 -1.14770260e-04 1.06727679e-03] [-2.17913578e-03 4.08013220e-03 -2.99955822e-03] [ 2.17913576e-03 -4.08013218e-03 -2.99955824e-03] [-2.59760080e-03 -8.94696462e-04 1.49226924e-03] [ 2.59760080e-03 8.94696461e-04 1.49226923e-03] [-2.31762876e-03 1.11935862e-03 -2.45807183e-03] [ 2.31762876e-03 -1.11935862e-03 -2.45807182e-03] [-1.80784606e-04 4.00101728e-03 1.20096634e-03] [ 1.80784598e-04 -4.00101728e-03 1.20096633e-03] [-1.32564020e-03 2.98234841e-03 1.51056411e-03] [ 1.32564021e-03 -2.98234841e-03 1.51056411e-03] [ 6.23551819e-05 -1.33716041e-03 1.20235849e-03] [-6.23551770e-05 1.33716042e-03 1.20235850e-03] [-2.09670630e-03 1.85533927e-03 2.60216697e-03] [ 2.09670630e-03 -1.85533927e-03 2.60216696e-03] [ 3.04686581e-03 -4.74995632e-04 3.18900753e-04] [-3.04686581e-03 4.74995650e-04 3.18900762e-04] [ 2.40182865e-03 -4.26403759e-03 2.70828280e-04] [-2.40182865e-03 4.26403758e-03 2.70828272e-04] [ 4.68916371e-04 -1.48877445e-03 -1.30652575e-03] [-4.68916370e-04 1.48877445e-03 -1.30652576e-03] [ 4.08785511e-04 3.40245065e-04 -4.07584789e-05] [-4.08785498e-04 -3.40245079e-04 -4.07584867e-05] [-2.58743948e-03 3.25443117e-03 -8.96255951e-04] [ 2.58743949e-03 -3.25443123e-03 -8.96255950e-04] [-6.79675377e-04 3.73351265e-03 -1.16651215e-03] [ 6.79675379e-04 -3.73351265e-03 -1.16651215e-03] [-2.39356792e-03 -1.17015433e-03 1.20266104e-03] [ 2.39356792e-03 1.17015433e-03 1.20266103e-03] [-7.83593573e-04 -3.75946231e-04 6.85389551e-04] [ 7.83593573e-04 3.75946172e-04 6.85389556e-04] [ 5.70982370e-06 1.20677567e-04 -2.25687335e-03] [-5.70981819e-06 -1.20677574e-04 -2.25687335e-03] [-2.33484915e-04 2.50505173e-03 2.05788382e-03] [ 2.33484907e-04 -2.50505174e-03 2.05788381e-03] [-1.84640244e-03 -4.06530213e-04 -1.43848677e-03] [ 1.84640244e-03 4.06530204e-04 -1.43848673e-03] [ 2.32661076e-03 -1.36165414e-03 -9.62557178e-04] [-2.32661077e-03 1.36165413e-03 -9.62557215e-04]] Final stress: [-2.36408937e-05 -1.57100252e-05 -5.51553129e-06 -1.94428236e-14 -1.23770520e-14 -4.70550777e-05] Minimization converged after 116 steps. Minimization converged after 18 steps. Minimization converged after 21 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-1.43683646e-04 -7.66538711e-04 -6.38734607e-04] [ 1.43683647e-04 7.66538699e-04 -6.38734604e-04] [-1.69033747e-04 -5.49730377e-04 1.41690899e-04] [ 1.69033747e-04 5.49730373e-04 1.41690896e-04] [ 8.12743525e-04 1.11070227e-03 2.49031293e-04] [-8.12743525e-04 -1.11070227e-03 2.49031292e-04] [-3.08959805e-04 -3.33275917e-04 -3.04443315e-04] [ 3.08959805e-04 3.33275919e-04 -3.04443313e-04] [ 4.78473861e-04 5.39659372e-04 8.48409346e-04] [-4.78473862e-04 -5.39659373e-04 8.48409347e-04] [-2.66364189e-04 -1.92017131e-04 1.90138463e-04] [ 2.66364189e-04 1.92017131e-04 1.90138464e-04] [-9.10940641e-04 -4.14989514e-04 6.76638011e-04] [ 9.10940641e-04 4.14989512e-04 6.76638012e-04] [-2.74816133e-03 7.95655644e-04 1.72861859e-03] [ 2.74816133e-03 -7.95655639e-04 1.72861859e-03] [ 1.13060547e-03 -1.34678994e-04 3.69007935e-04] [-1.13060547e-03 1.34678995e-04 3.69007938e-04] [ 1.06088903e-03 3.90321578e-04 -4.87746981e-04] [-1.06088903e-03 -3.90321581e-04 -4.87746983e-04] [ 4.66014935e-04 -5.20137282e-04 -3.59847441e-04] [-4.66014935e-04 5.20137280e-04 -3.59847441e-04] [-6.74361302e-04 -6.08399269e-04 8.41162011e-06] [ 6.74361302e-04 6.08399265e-04 8.41162265e-06] [-2.53799626e-04 -4.52017342e-05 6.82712451e-05] [ 2.53799627e-04 4.52017319e-05 6.82712444e-05] [ 2.89500162e-04 -1.28204833e-04 -1.45163413e-03] [-2.89500161e-04 1.28204833e-04 -1.45163413e-03] [ 3.02188081e-04 1.49177464e-03 -2.14397657e-03] [-3.02188081e-04 -1.49177464e-03 -2.14397657e-03] [ 8.71638487e-04 -1.23417448e-03 4.27227952e-04] [-8.71638488e-04 1.23417448e-03 4.27227952e-04] [ 9.20979116e-04 5.01181331e-04 -3.09289764e-05] [-9.20979116e-04 -5.01181332e-04 -3.09289787e-05] [ 3.52690932e-04 7.16863294e-04 -4.74228600e-04] [-3.52690934e-04 -7.16863291e-04 -4.74228601e-04] [-7.24348913e-05 -4.62524396e-04 -7.14515954e-04] [ 7.24348923e-05 4.62524398e-04 -7.14515955e-04] [ 4.74607257e-04 7.06277769e-04 -3.90161694e-04] [-4.74607256e-04 -7.06277767e-04 -3.90161693e-04] [-8.59609343e-04 -4.28256256e-04 3.77773413e-04] [ 8.59609343e-04 4.28256257e-04 3.77773413e-04] [-2.96550660e-05 2.06964147e-05 1.03716400e-03] [ 2.96550662e-05 -2.06964150e-05 1.03716400e-03] [-5.77102169e-04 -1.46940367e-03 6.69321127e-04] [ 5.77102168e-04 1.46940367e-03 6.69321127e-04] [-4.07346166e-04 -7.30070998e-04 -1.58809166e-03] [ 4.07346165e-04 7.30070999e-04 -1.58809165e-03] [-2.62786789e-04 -6.87735544e-04 9.65020179e-04] [ 2.62786789e-04 6.87735546e-04 9.65020176e-04] [ 2.51911146e-04 3.10683149e-04 9.30363893e-04] [-2.51911148e-04 -3.10683151e-04 9.30363894e-04] [-9.70799201e-04 6.35524779e-04 -2.15416724e-04] [ 9.70799202e-04 -6.35524777e-04 -2.15416723e-04] [-1.66647686e-03 -6.41547853e-04 6.10946688e-04] [ 1.66647686e-03 6.41547853e-04 6.10946688e-04] [-3.46694205e-05 -1.30478037e-03 6.79140477e-04] [ 3.46694203e-05 1.30478037e-03 6.79140478e-04] [ 5.82822525e-04 -1.64380798e-03 -1.36735870e-03] [-5.82822524e-04 1.64380798e-03 -1.36735870e-03] [-1.08938481e-03 7.25578712e-05 -3.85012618e-04] [ 1.08938480e-03 -7.25578714e-05 -3.85012618e-04] [-1.56749023e-03 -2.41953292e-04 -1.16648981e-03] [ 1.56749023e-03 2.41953292e-04 -1.16648981e-03] [ 5.76095469e-04 7.43752388e-04 1.04058192e-03] [-5.76095467e-04 -7.43752389e-04 1.04058192e-03] [ 1.80854208e-03 -1.09277853e-03 1.34451056e-03] [-1.80854208e-03 1.09277853e-03 1.34451056e-03] [-7.56298796e-04 6.26494254e-04 -1.66016936e-04] [ 7.56298795e-04 -6.26494256e-04 -1.66016936e-04] [-3.84641005e-04 -1.51390716e-03 9.57175237e-04] [ 3.84641006e-04 1.51390716e-03 9.57175237e-04] [-5.60154705e-04 -7.34947766e-04 -1.78575618e-03] [ 5.60154702e-04 7.34947764e-04 -1.78575618e-03] [ 1.51629722e-03 2.35987661e-04 1.02080007e-03] [-1.51629722e-03 -2.35987661e-04 1.02080006e-03] [ 1.49541396e-04 -4.48866564e-04 -1.27875206e-04] [-1.49541396e-04 4.48866564e-04 -1.27875207e-04] [ 2.03316210e-03 -1.60361707e-04 -3.15714911e-04] [-2.03316210e-03 1.60361710e-04 -3.15714912e-04] [ 2.25089618e-03 -4.27538194e-05 -1.99608868e-04] [-2.25089618e-03 4.27538205e-05 -1.99608868e-04] [-2.87240709e-04 -5.84506783e-04 -8.25147477e-04] [ 2.87240710e-04 5.84506784e-04 -8.25147477e-04] [ 1.72287186e-03 3.20205279e-04 7.95427210e-04] [-1.72287186e-03 -3.20205279e-04 7.95427210e-04] [-5.99148639e-04 7.31238556e-04 -5.58640440e-04] [ 5.99148639e-04 -7.31238549e-04 -5.58640441e-04] [-2.09983689e-03 2.50304025e-04 -4.38484841e-04] [ 2.09983689e-03 -2.50304024e-04 -4.38484841e-04] [ 6.67859209e-04 -3.44543840e-04 1.79012251e-04] [-6.67859209e-04 3.44543841e-04 1.79012256e-04] [-2.39400500e-04 -2.10024611e-04 1.05784027e-04] [ 2.39400500e-04 2.10024613e-04 1.05784024e-04] [-1.82240320e-03 5.79805616e-04 -2.67706015e-04] [ 1.82240320e-03 -5.79805615e-04 -2.67706019e-04] [ 4.94016833e-04 1.27800223e-03 2.86620954e-04] [-4.94016832e-04 -1.27800223e-03 2.86620955e-04] [-6.53584771e-04 5.25494006e-04 -5.79336318e-05] [ 6.53584773e-04 -5.25494003e-04 -5.79336337e-05] [-4.00739110e-04 2.03774102e-04 7.54384934e-04] [ 4.00739109e-04 -2.03774100e-04 7.54384933e-04]] Final stress: [ 1.78625475e-05 2.58359541e-07 9.67579036e-05 -2.47737709e-15 -4.09908510e-15 -6.61585924e-05] Minimization converged after 118 steps. Minimization converged after 116 steps. Minimization converged after 123 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 33 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 141 steps. Minimization converged after 140 steps. Minimization converged after 139 steps. Minimization converged after 140 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 8.23804919e-04 -2.70539855e-04 -5.14917522e-05] [ 6.65187489e-04 2.96437927e-04 -8.29763229e-05] [ 9.67261030e-04 8.09697470e-05 -1.22470949e-05] [ 1.29561236e-04 -8.13844541e-05 -4.65294271e-05] [ 7.17977314e-04 -2.49781918e-04 7.07896729e-05] [ 1.08832187e-03 1.83796935e-04 6.62458300e-05] [-8.37367006e-04 -4.44809003e-04 5.04238662e-04] [-2.61263643e-04 3.90492263e-04 4.35921119e-04] [ 1.24949030e-03 -1.63202138e-04 -2.34768388e-04] [-4.92103179e-05 1.30098211e-04 -2.12131980e-04] [-1.40975258e-05 1.63462728e-04 -1.73604084e-05] [-1.57574445e-03 -2.02093108e-04 -3.94540402e-05] [-4.18299596e-04 -4.37734320e-05 3.63992992e-04] [ 1.14170013e-03 5.26180835e-06 2.64632715e-04] [-1.11400936e-03 3.17137941e-04 2.22014696e-04] [ 1.57362283e-03 -3.45131583e-04 2.07090697e-04] [ 2.66373214e-04 -2.33805980e-05 7.83329545e-05] [-6.17847361e-04 2.63597318e-05 8.21948654e-05] [ 6.55290641e-04 -4.21975364e-05 -1.49160618e-04] [-3.03322802e-04 4.06468515e-05 -1.57219034e-04] [-4.42787737e-04 6.00242023e-05 1.72673185e-04] [-6.73290362e-04 -7.86938723e-05 1.47057184e-04] [-8.59914829e-04 4.23062398e-04 4.47966324e-05] [ 3.88662550e-04 -3.39057359e-04 5.67889009e-05] [-8.94587167e-05 5.19283235e-04 -7.74550953e-04] [ 4.47318019e-04 -3.99340066e-04 -5.49388264e-04] [-1.59820246e-04 -4.62769856e-04 -4.15365693e-04] [ 4.25165875e-05 4.22882444e-04 -2.91345974e-04] [ 8.55535592e-04 5.26308740e-05 2.74712420e-04] [-4.16591513e-04 -7.89325119e-06 2.75995960e-04] [ 1.56433227e-03 8.53530546e-06 -1.49629929e-04] [ 4.77226612e-04 2.29325895e-05 -2.06051514e-04] [-1.77906274e-04 -6.75191457e-05 -9.41895665e-06] [ 1.83788846e-04 8.35698905e-05 -1.73189371e-06] [-7.16902960e-04 -1.83590664e-05 -1.60956490e-04] [ 8.78554075e-04 -3.44015378e-04 1.43782766e-04] [ 4.50996725e-04 3.32091761e-04 2.25191366e-04] [-4.91686351e-04 4.57744139e-05 4.75459318e-04] [ 5.31619789e-04 4.50561058e-04 6.04682805e-04] [ 8.43865584e-05 -3.09459603e-04 -6.23745036e-04] [ 1.96352044e-04 4.41111319e-04 8.17581643e-04] [ 4.41546024e-04 -5.26386997e-04 -4.31726049e-04] [-1.05127963e-03 -5.10344034e-04 5.43880389e-04] [-6.79226536e-04 1.57572815e-03 -1.00643060e-03] [-6.35909159e-04 -1.35964570e-03 9.17542874e-04] [-1.05730644e-03 2.20424700e-04 -5.01272383e-04] [-4.21298641e-04 3.08340509e-04 -7.53965898e-04] [ 3.51502837e-04 -2.45066710e-04 -5.16985407e-04] [ 3.36616567e-04 1.94870369e-04 6.23893644e-04] [-3.67861293e-04 -2.55065576e-04 8.35296085e-04] [ 7.65098604e-04 1.89956501e-04 -2.63526880e-04] [-5.39050629e-04 1.23067015e-04 1.41402983e-04] [-6.31991996e-04 -1.79779817e-06 -4.41858462e-04] [ 9.78154130e-04 -2.82444003e-04 -5.20589831e-05] [ 2.78476990e-04 2.05272683e-04 2.49834298e-04] [ 4.20442005e-04 1.27693418e-03 -1.14214905e-03] [-3.95222144e-04 -1.19950184e-04 5.38564094e-04] [ 9.25516354e-04 -1.15459269e-03 -7.80646309e-04] [ 7.97716640e-04 5.05665212e-04 3.33019873e-04] [-7.32055968e-04 1.28841548e-03 -5.70360793e-04] [-7.37805935e-04 -1.51175578e-03 5.03323207e-04] [ 7.74039313e-04 -3.13473248e-04 -3.22336742e-04] [-5.78331095e-04 1.41948801e-03 5.15070964e-04] [ 3.90185882e-04 1.13172605e-04 -6.50234385e-04] [ 6.47257333e-04 -2.76705631e-04 2.98654675e-04] [-7.13326464e-04 -1.29826092e-03 -7.86975470e-04] [ 1.01507259e-03 2.85351476e-05 7.40311197e-04] [-9.72894042e-04 -5.28522044e-04 5.19984301e-04] [-9.56218945e-04 6.80582797e-04 -4.77585767e-04] [ 1.03427605e-03 -1.57653061e-04 -8.74924834e-04] [-2.95023067e-04 1.15714413e-03 6.36826892e-04] [-2.40787612e-04 -3.37831702e-04 -4.66697801e-04] [-6.13259655e-04 -2.72571531e-04 7.10241923e-04] [ 1.22978774e-04 -3.25126743e-04 -3.59352470e-04] [ 8.58687648e-04 3.24713921e-04 4.71404216e-04] [ 3.10784387e-04 -7.29036101e-04 3.62422700e-05] [ 3.06792275e-04 5.29228002e-04 1.73866697e-04] [ 9.05005390e-04 -1.44295217e-04 -3.45612427e-04] [ 3.69557153e-04 -3.54276340e-04 3.16793313e-04] [-8.46342251e-04 2.56136688e-04 1.67692208e-04] [ 1.46725444e-03 2.84754761e-05 -3.39510183e-06] [-1.68920748e-03 -3.88369049e-05 5.61172741e-06] [-3.92622183e-04 1.39933990e-04 -1.13051516e-04] [-3.40773102e-04 -1.45110101e-04 -1.21972731e-04] [ 1.44385846e-03 4.52338759e-04 -3.57135901e-04] [-8.88078786e-04 -4.89786746e-04 -3.99953770e-04] [-1.01442410e-03 1.37990067e-04 9.71600205e-06] [-4.08573801e-04 -1.76541275e-05 -1.52847091e-05] [-2.24362226e-03 -8.17958718e-05 -4.56081449e-06] [ 8.57822953e-04 3.71513884e-05 1.52416501e-05] [-4.36892766e-04 -7.07087963e-05 1.15911220e-04] [ 2.38419737e-04 7.97886451e-05 8.18780456e-05] [ 5.01732239e-04 -2.09582406e-04 1.38759959e-05] [-1.01642463e-03 1.58674263e-04 1.92211345e-06] [-3.96211087e-04 1.57368906e-03 -8.27921453e-04] [ 8.46768779e-04 -1.13517443e-04 -2.07677635e-04] [ 5.95542368e-04 -4.56997506e-04 -8.46606855e-05] [-2.00022238e-04 -1.10160840e-03 5.22305544e-04] [-1.06752385e-03 -1.55727241e-04 -4.78306152e-04] [-3.45845323e-04 1.37710617e-04 9.85087791e-04] [-6.77277010e-04 5.05050054e-04 -4.16735479e-04] [-5.58775392e-04 -6.66073273e-04 1.40130784e-03]] Final stress: [-7.11914644e-07 -1.97264228e-06 -8.90806876e-06 2.27361233e-08 1.81233294e-06 -1.17678476e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 3.21458293e-03 8.49701292e-04 -2.48200397e-04] [ 3.72363005e-03 -4.64659404e-04 1.18641360e-05] [ 3.46227937e-04 1.40782664e-04 -8.84038318e-04] [ 2.90839621e-03 -2.35381652e-04 -2.62952844e-04] [ 4.02755182e-03 -7.68491433e-04 1.79628731e-04] [ 2.73813630e-03 1.52589345e-03 8.82797248e-05] [-5.17905965e-04 -4.89529021e-04 9.13053346e-04] [-2.58371990e-03 1.41839030e-03 1.79166289e-03] [-2.34930878e-04 -2.09793376e-04 -5.48286458e-04] [ 4.30080806e-03 4.14212785e-04 -7.80632448e-04] [-5.13712114e-03 9.89195405e-04 -3.10099383e-04] [-4.87754445e-05 -4.90542332e-04 3.80343858e-05] [ 4.62707900e-03 1.29756954e-05 7.03530176e-04] [-3.68686436e-04 2.11319069e-04 9.49708656e-04] [ 5.52121427e-03 3.18834279e-04 7.64510102e-04] [-4.58370060e-03 -4.08130712e-04 8.06868126e-04] [-2.08957691e-03 -3.37624789e-04 1.95087445e-04] [ 4.66430925e-04 -7.43694517e-05 -1.65014808e-04] [-2.50475681e-03 -3.21241724e-05 -3.38513118e-04] [ 2.39770393e-03 3.88581599e-05 -3.67309454e-04] [-2.73208302e-03 2.40005323e-04 3.56367036e-04] [-1.10019157e-03 -7.84619049e-06 7.63811106e-05] [ 2.78273220e-05 1.53751794e-03 3.25761048e-04] [-4.34071343e-03 -1.71119890e-03 2.43440921e-04] [ 1.26723319e-03 9.41110849e-04 -1.40231627e-03] [ 4.62650551e-04 -1.64327436e-04 -1.27359858e-03] [ 9.13999647e-05 -1.22759518e-03 -9.22374670e-04] [-1.60184302e-04 1.18875394e-03 -1.38202418e-03] [-2.08775464e-03 5.17391523e-05 9.84315002e-04] [ 3.17217012e-03 -7.58223105e-04 9.44036893e-04] [ 2.64241432e-03 -4.88704198e-04 -9.28534360e-04] [ 5.60877726e-03 8.68759506e-05 -4.37745803e-04] [ 1.08356744e-03 -9.36525702e-04 -1.18159573e-05] [ 3.92895185e-04 5.23288722e-04 2.82703695e-05] [ 2.22578389e-04 -1.22864857e-03 1.45826812e-04] [-1.19000719e-03 7.91345167e-04 2.33274467e-03] [-2.60331266e-03 -5.58858554e-04 -1.15609972e-03] [ 4.50317443e-03 4.03018704e-04 9.75142460e-04] [ 1.03002908e-04 -1.31571064e-03 2.83127957e-03] [ 1.14991307e-03 2.47063741e-03 -9.43894328e-04] [ 1.48668377e-03 -2.41422832e-03 1.44801884e-03] [-2.16672932e-04 1.16786979e-03 -2.36814681e-03] [-2.78127262e-03 5.39087510e-03 3.47587615e-03] [-3.67850933e-03 -2.07327812e-04 -1.46354783e-03] [-4.31214926e-03 2.37748562e-03 3.31566317e-03] [-2.93618406e-03 -6.35888412e-03 -3.56261432e-03] [ 9.77968900e-04 -3.25893578e-04 3.48214045e-03] [-1.47769811e-03 4.77661436e-04 4.17863426e-03] [-1.30401046e-03 -9.60557846e-04 -3.60738887e-03] [ 3.97308231e-04 1.33653552e-03 -1.99803334e-03] [-2.73247185e-03 2.84417681e-04 -2.34081260e-03] [ 3.95895871e-03 1.73539759e-03 3.56050408e-04] [ 1.59963518e-03 -1.87506315e-03 -1.18783606e-03] [-2.18794486e-03 -7.18780765e-04 1.44491635e-03] [-2.22245947e-03 -7.90701941e-04 1.87764184e-03] [ 3.37056262e-03 3.36766258e-03 -2.61148506e-03] [ 1.30975245e-03 -2.57513548e-04 1.00103409e-03] [ 6.56954620e-04 -3.51109867e-03 -3.48232447e-03] [-2.12739373e-03 6.15242560e-03 1.80931262e-03] [ 3.08625428e-03 5.19683372e-04 -1.36756883e-03] [ 3.24518798e-03 -1.45454877e-03 1.26370164e-03] [-2.03387746e-03 -4.81482275e-03 -2.65807124e-03] [ 2.36549573e-03 1.24685172e-03 1.10574350e-03] [-2.67104293e-03 4.40837852e-03 -2.20738398e-03] [-1.98348514e-03 -5.24889990e-03 7.52567541e-04] [ 1.10762558e-03 -2.13118674e-04 -3.27183447e-03] [-3.43386741e-03 -2.98185041e-03 -1.91692997e-03] [ 2.98531158e-03 1.22134252e-03 -3.85905153e-03] [ 3.22127223e-03 -9.56956039e-04 3.40220732e-03] [-3.38119490e-03 2.55016797e-03 2.16924397e-03] [-2.68028192e-03 1.23062421e-03 2.86887393e-03] [ 1.48885085e-03 -1.40864093e-04 -1.77540073e-03] [-2.37364894e-04 -3.47013411e-03 2.69158269e-03] [-1.40715409e-03 8.17485154e-04 -2.24204175e-03] [ 7.76774239e-04 -2.28442869e-03 9.62750806e-04] [ 4.11374441e-03 4.10454925e-04 -2.13400395e-03] [ 3.41550296e-03 -8.02477160e-04 2.27016067e-03] [ 7.14639057e-04 2.86783810e-03 -1.28637689e-04] [-2.66936718e-03 -8.62415878e-04 8.00903589e-04] [ 1.18267113e-03 7.88429487e-04 1.63929297e-03] [-6.38956794e-03 2.78896679e-04 9.94661551e-05] [ 6.00109593e-03 -1.95951472e-04 2.60421686e-07] [-2.11550176e-03 5.14512844e-04 -4.92148477e-04] [-1.58835453e-03 -2.69609789e-04 -3.78629234e-04] [-2.06333393e-03 1.63484153e-03 -1.80875611e-03] [ 5.50879302e-03 -1.64887174e-03 -1.46017168e-03] [-8.12648631e-05 -2.92776391e-03 -7.00688096e-04] [-4.48880329e-03 8.90277860e-04 -1.84302280e-04] [ 3.29503586e-03 -1.98980726e-04 3.77160111e-07] [-8.41347401e-03 5.88555929e-04 -2.89712109e-04] [ 7.00732610e-04 -9.77872710e-06 1.84052879e-04] [-1.65920491e-03 -1.31004085e-05 4.26091524e-04] [-3.05706024e-03 -6.81915409e-04 9.30791578e-05] [ 2.80971167e-03 1.85787751e-04 3.23084679e-04] [ 2.02177698e-03 1.62306997e-03 -5.15255995e-04] [-1.30707091e-03 4.48621145e-03 1.99364817e-03] [-1.75615759e-03 -5.87198577e-03 -2.83820623e-03] [ 3.12800012e-03 5.92846095e-04 -4.35326842e-04] [-2.08297819e-03 -2.09533987e-03 -1.63958755e-03] [-1.49826892e-03 3.49267647e-03 4.41505180e-03] [-3.67241330e-03 -1.36775998e-04 -1.29779982e-03] [-9.94388346e-04 -1.84794898e-04 3.04992665e-03]] Final stress: [-1.57349002e-05 9.09976407e-06 -2.17896730e-05 9.95338725e-07 -3.29865007e-05 4.66570819e-05] Minimization converged after 147 steps. Minimization converged after 149 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 3.63939060e-04 2.66300740e-03 4.20212343e-04] [-3.63939057e-04 -2.66300739e-03 4.20212346e-04] [ 2.27517071e-03 1.45892555e-04 -3.72531462e-04] [-2.27517071e-03 -1.45892544e-04 -3.72531460e-04] [ 1.33113591e-03 -5.04234804e-04 4.02778273e-04] [-1.33113591e-03 5.04234805e-04 4.02778274e-04] [-8.37997205e-03 7.57763812e-04 -7.02454855e-04] [ 8.37997206e-03 -7.57763818e-04 -7.02454860e-04] [-3.41748307e-03 2.86778472e-04 4.20547109e-04] [ 3.41748307e-03 -2.86778462e-04 4.20547102e-04] [ 1.11479142e-03 3.16907375e-04 -2.44825491e-04] [-1.11479142e-03 -3.16907376e-04 -2.44825496e-04] [ 3.47915804e-04 3.90740484e-04 1.04879880e-04] [-3.47915807e-04 -3.90740478e-04 1.04879877e-04] [-8.20788023e-03 6.18680132e-04 1.56282006e-03] [ 8.20788022e-03 -6.18680140e-04 1.56282005e-03] [-2.75715556e-04 8.03192611e-05 -1.55337155e-04] [ 2.75715552e-04 -8.03192537e-05 -1.55337144e-04] [ 1.44242874e-03 -5.08554120e-04 3.75576237e-04] [-1.44242874e-03 5.08554119e-04 3.75576240e-04] [ 5.09645650e-03 1.62781084e-04 -5.60450831e-04] [-5.09645650e-03 -1.62781079e-04 -5.60450836e-04] [-3.07253704e-03 1.01035098e-03 2.04719465e-04] [ 3.07253704e-03 -1.01035098e-03 2.04719468e-04] [-1.30051017e-03 -1.61560737e-03 1.63766584e-03] [ 1.30051017e-03 1.61560736e-03 1.63766583e-03] [ 2.95202624e-04 -1.47314255e-03 -1.44879554e-03] [-2.95202626e-04 1.47314254e-03 -1.44879555e-03] [ 6.79492211e-03 6.01182489e-04 4.72965410e-04] [-6.79492210e-03 -6.01182493e-04 4.72965409e-04] [-1.63119657e-03 -4.83648939e-04 -1.39352054e-04] [ 1.63119656e-03 4.83648941e-04 -1.39352053e-04] [-1.49695021e-03 -1.15571750e-03 -2.26533421e-04] [ 1.49695021e-03 1.15571750e-03 -2.26533419e-04] [-3.19033908e-03 3.11269295e-03 -1.10077017e-03] [ 3.19033907e-03 -3.11269294e-03 -1.10077018e-03] [ 1.80457715e-03 3.44487057e-03 1.36670075e-03] [-1.80457715e-03 -3.44487058e-03 1.36670075e-03] [-1.34547355e-03 -1.51001068e-03 5.27097836e-03] [ 1.34547355e-03 1.51001068e-03 5.27097836e-03] [ 5.45180910e-04 -1.55680533e-03 -5.16701372e-03] [-5.45180915e-04 1.55680533e-03 -5.16701373e-03] [-2.32231933e-03 -4.43986726e-03 -2.94991252e-03] [ 2.32231933e-03 4.43986726e-03 -2.94991252e-03] [ 1.88045781e-03 -3.23650357e-03 3.27287172e-03] [-1.88045781e-03 3.23650357e-03 3.27287173e-03] [-7.70021872e-03 4.66659954e-03 1.71230913e-03] [ 7.70021872e-03 -4.66659954e-03 1.71230913e-03] [ 8.10108003e-03 3.33851457e-03 -5.65594471e-04] [-8.10108003e-03 -3.33851457e-03 -5.65594465e-04] [-2.04530499e-03 -3.10416698e-03 -2.49863256e-03] [ 2.04530499e-03 3.10416698e-03 -2.49863256e-03] [ 1.25322911e-03 -3.12419110e-03 2.34271333e-03] [-1.25322911e-03 3.12419110e-03 2.34271333e-03] [ 1.66695942e-03 -3.53076846e-03 1.15988535e-03] [-1.66695941e-03 3.53076846e-03 1.15988534e-03] [-3.44736238e-03 -3.24243300e-03 -6.92967529e-04] [ 3.44736237e-03 3.24243301e-03 -6.92967528e-04] [ 2.18516283e-03 -7.31799184e-04 -8.22569136e-04] [-2.18516283e-03 7.31799179e-04 -8.22569139e-04] [-2.31855780e-03 -1.41092851e-03 5.93926645e-04] [ 2.31855780e-03 1.41092851e-03 5.93926645e-04] [ 8.46664453e-04 -2.50564518e-03 8.72211911e-03] [-8.46664446e-04 2.50564518e-03 8.72211912e-03] [-1.23104950e-03 -3.47290618e-03 -1.03554528e-02] [ 1.23104951e-03 3.47290618e-03 -1.03554528e-02] [-1.52333636e-03 4.12751650e-04 2.25084758e-03] [ 1.52333636e-03 -4.12751653e-04 2.25084758e-03] [ 3.14378817e-03 1.02720771e-03 -7.38656292e-04] [-3.14378817e-03 -1.02720772e-03 -7.38656294e-04] [ 3.10967848e-03 2.71723175e-03 -1.93413543e-03] [-3.10967848e-03 -2.71723176e-03 -1.93413543e-03] [-3.97514633e-03 3.73914018e-03 9.27933716e-04] [ 3.97514634e-03 -3.73914018e-03 9.27933720e-04] [ 1.76103534e-03 -4.69763146e-04 -2.75746489e-03] [-1.76103534e-03 4.69763142e-04 -2.75746489e-03] [-6.79807750e-04 -1.02643539e-03 2.00163460e-03] [ 6.79807752e-04 1.02643539e-03 2.00163460e-03] [ 4.33149026e-03 9.47637330e-04 -9.10494620e-04] [-4.33149026e-03 -9.47637328e-04 -9.10494617e-04] [-4.29920348e-03 3.93519725e-05 8.46318166e-05] [ 4.29920348e-03 -3.93519694e-05 8.46318221e-05] [ 1.90825927e-03 4.97964413e-04 -7.64428940e-04] [-1.90825927e-03 -4.97964406e-04 -7.64428940e-04] [-3.10245274e-03 -1.74828825e-04 3.48729469e-04] [ 3.10245273e-03 1.74828818e-04 3.48729473e-04] [ 7.89485132e-03 -3.26269499e-03 -4.33183146e-04] [-7.89485133e-03 3.26269498e-03 -4.33183149e-04] [ 6.37018730e-03 1.83733668e-05 -3.23467641e-04] [-6.37018731e-03 -1.83733729e-05 -3.23467637e-04] [-2.84177059e-03 -5.36057328e-04 4.20471179e-04] [ 2.84177060e-03 5.36057334e-04 4.20471182e-04] [ 2.74937277e-03 2.34860472e-04 1.75855688e-04] [-2.74937278e-03 -2.34860471e-04 1.75855686e-04] [ 3.55942083e-03 -6.90889215e-04 -1.45562290e-03] [-3.55942084e-03 6.90889218e-04 -1.45562290e-03] [-2.77900069e-03 -1.51095198e-04 1.78046843e-03] [ 2.77900069e-03 1.51095195e-04 1.78046843e-03] [-3.17670417e-03 -3.48230067e-03 -2.13997354e-03] [ 3.17670418e-03 3.48230067e-03 -2.13997353e-03] [ 3.20226429e-03 -2.71522854e-03 1.42637966e-03] [-3.20226428e-03 2.71522854e-03 1.42637965e-03]] Final stress: [-1.83949260e-05 1.01578063e-05 -1.29216950e-05 1.62535377e-15 1.16882058e-15 -5.80164105e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-3.87114830e-04 -4.01521864e-03 -8.43116282e-04] [ 3.87114830e-04 4.01521864e-03 -8.43116283e-04] [-6.81490764e-04 5.18239765e-04 3.38518235e-04] [ 6.81490765e-04 -5.18239764e-04 3.38518235e-04] [-8.32670599e-04 -9.54046847e-05 -4.51929422e-05] [ 8.32670599e-04 9.54046865e-05 -4.51929408e-05] [ 2.04052840e-03 3.03483359e-04 -1.03306800e-03] [-2.04052840e-03 -3.03483358e-04 -1.03306800e-03] [ 7.34042982e-04 -6.98536918e-05 2.74863363e-04] [-7.34042982e-04 6.98536930e-05 2.74863361e-04] [-2.70909510e-04 3.06894243e-04 -4.31230816e-04] [ 2.70909510e-04 -3.06894242e-04 -4.31230815e-04] [-1.41072124e-04 9.31983477e-06 4.99130157e-05] [ 1.41072125e-04 -9.31983659e-06 4.99130159e-05] [ 1.60403871e-03 1.67188138e-03 8.76167117e-05] [-1.60403871e-03 -1.67188137e-03 8.76167113e-05] [-6.22650813e-05 -1.34459135e-04 1.33876592e-04] [ 6.22650816e-05 1.34459135e-04 1.33876592e-04] [ 6.17651018e-04 -4.73004009e-04 -1.87032628e-04] [-6.17651018e-04 4.73004008e-04 -1.87032626e-04] [-1.22880652e-03 -1.69801802e-05 1.79478246e-04] [ 1.22880652e-03 1.69801803e-05 1.79478245e-04] [ 8.53793263e-04 -2.09182601e-03 -5.71923546e-04] [-8.53793263e-04 2.09182599e-03 -5.71923544e-04] [ 4.37175620e-04 7.68482379e-05 -7.87643774e-04] [-4.37175621e-04 -7.68482350e-05 -7.87643769e-04] [ 4.44589133e-04 -6.08474610e-05 -7.10794018e-04] [-4.44589133e-04 6.08474697e-05 -7.10794018e-04] [-1.50348382e-03 2.86187689e-04 -1.10492025e-04] [ 1.50348382e-03 -2.86187690e-04 -1.10492026e-04] [ 3.01417440e-04 -9.03952379e-06 -3.22233688e-04] [-3.01417440e-04 9.03952274e-06 -3.22233689e-04] [ 1.00405312e-03 3.90397965e-04 3.84388761e-04] [-1.00405312e-03 -3.90397964e-04 3.84388761e-04] [ 7.14777131e-04 -9.09867287e-04 1.84265370e-04] [-7.14777130e-04 9.09867287e-04 1.84265369e-04] [-8.15918512e-04 -1.21171255e-03 1.29847195e-05] [ 8.15918512e-04 1.21171256e-03 1.29847202e-05] [-5.21577494e-05 -3.29946603e-04 -3.26459723e-04] [ 5.21577517e-05 3.29946601e-04 -3.26459723e-04] [ 9.42649419e-05 9.00360426e-04 2.03886412e-03] [-9.42649454e-05 -9.00360427e-04 2.03886412e-03] [ 5.52062877e-04 3.87840354e-04 1.17097177e-03] [-5.52062877e-04 -3.87840355e-04 1.17097177e-03] [-6.43001051e-04 1.00067720e-03 -1.13791409e-03] [ 6.43001051e-04 -1.00067720e-03 -1.13791409e-03] [ 1.88119056e-03 -1.52837049e-03 -1.80549680e-03] [-1.88119056e-03 1.52837049e-03 -1.80549680e-03] [-2.12149291e-03 -3.36854321e-04 7.87891991e-05] [ 2.12149291e-03 3.36854319e-04 7.87891995e-05] [ 1.95026042e-04 8.92697782e-04 8.03921492e-04] [-1.95026042e-04 -8.92697781e-04 8.03921492e-04] [-5.65378365e-04 7.46803656e-04 -1.04056356e-03] [ 5.65378366e-04 -7.46803657e-04 -1.04056356e-03] [-1.22479094e-03 1.02798394e-03 -3.95979731e-04] [ 1.22479094e-03 -1.02798394e-03 -3.95979732e-04] [ 5.20121728e-04 7.61933968e-04 3.79175447e-04] [-5.20121727e-04 -7.61933973e-04 3.79175446e-04] [-1.17486398e-03 -3.60672829e-04 -8.21055213e-07] [ 1.17486398e-03 3.60672829e-04 -8.21054726e-07] [ 9.53812200e-04 -4.19301485e-04 1.15027296e-05] [-9.53812200e-04 4.19301485e-04 1.15027300e-05] [-7.84981670e-04 -8.44688379e-04 -1.93601387e-03] [ 7.84981668e-04 8.44688381e-04 -1.93601387e-03] [ 3.80235503e-05 6.41887859e-04 3.10702312e-03] [-3.80235502e-05 -6.41887858e-04 3.10702312e-03] [ 1.38649253e-04 8.90752461e-07 -4.13207934e-05] [-1.38649252e-04 -8.90752721e-07 -4.13207946e-05] [ 1.23826266e-04 2.32741280e-04 -2.74287802e-06] [-1.23826269e-04 -2.32741281e-04 -2.74287592e-06] [-1.62894757e-03 -3.14242521e-04 7.03834304e-04] [ 1.62894757e-03 3.14242520e-04 7.03834305e-04] [ 7.58908819e-04 -1.30182318e-03 -7.15995731e-04] [-7.58908821e-04 1.30182317e-03 -7.15995733e-04] [ 4.39415494e-04 3.84930935e-05 5.91030377e-04] [-4.39415495e-04 -3.84930934e-05 5.91030376e-04] [ 2.44091107e-04 -2.07867122e-04 -1.10108521e-03] [-2.44091108e-04 2.07867123e-04 -1.10108521e-03] [-1.04557220e-03 -2.29750732e-04 1.21301171e-04] [ 1.04557220e-03 2.29750732e-04 1.21301169e-04] [ 1.36215844e-03 -1.32401237e-04 7.48781797e-05] [-1.36215844e-03 1.32401237e-04 7.48781795e-05] [-5.30625679e-04 1.75426706e-04 -2.79147305e-04] [ 5.30625681e-04 -1.75426707e-04 -2.79147304e-04] [ 5.46442034e-04 -1.88725655e-04 4.32321737e-04] [-5.46442035e-04 1.88725654e-04 4.32321737e-04] [-1.99058149e-03 2.81778648e-03 1.71203929e-04] [ 1.99058149e-03 -2.81778648e-03 1.71203929e-04] [-1.68631988e-03 -1.27956300e-04 6.35839228e-06] [ 1.68631988e-03 1.27956299e-04 6.35839361e-06] [ 1.65075953e-03 -3.10526558e-04 8.84893795e-05] [-1.65075952e-03 3.10526556e-04 8.84893809e-05] [-4.86606002e-04 1.86231814e-03 1.10519210e-04] [ 4.86606002e-04 -1.86231813e-03 1.10519209e-04] [-1.28247848e-03 1.15902870e-03 8.98755275e-04] [ 1.28247848e-03 -1.15902870e-03 8.98755275e-04] [ 7.43200012e-04 -2.48175030e-04 3.85056751e-04] [-7.43200012e-04 2.48175032e-04 3.85056751e-04] [ 1.25270162e-03 1.21640630e-03 9.50257257e-04] [-1.25270162e-03 -1.21640630e-03 9.50257253e-04] [-1.10552249e-03 9.44068715e-04 5.61096079e-05] [ 1.10552249e-03 -9.44068711e-04 5.61096113e-05]] Final stress: [-2.32019245e-06 -1.99468813e-06 -5.93432500e-06 1.32896573e-15 -1.37438003e-15 2.14876019e-05] Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 10 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. Minimization converged after 8 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 20 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 122 steps. Minimization converged after 119 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 1.38479218e-04 -2.30865377e-04 -1.62520688e-04] [-1.38479218e-04 2.30865380e-04 -1.62520689e-04] [ 2.18952465e-04 -1.26985586e-04 1.82658401e-04] [-2.18952465e-04 1.26985585e-04 1.82658402e-04] [ 1.11542459e-04 -1.95463567e-04 7.22153207e-05] [-1.11542459e-04 1.95463567e-04 7.22153212e-05] [-4.31540089e-04 -7.18031182e-05 1.54475213e-04] [ 4.31540088e-04 7.18031159e-05 1.54475212e-04] [-3.33362986e-05 -6.05454187e-04 1.41688156e-04] [ 3.33362985e-05 6.05454187e-04 1.41688156e-04] [ 6.46052423e-05 2.91110312e-04 3.32079248e-06] [-6.46052427e-05 -2.91110311e-04 3.32079205e-06] [-1.91246684e-04 -2.23664535e-04 -9.00676720e-05] [ 1.91246684e-04 2.23664536e-04 -9.00676714e-05] [-2.32319573e-04 -1.10165103e-04 -5.43731477e-04] [ 2.32319573e-04 1.10165102e-04 -5.43731477e-04] [-9.63161044e-05 -7.37713897e-05 9.33150418e-05] [ 9.63161042e-05 7.37713896e-05 9.33150412e-05] [ 2.55234507e-05 3.44780426e-04 -7.64363237e-05] [-2.55234508e-05 -3.44780426e-04 -7.64363234e-05] [ 5.62574626e-04 4.68361672e-04 -2.77243632e-04] [-5.62574627e-04 -4.68361671e-04 -2.77243633e-04] [-5.74999222e-04 -2.50283890e-04 7.86148792e-05] [ 5.74999222e-04 2.50283889e-04 7.86148791e-05] [ 2.28311577e-04 -4.79867001e-05 8.19957039e-05] [-2.28311578e-04 4.79867024e-05 8.19957065e-05] [ 6.85733987e-06 8.66925677e-05 4.66442824e-04] [-6.85734073e-06 -8.66925684e-05 4.66442825e-04] [ 2.13504745e-04 -4.59560143e-04 2.73627330e-04] [-2.13504745e-04 4.59560142e-04 2.73627330e-04] [-5.55523923e-05 4.14816031e-04 -2.78723095e-04] [ 5.55523906e-05 -4.14816032e-04 -2.78723096e-04] [-4.40768935e-04 1.47929719e-04 2.21575138e-06] [ 4.40768936e-04 -1.47929719e-04 2.21575164e-06] [ 1.37490941e-05 3.72210057e-05 -3.26649731e-04] [-1.37490937e-05 -3.72210060e-05 -3.26649729e-04] [ 1.75584948e-04 2.47586461e-04 4.40134859e-05] [-1.75584948e-04 -2.47586461e-04 4.40134854e-05] [-1.59366906e-04 -2.24127657e-04 2.45556019e-04] [ 1.59366906e-04 2.24127657e-04 2.45556019e-04] [ 1.78535459e-04 1.80455324e-04 -2.54446667e-04] [-1.78535457e-04 -1.80455323e-04 -2.54446668e-04] [ 1.30646065e-04 -1.52989513e-04 -3.36741155e-04] [-1.30646066e-04 1.52989512e-04 -3.36741155e-04] [ 3.90562993e-04 -5.46824313e-04 3.00947927e-04] [-3.90562992e-04 5.46824312e-04 3.00947927e-04] [-9.10301909e-05 1.21497207e-04 2.77048352e-04] [ 9.10301914e-05 -1.21497206e-04 2.77048352e-04] [ 2.37326867e-04 2.83646930e-04 -2.84741633e-04] [-2.37326867e-04 -2.83646930e-04 -2.84741633e-04] [ 1.31073520e-04 -8.25276585e-06 1.00709997e-04] [-1.31073520e-04 8.25276584e-06 1.00709997e-04] [-1.28425562e-04 -1.20146580e-04 3.02770452e-04] [ 1.28425562e-04 1.20146581e-04 3.02770453e-04] [ 7.60107649e-04 2.33011993e-04 -1.23762072e-04] [-7.60107648e-04 -2.33011991e-04 -1.23762072e-04] [-1.76199639e-05 1.10627439e-04 -6.24653194e-04] [ 1.76199664e-05 -1.10627440e-04 -6.24653194e-04] [ 5.20917308e-04 -5.72832699e-05 3.56184138e-05] [-5.20917307e-04 5.72832709e-05 3.56184130e-05] [ 5.97340454e-06 2.26626710e-04 1.45069853e-04] [-5.97340493e-06 -2.26626710e-04 1.45069853e-04] [ 5.90737145e-05 7.70154699e-05 7.57278609e-04] [-5.90737153e-05 -7.70154697e-05 7.57278608e-04] [-1.67399625e-04 1.12472170e-04 -6.09940336e-04] [ 1.67399625e-04 -1.12472169e-04 -6.09940337e-04] [ 7.18142966e-06 1.52320011e-04 1.17394935e-04] [-7.18142920e-06 -1.52320011e-04 1.17394935e-04] [ 1.78820139e-04 -3.28590704e-05 -3.13770772e-04] [-1.78820138e-04 3.28590705e-05 -3.13770773e-04] [ 1.32220505e-03 -7.39456401e-05 1.24093330e-04] [-1.32220505e-03 7.39456405e-05 1.24093330e-04] [-6.25703320e-04 -5.01115979e-04 6.06117435e-04] [ 6.25703319e-04 5.01115979e-04 6.06117435e-04] [ 2.06961690e-04 5.72865250e-05 -2.42346751e-04] [-2.06961690e-04 -5.72865253e-05 -2.42346752e-04] [-2.39657838e-04 -4.90442724e-05 2.85126067e-04] [ 2.39657838e-04 4.90442728e-05 2.85126067e-04] [-3.31132880e-05 -1.87236461e-04 7.12684003e-05] [ 3.31132882e-05 1.87236458e-04 7.12683981e-05] [-1.41243697e-04 -3.54614000e-05 -5.80425937e-05] [ 1.41243697e-04 3.54614002e-05 -5.80425931e-05] [-5.07964082e-05 -2.57620785e-04 1.75279721e-04] [ 5.07964085e-05 2.57620784e-04 1.75279720e-04] [-4.38450056e-04 1.95153528e-04 -9.22364193e-05] [ 4.38450056e-04 -1.95153526e-04 -9.22364183e-05] [ 1.52437410e-04 1.54443319e-04 6.91329339e-05] [-1.52437409e-04 -1.54443321e-04 6.91329341e-05] [ 2.72279075e-04 2.13982566e-05 5.49105255e-05] [-2.72279076e-04 -2.13982562e-05 5.49105254e-05] [-5.00800964e-04 2.28876572e-04 -1.41544351e-04] [ 5.00800963e-04 -2.28876572e-04 -1.41544352e-04] [ 2.53882318e-04 6.02332603e-05 -1.13703072e-04] [-2.53882318e-04 -6.02332616e-05 -1.13703074e-04] [-7.08605869e-05 3.15915804e-05 1.42832614e-04] [ 7.08605868e-05 -3.15915797e-05 1.42832615e-04] [-3.76333102e-04 -5.51664509e-04 1.61155622e-04] [ 3.76333102e-04 5.51664509e-04 1.61155621e-04] [-4.13239229e-04 8.61238547e-06 -3.82262962e-04] [ 4.13239229e-04 -8.61238593e-06 -3.82262963e-04] [ 1.88055258e-04 1.08374237e-04 -2.33329508e-04] [-1.88055257e-04 -1.08374236e-04 -2.33329508e-04]] Final stress: [-2.22621127e-05 -1.42836012e-05 -2.10094514e-05 1.87039549e-15 -9.10697357e-16 -9.08539021e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-8.94250300e-04 -1.09034419e-03 -1.00746442e-03] [ 8.94250307e-04 1.09034420e-03 -1.00746441e-03] [-1.30586441e-03 -6.25613882e-04 8.88302451e-04] [ 1.30586442e-03 6.25613880e-04 8.88302442e-04] [-8.62463046e-04 -1.46849163e-03 2.25722068e-04] [ 8.62463046e-04 1.46849163e-03 2.25722068e-04] [ 2.76863681e-03 -4.48855428e-04 7.80943942e-04] [-2.76863681e-03 4.48855450e-04 7.80943952e-04] [ 2.43052024e-04 -3.99325870e-03 9.35750777e-04] [-2.43052021e-04 3.99325869e-03 9.35750774e-04] [-1.73347054e-04 1.89949582e-03 1.64794893e-04] [ 1.73347055e-04 -1.89949583e-03 1.64794890e-04] [ 1.10180371e-03 -1.55870654e-03 -7.81177401e-04] [-1.10180372e-03 1.55870654e-03 -7.81177422e-04] [ 1.46764705e-03 -8.76473290e-04 -3.95061819e-03] [-1.46764706e-03 8.76473279e-04 -3.95061819e-03] [ 8.71453510e-04 -6.61942030e-04 6.06234022e-04] [-8.71453515e-04 6.61942018e-04 6.06234013e-04] [-4.12028667e-04 2.34365536e-03 -3.69458426e-04] [ 4.12028667e-04 -2.34365535e-03 -3.69458433e-04] [-3.83749168e-03 3.09739866e-03 -1.93969037e-03] [ 3.83749168e-03 -3.09739866e-03 -1.93969035e-03] [ 3.65048374e-03 -2.10119564e-03 2.07107570e-04] [-3.65048375e-03 2.10119566e-03 2.07107568e-04] [-1.57323373e-03 -4.26524531e-04 9.86420497e-04] [ 1.57323372e-03 4.26524555e-04 9.86420516e-04] [-1.27701466e-04 7.34676833e-04 3.36279586e-03] [ 1.27701464e-04 -7.34676854e-04 3.36279586e-03] [-1.62956350e-03 -3.00354776e-03 1.68161106e-03] [ 1.62956350e-03 3.00354776e-03 1.68161106e-03] [ 5.77794302e-04 2.78349391e-03 -1.88489323e-03] [-5.77794304e-04 -2.78349391e-03 -1.88489324e-03] [ 2.73043603e-03 6.43300394e-04 4.49664866e-05] [-2.73043603e-03 -6.43300390e-04 4.49664832e-05] [ 9.10209164e-04 -2.03409086e-03 2.80177265e-04] [-9.10209157e-04 2.03409086e-03 2.80177274e-04] [-2.14280048e-04 -2.87646729e-04 -2.31020526e-03] [ 2.14280046e-04 2.87646731e-04 -2.31020526e-03] [ 1.13349448e-03 -1.41339914e-03 -1.46364402e-03] [-1.13349449e-03 1.41339914e-03 -1.46364401e-03] [-9.51041030e-04 1.42262512e-03 1.63877944e-03] [ 9.51041017e-04 -1.42262512e-03 1.63877945e-03] [ 2.57401797e-03 3.71026514e-03 1.97360838e-03] [-2.57401798e-03 -3.71026514e-03 1.97360837e-03] [ 8.31313185e-04 1.39080612e-03 -1.91313955e-03] [-8.31313185e-04 -1.39080612e-03 -1.91313956e-03] [ 1.79676847e-03 -1.76266529e-03 -1.43514392e-03] [-1.79676848e-03 1.76266530e-03 -1.43514392e-03] [-4.41176297e-04 -8.47452997e-04 1.64760903e-03] [ 4.41176286e-04 8.47452997e-04 1.64760902e-03] [-9.19493288e-04 7.70842751e-04 2.06366607e-03] [ 9.19493286e-04 -7.70842751e-04 2.06366608e-03] [ 6.04698067e-04 -2.78783739e-04 7.92185561e-04] [-6.04698073e-04 2.78783743e-04 7.92185558e-04] [-2.30682768e-04 -6.29731496e-04 -4.23501700e-03] [ 2.30682790e-04 6.29731511e-04 -4.23501701e-03] [ 5.12591605e-03 -1.63060414e-03 -6.77354080e-04] [-5.12591606e-03 1.63060416e-03 -6.77354075e-04] [ 2.48582032e-04 -1.19458204e-03 8.63175883e-04] [-2.48582033e-04 1.19458204e-03 8.63175877e-04] [ 3.37702548e-03 7.32943020e-04 3.72261756e-04] [-3.37702548e-03 -7.32943018e-04 3.72261762e-04] [-9.23916870e-04 -6.11340823e-04 -4.09216695e-03] [ 9.23916868e-04 6.11340814e-04 -4.09216696e-03] [ 2.62852493e-04 -4.33038594e-04 4.79271179e-03] [-2.62852492e-04 4.33038590e-04 4.79271179e-03] [ 1.43825899e-03 -1.00258522e-04 -2.40163473e-03] [-1.43825900e-03 1.00258525e-04 -2.40163472e-03] [ 1.22231238e-04 -1.22689783e-03 1.06444495e-03] [-1.22231238e-04 1.22689784e-03 1.06444494e-03] [-4.52232881e-03 3.57632301e-03 4.05172746e-03] [ 4.52232880e-03 -3.57632300e-03 4.05172745e-03] [ 8.80183156e-03 5.79118097e-04 8.53738132e-04] [-8.80183154e-03 -5.79118088e-04 8.53738135e-04] [-1.56198253e-03 3.15358777e-04 1.58402522e-03] [ 1.56198253e-03 -3.15358776e-04 1.58402523e-03] [ 1.61696329e-03 -4.76574849e-04 -1.39112734e-03] [-1.61696329e-03 4.76574848e-04 -1.39112735e-03] [ 5.74251484e-04 -9.89265702e-04 5.71196684e-04] [-5.74251485e-04 9.89265687e-04 5.71196675e-04] [ 7.18604369e-04 6.56565487e-05 -4.52909999e-04] [-7.18604366e-04 -6.56565490e-05 -4.52909998e-04] [ 1.50933831e-04 -1.75763248e-03 1.12670073e-03] [-1.50933833e-04 1.75763248e-03 1.12670073e-03] [ 2.96405907e-03 1.28008472e-03 -6.17117723e-04] [-2.96405908e-03 -1.28008473e-03 -6.17117733e-04] [-6.85657627e-04 5.65454546e-06 4.55514150e-04] [ 6.85657638e-04 -5.65454407e-06 4.55514160e-04] [-1.57850322e-03 -2.22989152e-04 3.95866193e-04] [ 1.57850322e-03 2.22989154e-04 3.95866192e-04] [ 3.37101628e-03 1.61579765e-03 -7.74427361e-04] [-3.37101628e-03 -1.61579765e-03 -7.74427367e-04] [-1.91669504e-03 1.06900162e-03 -8.02449906e-04] [ 1.91669506e-03 -1.06900164e-03 -8.02449909e-04] [-2.43208105e-03 3.69192839e-03 1.08290304e-03] [ 2.43208106e-03 -3.69192840e-03 1.08290303e-03] [-4.99559709e-04 -4.65419411e-04 1.02645320e-03] [ 4.99559703e-04 4.65419403e-04 1.02645321e-03] [ 1.18807888e-03 -9.17746793e-04 -1.62213656e-03] [-1.18807889e-03 9.17746787e-04 -1.62213658e-03] [-2.62756028e-03 -3.11781092e-04 -2.39961810e-03] [ 2.62756029e-03 3.11781082e-04 -2.39961809e-03]] Final stress: [-3.12292833e-05 -5.82017005e-06 -6.54234572e-05 -1.25872238e-14 -5.06739737e-16 6.07840351e-05] Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 18 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 2.24121816e-04 -4.42516179e-04 -3.99953080e-04] [-2.24121814e-04 4.42516176e-04 -3.99953081e-04] [ 5.79363183e-04 -8.00624213e-04 1.41471704e-04] [-5.79363184e-04 8.00624214e-04 1.41471704e-04] [ 2.74285115e-04 2.46584355e-04 5.19706061e-04] [-2.74285116e-04 -2.46584355e-04 5.19706059e-04] [-1.04461514e-03 1.17203769e-03 1.92506858e-04] [ 1.04461514e-03 -1.17203770e-03 1.92506854e-04] [-6.93233439e-05 -4.36861899e-04 5.83495771e-04] [ 6.93233460e-05 4.36861893e-04 5.83495774e-04] [-1.01598029e-05 1.19776681e-04 -9.81768131e-04] [ 1.01598033e-05 -1.19776681e-04 -9.81768134e-04] [-6.57701679e-04 6.11160958e-05 6.18196507e-04] [ 6.57701679e-04 -6.11160969e-05 6.18196508e-04] [-1.00234770e-03 5.12051482e-04 2.26591031e-03] [ 1.00234770e-03 -5.12051475e-04 2.26591030e-03] [-5.44208577e-04 -9.33477745e-04 9.40714657e-04] [ 5.44208578e-04 9.33477745e-04 9.40714654e-04] [ 6.48882752e-04 -1.70619638e-04 -7.33212639e-04] [-6.48882754e-04 1.70619638e-04 -7.33212634e-04] [ 1.80911987e-03 5.25965462e-04 -4.41160094e-04] [-1.80911987e-03 -5.25965463e-04 -4.41160095e-04] [-1.44889126e-03 -8.28237334e-04 -2.51380936e-04] [ 1.44889126e-03 8.28237340e-04 -2.51380935e-04] [ 7.29807425e-04 -1.35465467e-03 8.23508506e-04] [-7.29807423e-04 1.35465468e-03 8.23508513e-04] [ 1.53349018e-04 -2.37855886e-04 -2.50239065e-03] [-1.53349018e-04 2.37855884e-04 -2.50239065e-03] [ 8.45278588e-04 -2.50134442e-04 1.18289437e-03] [-8.45278587e-04 2.50134443e-04 1.18289437e-03] [-1.78091008e-04 -7.26676056e-04 -7.18115249e-04] [ 1.78091005e-04 7.26676059e-04 -7.18115249e-04] [-9.70789863e-04 7.98420754e-04 -1.12209191e-04] [ 9.70789863e-04 -7.98420751e-04 -1.12209190e-04] [-2.10694078e-04 5.58931694e-04 -3.51610449e-04] [ 2.10694075e-04 -5.58931694e-04 -3.51610449e-04] [ 5.51385617e-04 4.25507771e-04 3.71417551e-04] [-5.51385616e-04 -4.25507771e-04 3.71417549e-04] [-6.63696002e-04 4.35086494e-05 4.74755161e-04] [ 6.63696004e-04 -4.35086494e-05 4.74755165e-04] [ 6.28528468e-04 4.80820711e-04 -7.16835066e-04] [-6.28528467e-04 -4.80820710e-04 -7.16835069e-04] [ 6.43296768e-05 -1.69460676e-03 -9.52280240e-04] [-6.43296742e-05 1.69460677e-03 -9.52280239e-04] [ 6.88802583e-04 -4.18667609e-04 8.67382613e-04] [-6.88802585e-04 4.18667609e-04 8.67382614e-04] [-5.09384438e-04 -6.49534159e-05 5.53054705e-04] [ 5.09384433e-04 6.49534166e-05 5.53054703e-04] [ 4.03860821e-04 1.04651712e-03 -7.05671398e-05] [-4.03860820e-04 -1.04651712e-03 -7.05671387e-05] [ 4.70239348e-04 2.06837643e-04 6.80690997e-05] [-4.70239348e-04 -2.06837641e-04 6.80690980e-05] [-7.34025096e-04 -4.97505576e-04 -1.14105818e-04] [ 7.34025097e-04 4.97505576e-04 -1.14105818e-04] [ 1.39797543e-03 9.57753367e-04 9.98223597e-04] [-1.39797544e-03 -9.57753373e-04 9.98223601e-04] [-1.37766556e-03 -4.40059097e-05 -5.53207528e-04] [ 1.37766555e-03 4.40059075e-05 -5.53207527e-04] [ 8.37313014e-04 -2.98837477e-04 -9.97369119e-05] [-8.37313016e-04 2.98837477e-04 -9.97369110e-05] [-5.33790051e-04 3.51658890e-04 6.51920233e-04] [ 5.33790052e-04 -3.51658890e-04 6.51920234e-04] [-5.98092420e-05 4.56360900e-04 2.35921755e-03] [ 5.98092416e-05 -4.56360903e-04 2.35921755e-03] [-8.50375720e-04 3.06521989e-04 -1.05926009e-03] [ 8.50375724e-04 -3.06521993e-04 -1.05926009e-03] [ 3.07357125e-04 1.01231535e-03 1.37404405e-03] [-3.07357126e-04 -1.01231535e-03 1.37404405e-03] [ 1.26411074e-03 -2.94565080e-05 -6.64972670e-04] [-1.26411074e-03 2.94565062e-05 -6.64972671e-04] [ 2.92569842e-03 -1.32173367e-03 -1.05647421e-03] [-2.92569841e-03 1.32173366e-03 -1.05647420e-03] [-2.49414312e-03 -5.44213256e-04 2.51774608e-04] [ 2.49414313e-03 5.44213256e-04 2.51774606e-04] [ 1.16368133e-03 6.50366260e-04 -1.58954409e-03] [-1.16368133e-03 -6.50366260e-04 -1.58954409e-03] [-7.69197449e-04 -4.84064388e-04 -6.24729628e-04] [ 7.69197452e-04 4.84064387e-04 -6.24729628e-04] [-2.71510673e-04 7.78578333e-04 -3.92143973e-04] [ 2.71510671e-04 -7.78578337e-04 -3.92143977e-04] [ 1.16271507e-04 1.91260519e-03 2.69053806e-04] [-1.16271507e-04 -1.91260519e-03 2.69053808e-04] [ 6.95338840e-05 6.53586027e-04 -1.09419944e-04] [-6.95338852e-05 -6.53586024e-04 -1.09419942e-04] [-1.19949760e-03 2.00555673e-05 -1.89908791e-04] [ 1.19949761e-03 -2.00555594e-05 -1.89908786e-04] [ 2.67955092e-04 1.61909378e-04 -4.16568398e-05] [-2.67955094e-04 -1.61909373e-04 -4.16568383e-05] [ 3.65298999e-04 -1.47341230e-03 1.86909450e-04] [-3.65299000e-04 1.47341230e-03 1.86909448e-04] [-1.29544636e-03 5.80895891e-04 -4.81224809e-04] [ 1.29544636e-03 -5.80895893e-04 -4.81224809e-04] [ 8.20650575e-04 3.03284282e-04 5.25073368e-05] [-8.20650579e-04 -3.03284290e-04 5.25073370e-05] [ 4.84544474e-04 2.33304160e-04 -2.59368110e-04] [-4.84544477e-04 -2.33304158e-04 -2.59368107e-04] [-3.15128154e-05 -1.30330345e-03 -3.91922510e-05] [ 3.15128164e-05 1.30330345e-03 -3.91922544e-05] [-3.42687881e-04 3.54242103e-04 -3.16140588e-04] [ 3.42687881e-04 -3.54242101e-04 -3.16140588e-04] [ 1.08529164e-03 5.27857615e-04 7.58346040e-05] [-1.08529164e-03 -5.27857616e-04 7.58346062e-05]] Final stress: [ 5.75287767e-06 1.72707257e-05 -2.15494038e-05 9.41488150e-15 8.26998984e-16 -2.52741222e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-2.23369382e-04 -4.44538553e-04 -3.99436679e-04] [ 2.23369382e-04 4.44538554e-04 -3.99436677e-04] [-5.77494009e-04 -7.97387676e-04 1.41229550e-04] [ 5.77494010e-04 7.97387675e-04 1.41229551e-04] [-2.73717398e-04 2.45904538e-04 5.17470510e-04] [ 2.73717397e-04 -2.45904536e-04 5.17470511e-04] [ 1.04104349e-03 1.16867707e-03 1.89944504e-04] [-1.04104349e-03 -1.16867707e-03 1.89944505e-04] [ 6.86681886e-05 -4.35708135e-04 5.81578446e-04] [-6.86681888e-05 4.35708133e-04 5.81578444e-04] [ 1.05672661e-05 1.19726904e-04 -9.78478986e-04] [-1.05672661e-05 -1.19726902e-04 -9.78478988e-04] [ 6.55728356e-04 6.02147219e-05 6.15861042e-04] [-6.55728357e-04 -6.02147190e-05 6.15861044e-04] [ 9.98977241e-04 5.12366960e-04 2.25632007e-03] [-9.98977243e-04 -5.12366966e-04 2.25632007e-03] [ 5.42453428e-04 -9.30401192e-04 9.37384206e-04] [-5.42453429e-04 9.30401191e-04 9.37384205e-04] [-6.46109028e-04 -1.69512154e-04 -7.30787390e-04] [ 6.46109029e-04 1.69512153e-04 -7.30787384e-04] [-1.80316188e-03 5.24598767e-04 -4.39107972e-04] [ 1.80316188e-03 -5.24598761e-04 -4.39107973e-04] [ 1.44422780e-03 -8.28579574e-04 -2.51275076e-04] [-1.44422780e-03 8.28579572e-04 -2.51275077e-04] [-7.27234272e-04 -1.34987302e-03 8.20790934e-04] [ 7.27234270e-04 1.34987302e-03 8.20790938e-04] [-1.52940992e-04 -2.37411078e-04 -2.49269586e-03] [ 1.52940990e-04 2.37411076e-04 -2.49269586e-03] [-8.42227244e-04 -2.49275329e-04 1.17881131e-03] [ 8.42227243e-04 2.49275328e-04 1.17881131e-03] [ 1.77414243e-04 -7.24207910e-04 -7.15814604e-04] [-1.77414243e-04 7.24207911e-04 -7.15814607e-04] [ 9.67921486e-04 7.96033434e-04 -1.11063866e-04] [-9.67921487e-04 -7.96033432e-04 -1.11063862e-04] [ 5.50157301e-04 -4.23892152e-04 3.69961113e-04] [-5.50157299e-04 4.23892150e-04 3.69961114e-04] [-2.09739310e-04 -5.57074848e-04 -3.50738281e-04] [ 2.09739311e-04 5.57074848e-04 -3.50738280e-04] [ 6.26908840e-04 -4.80587144e-04 -7.13157263e-04] [-6.26908837e-04 4.80587144e-04 -7.13157260e-04] [-6.62178496e-04 -4.27110436e-05 4.74501000e-04] [ 6.62178494e-04 4.27110448e-05 4.74501001e-04] [ 6.86604840e-04 4.17183749e-04 8.64543849e-04] [-6.86604840e-04 -4.17183751e-04 8.64543849e-04] [ 6.42010286e-05 1.68916670e-03 -9.49486573e-04] [-6.42010289e-05 -1.68916670e-03 -9.49486573e-04] [ 4.02550121e-04 -1.04397705e-03 -7.21793604e-05] [-4.02550123e-04 1.04397705e-03 -7.21793635e-05] [-5.07352118e-04 6.55010699e-05 5.50936374e-04] [ 5.07352118e-04 -6.55010693e-05 5.50936372e-04] [-7.31778621e-04 4.96347815e-04 -1.13249281e-04] [ 7.31778625e-04 -4.96347815e-04 -1.13249282e-04] [ 4.69310952e-04 -2.06145452e-04 6.80568412e-05] [-4.69310953e-04 2.06145450e-04 6.80568413e-05] [-1.37339616e-03 4.30008484e-05 -5.52213022e-04] [ 1.37339616e-03 -4.30008501e-05 -5.52213019e-04] [ 1.39536299e-03 -9.54685312e-04 9.95116540e-04] [-1.39536298e-03 9.54685311e-04 9.95116539e-04] [-5.32522408e-04 -3.51143552e-04 6.49847284e-04] [ 5.32522409e-04 3.51143551e-04 6.49847281e-04] [ 8.34642971e-04 2.97807651e-04 -9.91656544e-05] [-8.34642973e-04 -2.97807651e-04 -9.91656526e-05] [-8.48528372e-04 -3.06664597e-04 -1.05566097e-03] [ 8.48528374e-04 3.06664599e-04 -1.05566097e-03] [-5.95490288e-05 -4.55258247e-04 2.35223771e-03] [ 5.95490260e-05 4.55258250e-04 2.35223770e-03] [ 1.25923067e-03 2.97795882e-05 -6.63020127e-04] [-1.25923067e-03 -2.97795870e-05 -6.63020128e-04] [ 3.07125930e-04 -1.00811512e-03 1.36881322e-03] [-3.07125931e-04 1.00811512e-03 1.36881322e-03] [-2.48558409e-03 5.43410136e-04 2.51426135e-04] [ 2.48558410e-03 -5.43410141e-04 2.51426137e-04] [ 2.91619010e-03 1.31685852e-03 -1.05256220e-03] [-2.91619010e-03 -1.31685852e-03 -1.05256220e-03] [-7.66171834e-04 4.82882835e-04 -6.22444005e-04] [ 7.66171836e-04 -4.82882836e-04 -6.22444004e-04] [ 1.15948205e-03 -6.48304463e-04 -1.58476868e-03] [-1.15948205e-03 6.48304463e-04 -1.58476868e-03] [ 2.70451823e-04 7.75477388e-04 -3.90338160e-04] [-2.70451825e-04 -7.75477388e-04 -3.90338157e-04] [-1.15779426e-04 1.90606390e-03 2.68317477e-04] [ 1.15779425e-04 -1.90606390e-03 2.68317480e-04] [-6.88686096e-05 6.51401814e-04 -1.08723886e-04] [ 6.88686087e-05 -6.51401814e-04 -1.08723886e-04] [ 1.19649658e-03 1.98672272e-05 -1.88896841e-04] [-1.19649658e-03 -1.98672259e-05 -1.88896840e-04] [-2.66657160e-04 1.63663864e-04 -4.12289275e-05] [ 2.66657162e-04 -1.63663868e-04 -4.12289289e-05] [-3.64100027e-04 -1.46861908e-03 1.86291757e-04] [ 3.64100027e-04 1.46861908e-03 1.86291753e-04] [ 1.29142031e-03 5.78636177e-04 -4.80004090e-04] [-1.29142031e-03 -5.78636176e-04 -4.80004092e-04] [-8.18510536e-04 3.05119835e-04 5.21933704e-05] [ 8.18510539e-04 -3.05119833e-04 5.21933693e-05] [-3.16097474e-05 1.30012227e-03 -3.83420855e-05] [ 3.16097462e-05 -1.30012227e-03 -3.83420840e-05] [ 4.82736445e-04 -2.32713244e-04 -2.57383471e-04] [-4.82736445e-04 2.32713245e-04 -2.57383472e-04] [ 1.08177720e-03 -5.25800871e-04 7.58166315e-05] [-1.08177720e-03 5.25800874e-04 7.58166294e-05] [-3.41651509e-04 -3.53423636e-04 -3.15226568e-04] [ 3.41651510e-04 3.53423636e-04 -3.15226568e-04]] Final stress: [ 5.77601134e-06 1.72761374e-05 -2.14585291e-05 -1.77231141e-15 -2.06032695e-15 2.51974015e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.19629670e-04 -1.89161367e-04 5.53969247e-05] [-1.19629669e-04 1.89161371e-04 5.53969239e-05] [ 2.27089236e-04 2.67197143e-04 3.64336265e-05] [-2.27089236e-04 -2.67197143e-04 3.64336253e-05] [ 4.46698649e-05 -2.38583263e-04 -1.56347769e-04] [-4.46698647e-05 2.38583264e-04 -1.56347769e-04] [-3.81119490e-04 -2.64173656e-04 -2.46001477e-04] [ 3.81119490e-04 2.64173659e-04 -2.46001476e-04] [-2.54977123e-05 1.70463796e-04 -1.09722721e-04] [ 2.54977122e-05 -1.70463797e-04 -1.09722721e-04] [ 8.51476106e-05 4.42855144e-05 2.11669849e-04] [-8.51476112e-05 -4.42855142e-05 2.11669850e-04] [-3.04758233e-04 1.37740186e-05 -3.22946966e-04] [ 3.04758232e-04 -1.37740192e-05 -3.22946967e-04] [-3.21972692e-04 1.68549974e-04 -7.10579080e-04] [ 3.21972692e-04 -1.68549976e-04 -7.10579080e-04] [-3.85115494e-06 3.29011815e-04 -3.15319382e-04] [ 3.85115525e-06 -3.29011816e-04 -3.15319383e-04] [ 8.25059311e-05 -1.59094729e-04 3.18989867e-04] [-8.25059309e-05 1.59094729e-04 3.18989866e-04] [ 5.58812717e-04 -2.18741904e-04 5.23176484e-05] [-5.58812717e-04 2.18741904e-04 5.23176478e-05] [-5.19691910e-04 -5.03885247e-06 3.83697872e-05] [ 5.19691910e-04 5.03884628e-06 3.83697892e-05] [ 2.00941161e-04 2.51452201e-04 -2.15660839e-04] [-2.00941162e-04 -2.51452198e-04 -2.15660835e-04] [-5.66328237e-05 -7.60662768e-05 7.56199384e-04] [ 5.66328227e-05 7.60662774e-05 7.56199387e-04] [ 2.11222508e-04 1.44251760e-04 -1.36151536e-04] [-2.11222509e-04 -1.44251761e-04 -1.36151535e-04] [ 4.97186038e-05 2.52460649e-04 1.15269130e-04] [-4.97186045e-05 -2.52460650e-04 1.15269130e-04] [-3.63929245e-04 -2.03004130e-04 -1.79351168e-05] [ 3.63929245e-04 2.03004130e-04 -1.79351177e-05] [-2.10809051e-04 -4.30217816e-05 -3.48164548e-05] [ 2.10809051e-04 4.30217813e-05 -3.48164543e-05] [ 1.11354572e-04 2.71928283e-04 2.27982205e-04] [-1.11354572e-04 -2.71928283e-04 2.27982205e-04] [-2.14416060e-04 -1.04498031e-04 5.56546614e-04] [ 2.14416061e-04 1.04498030e-04 5.56546613e-04] [ 1.72014741e-04 4.41993622e-05 -1.19692903e-04] [-1.72014743e-04 -4.41993640e-05 -1.19692900e-04] [-1.91167056e-04 -3.09765866e-04 -3.37392162e-04] [ 1.91167056e-04 3.09765866e-04 -3.37392163e-04] [ 2.78328069e-05 -3.89856933e-04 2.27905390e-04] [-2.78328068e-05 3.89856933e-04 2.27905391e-04] [-7.90529982e-05 4.23436390e-04 3.38671938e-05] [ 7.90529989e-05 -4.23436390e-04 3.38671941e-05] [ 1.82744809e-04 3.25704587e-05 -3.08041260e-04] [-1.82744811e-04 -3.25704586e-05 -3.08041261e-04] [ 2.81328722e-04 -7.65770381e-05 -1.38869164e-04] [-2.81328723e-04 7.65770385e-05 -1.38869164e-04] [-1.13716321e-04 -7.76827340e-05 -7.40810152e-05] [ 1.13716322e-04 7.76827337e-05 -7.40810161e-05] [ 1.77694612e-04 -3.26597389e-05 1.02164168e-04] [-1.77694609e-04 3.26597413e-05 1.02164168e-04] [-2.36865946e-04 1.25356129e-04 -2.65682325e-04] [ 2.36865946e-04 -1.25356129e-04 -2.65682324e-04] [ 2.53196018e-04 2.58227314e-04 -1.35505849e-04] [-2.53196018e-04 -2.58227314e-04 -1.35505849e-04] [-2.27493507e-04 -2.10602575e-04 4.12249501e-05] [ 2.27493507e-04 2.10602576e-04 4.12249502e-05] [ 2.09739515e-04 8.82815128e-05 4.20421390e-04] [-2.09739515e-04 -8.82815128e-05 4.20421390e-04] [-1.31938658e-04 1.56653830e-04 -8.94782231e-04] [ 1.31938658e-04 -1.56653831e-04 -8.94782231e-04] [-2.74853733e-04 -1.48123539e-04 1.51375348e-04] [ 2.74853733e-04 1.48123540e-04 1.51375350e-04] [ 8.20289477e-06 2.03690130e-04 -2.60287804e-04] [-8.20289342e-06 -2.03690129e-04 -2.60287805e-04] [ 6.01840052e-04 4.30989436e-06 -1.60003815e-05] [-6.01840053e-04 -4.30989175e-06 -1.60003820e-05] [-8.31130969e-04 -2.05172020e-04 2.29585666e-04] [ 8.31130970e-04 2.05172022e-04 2.29585667e-04] [ 3.29933836e-04 -1.02261286e-04 8.61979744e-05] [-3.29933836e-04 1.02261286e-04 8.61979753e-05] [-2.15733872e-04 2.06631554e-04 5.00250521e-04] [ 2.15733871e-04 -2.06631555e-04 5.00250520e-04] [ 5.96004225e-05 -1.23444300e-04 1.74340380e-05] [-5.96004229e-05 1.23444298e-04 1.74340364e-05] [-8.90699229e-05 -5.45409524e-04 -4.03883742e-05] [ 8.90699234e-05 5.45409524e-04 -4.03883739e-05] [-7.02867267e-05 -8.48967389e-05 -1.40321477e-04] [ 7.02867267e-05 8.48967399e-05 -1.40321477e-04] [-1.61621147e-04 -1.27204038e-04 1.24635954e-04] [ 1.61621146e-04 1.27204036e-04 1.24635953e-04] [ 2.27639577e-04 3.52572825e-05 4.45975064e-05] [-2.27639576e-04 -3.52572848e-05 4.45975078e-05] [ 2.43883071e-04 3.70508199e-04 -1.10308853e-04] [-2.43883071e-04 -3.70508199e-04 -1.10308854e-04] [-4.60907064e-04 -3.51069223e-04 2.57844103e-04] [ 4.60907064e-04 3.51069224e-04 2.57844102e-04] [ 5.03544792e-05 3.22212472e-04 5.96895199e-05] [-5.03544789e-05 -3.22212467e-04 5.96895205e-05] [ 8.66019195e-05 -2.98150760e-04 1.35737529e-04] [-8.66019191e-05 2.98150759e-04 1.35737528e-04] [-4.28729186e-05 -3.41672224e-05 3.34552826e-04] [ 4.28729181e-05 3.41672204e-05 3.34552828e-04] [-2.61452690e-04 1.18460406e-05 -5.09345865e-05] [ 2.61452691e-04 -1.18460411e-05 -5.09345900e-05] [ 2.53700603e-04 -3.43626773e-05 2.11106120e-05] [-2.53700603e-04 3.43626776e-05 2.11106146e-05]] Final stress: [-1.37322368e-05 -2.00366799e-05 -1.34624537e-05 -1.63734302e-16 4.01567339e-16 -6.30468087e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-1.25447287e-04 -1.98954107e-04 5.92141567e-05] [ 1.25447286e-04 1.98954108e-04 5.92141562e-05] [-2.34054251e-04 2.71542988e-04 3.64387708e-05] [ 2.34054251e-04 -2.71542989e-04 3.64387710e-05] [-4.70977718e-05 -2.46647639e-04 -1.55695328e-04] [ 4.70977720e-05 2.46647638e-04 -1.55695329e-04] [ 3.93191716e-04 -2.68255486e-04 -2.50553124e-04] [-3.93191716e-04 2.68255484e-04 -2.50553124e-04] [ 2.57523968e-05 1.75738995e-04 -1.10141019e-04] [-2.57523967e-05 -1.75738994e-04 -1.10141018e-04] [-8.58921083e-05 4.45234133e-05 2.13360232e-04] [ 8.58921091e-05 -4.45234136e-05 2.13360231e-04] [ 3.15834381e-04 1.89189414e-05 -3.33812684e-04] [-3.15834382e-04 -1.89189420e-05 -3.33812685e-04] [ 3.32370910e-04 1.79292538e-04 -7.26544074e-04] [-3.32370910e-04 -1.79292540e-04 -7.26544074e-04] [-2.19466230e-06 3.36746848e-04 -3.22034564e-04] [ 2.19466289e-06 -3.36746849e-04 -3.22034564e-04] [-7.81095967e-05 -1.70501139e-04 3.28601117e-04] [ 7.81095958e-05 1.70501139e-04 3.28601117e-04] [-5.74327540e-04 -2.27760219e-04 4.79729108e-05] [ 5.74327540e-04 2.27760219e-04 4.79729104e-05] [ 5.36566043e-04 2.08514152e-06 3.84149822e-05] [-5.36566044e-04 -2.08513869e-06 3.84149820e-05] [-2.06624295e-04 2.53451887e-04 -2.17007693e-04] [ 2.06624296e-04 -2.53451886e-04 -2.17007692e-04] [ 5.76542215e-05 -8.45009247e-05 7.74140095e-04] [-5.76542208e-05 8.45009249e-05 7.74140095e-04] [-2.14215942e-04 1.48770929e-04 -1.39056547e-04] [ 2.14215941e-04 -1.48770929e-04 -1.39056547e-04] [-5.38266624e-05 2.60650107e-04 1.18729238e-04] [ 5.38266633e-05 -2.60650107e-04 1.18729239e-04] [ 3.75822583e-04 -2.03853166e-04 -2.01353407e-05] [-3.75822583e-04 2.03853165e-04 -2.01353409e-05] [ 1.14811376e-04 -2.79431162e-04 2.35311497e-04] [-1.14811376e-04 2.79431162e-04 2.35311497e-04] [-2.16697028e-04 4.98115823e-05 -3.94886222e-05] [ 2.16697028e-04 -4.98115820e-05 -3.94886219e-05] [ 1.81194443e-04 -4.07452553e-05 -1.30543534e-04] [-1.81194444e-04 4.07452556e-05 -1.30543534e-04] [-2.22391137e-04 1.10240578e-04 5.75507027e-04] [ 2.22391137e-04 -1.10240577e-04 5.75507026e-04] [ 2.87797553e-05 4.01413930e-04 2.33421652e-04] [-2.87797554e-05 -4.01413928e-04 2.33421652e-04] [-1.97784972e-04 3.19762343e-04 -3.45995694e-04] [ 1.97784973e-04 -3.19762343e-04 -3.45995693e-04] [ 1.89727459e-04 -3.43498182e-05 -3.21479202e-04] [-1.89727458e-04 3.43498191e-05 -3.21479202e-04] [-7.63460217e-05 -4.37631116e-04 4.18228124e-05] [ 7.63460217e-05 4.37631116e-04 4.18228128e-05] [-1.15213693e-04 8.20654262e-05 -7.42819118e-05] [ 1.15213693e-04 -8.20654270e-05 -7.42819109e-05] [ 2.88936153e-04 7.81342728e-05 -1.45644251e-04] [-2.88936154e-04 -7.81342735e-05 -1.45644251e-04] [-2.42688809e-04 -1.22411623e-04 -2.71698335e-04] [ 2.42688808e-04 1.22411624e-04 -2.71698336e-04] [ 1.73447770e-04 3.08986311e-05 1.07033936e-04] [-1.73447770e-04 -3.08986308e-05 1.07033936e-04] [-2.31687926e-04 2.17372317e-04 4.16925616e-05] [ 2.31687927e-04 -2.17372316e-04 4.16925618e-05] [ 2.61376226e-04 -2.66555106e-04 -1.37363398e-04] [-2.61376226e-04 2.66555106e-04 -1.37363398e-04] [-1.39397780e-04 -1.60343050e-04 -9.24687353e-04] [ 1.39397779e-04 1.60343049e-04 -9.24687354e-04] [ 2.20184002e-04 -9.17438516e-05 4.36923004e-04] [-2.20184002e-04 9.17438520e-05 4.36923004e-04] [ 9.43676640e-06 -2.00046649e-04 -2.60002150e-04] [-9.43676643e-06 2.00046650e-04 -2.60002150e-04] [-2.76475498e-04 1.59702003e-04 1.52730222e-04] [ 2.76475497e-04 -1.59702003e-04 1.52730221e-04] [-8.50551186e-04 2.00501064e-04 2.27341792e-04] [ 8.50551185e-04 -2.00501063e-04 2.27341793e-04] [ 6.06149106e-04 -7.16030727e-06 -1.36766848e-05] [-6.06149106e-04 7.16030674e-06 -1.36766853e-05] [-2.15411973e-04 -2.10522365e-04 5.15619761e-04] [ 2.15411974e-04 2.10522365e-04 5.15619761e-04] [ 3.38906717e-04 1.07720975e-04 8.55020826e-05] [-3.38906717e-04 -1.07720975e-04 8.55020824e-05] [-6.95616325e-05 -1.21464877e-04 1.20307675e-05] [ 6.95616335e-05 1.21464877e-04 1.20307660e-05] [ 9.83802723e-05 -5.57962301e-04 -4.26705679e-05] [-9.83802718e-05 5.57962301e-04 -4.26705678e-05] [ 7.78910505e-05 -8.50827470e-05 -1.48106897e-04] [-7.78910509e-05 8.50827477e-05 -1.48106898e-04] [ 1.65659415e-04 -1.34448945e-04 1.30693457e-04] [-1.65659415e-04 1.34448946e-04 1.30693457e-04] [-2.33463556e-04 3.59144732e-05 4.82305712e-05] [ 2.33463557e-04 -3.59144735e-05 4.82305712e-05] [-2.57744399e-04 3.78916278e-04 -1.10787225e-04] [ 2.57744399e-04 -3.78916279e-04 -1.10787224e-04] [ 4.73424920e-04 -3.62593615e-04 2.71011327e-04] [-4.73424920e-04 3.62593616e-04 2.71011327e-04] [-4.80284185e-05 3.28668787e-04 6.20617800e-05] [ 4.80284185e-05 -3.28668789e-04 6.20617798e-05] [-4.23802848e-05 3.50369787e-05 3.45679448e-04] [ 4.23802851e-05 -3.50369789e-05 3.45679449e-04] [ 8.85000493e-05 3.07231756e-04 1.36995218e-04] [-8.85000482e-05 -3.07231756e-04 1.36995218e-04] [ 2.64155383e-04 3.93040425e-05 1.90647194e-05] [-2.64155384e-04 -3.93040442e-05 1.90647185e-05] [-2.66049100e-04 -8.80081567e-06 -5.41389352e-05] [ 2.66049100e-04 8.80081471e-06 -5.41389361e-05]] Final stress: [-1.37514647e-05 -1.99590097e-05 -1.34236132e-05 3.15636709e-15 3.13365941e-15 6.53474972e-06] Minimization converged after 18 steps. Minimization converged after 20 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 19 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-8.00286086e-05 -8.54074471e-05 -2.33075685e-04] [ 8.00286087e-05 8.54074393e-05 -2.33075684e-04] [-2.79041462e-05 -2.81648559e-04 4.27149293e-05] [ 2.79041459e-05 2.81648558e-04 4.27149316e-05] [ 5.36182222e-04 6.97585254e-04 7.77128532e-05] [-5.36182222e-04 -6.97585255e-04 7.77128525e-05] [-2.05879832e-04 -2.23687276e-05 -2.71325862e-04] [ 2.05879833e-04 2.23687267e-05 -2.71325863e-04] [ 3.11726540e-04 3.10649554e-04 4.84895325e-04] [-3.11726540e-04 -3.10649554e-04 4.84895325e-04] [-2.02205266e-04 -2.08001636e-04 1.74000422e-04] [ 2.02205266e-04 2.08001637e-04 1.74000423e-04] [-4.08729076e-04 -1.86404369e-04 2.23130206e-04] [ 4.08729075e-04 1.86404370e-04 2.23130209e-04] [-1.62277799e-03 2.47839973e-04 7.33938763e-04] [ 1.62277799e-03 -2.47839971e-04 7.33938765e-04] [ 5.91891927e-04 -8.17098322e-05 1.96710427e-04] [-5.91891927e-04 8.17098333e-05 1.96710429e-04] [ 4.18812089e-04 2.23317893e-04 -1.14884137e-04] [-4.18812089e-04 -2.23317894e-04 -1.14884138e-04] [ 2.80206937e-04 -2.72174280e-04 -2.11416278e-04] [-2.80206937e-04 2.72174278e-04 -2.11416276e-04] [-5.04247471e-04 -5.58597883e-04 -6.12704947e-05] [ 5.04247471e-04 5.58597893e-04 -6.12704969e-05] [-7.68265236e-05 -1.29475266e-04 1.11939284e-04] [ 7.68265233e-05 1.29475262e-04 1.11939277e-04] [ 2.73404946e-04 1.22271777e-04 -5.44570427e-04] [-2.73404946e-04 -1.22271781e-04 -5.44570428e-04] [ 2.48562899e-04 8.07250766e-04 -1.32231656e-03] [-2.48562899e-04 -8.07250765e-04 -1.32231656e-03] [ 4.64558415e-04 -6.69641078e-04 3.18756919e-04] [-4.64558415e-04 6.69641078e-04 3.18756920e-04] [ 3.85535707e-04 2.75311321e-04 1.64890621e-05] [-3.85535707e-04 -2.75311320e-04 1.64890634e-05] [ 2.52456236e-04 3.77539842e-04 -3.69710697e-04] [-2.52456237e-04 -3.77539843e-04 -3.69710697e-04] [-1.06230381e-05 -2.88223177e-04 -4.07581394e-04] [ 1.06230390e-05 2.88223178e-04 -4.07581394e-04] [ 4.40961229e-05 4.28214433e-04 -2.91585772e-04] [-4.40961244e-05 -4.28214432e-04 -2.91585771e-04] [-1.86578190e-04 -2.01280364e-04 1.23786961e-04] [ 1.86578193e-04 2.01280366e-04 1.23786959e-04] [-4.50612953e-05 5.28069814e-05 4.42071326e-04] [ 4.50612964e-05 -5.28069811e-05 4.42071325e-04] [-2.34540756e-04 -9.69606338e-04 4.68719619e-04] [ 2.34540755e-04 9.69606338e-04 4.68719619e-04] [-2.03569862e-04 -4.31524972e-04 -7.98011299e-04] [ 2.03569860e-04 4.31524974e-04 -7.98011300e-04] [-2.75767027e-05 -4.08369811e-04 4.74663503e-04] [ 2.75767021e-05 4.08369811e-04 4.74663503e-04] [ 2.21655051e-04 1.83366887e-04 5.95918986e-04] [-2.21655050e-04 -1.83366887e-04 5.95918985e-04] [-4.99069878e-04 3.40535225e-04 -5.63583332e-05] [ 4.99069877e-04 -3.40535224e-04 -5.63583323e-05] [-4.06613725e-04 -8.44519614e-06 5.24213367e-04] [ 4.06613724e-04 8.44519754e-06 5.24213368e-04] [-1.38358006e-04 -7.08978996e-04 3.24578069e-04] [ 1.38358006e-04 7.08978996e-04 3.24578070e-04] [ 3.85860698e-04 -9.29287453e-04 -7.97375301e-04] [-3.85860697e-04 9.29287453e-04 -7.97375300e-04] [-6.32106877e-04 1.07937958e-04 -1.45980441e-04] [ 6.32106876e-04 -1.07937958e-04 -1.45980441e-04] [-6.49394756e-04 -4.48300205e-05 -4.62617610e-04] [ 6.49394757e-04 4.48300189e-05 -4.62617611e-04] [ 2.35960812e-04 4.16079674e-04 4.80773962e-04] [-2.35960812e-04 -4.16079677e-04 4.80773963e-04] [ 1.09147277e-03 -6.57208302e-04 7.14389997e-04] [-1.09147276e-03 6.57208302e-04 7.14389997e-04] [-5.82175990e-04 2.83229728e-04 -1.56884474e-04] [ 5.82175988e-04 -2.83229729e-04 -1.56884473e-04] [-1.48308922e-04 -8.50642147e-04 5.29306248e-04] [ 1.48308922e-04 8.50642146e-04 5.29306248e-04] [-6.88832560e-05 -2.23725718e-04 -1.07156812e-03] [ 6.88832558e-05 2.23725718e-04 -1.07156812e-03] [ 7.77101959e-04 6.64051205e-05 5.56913448e-04] [-7.77101960e-04 -6.64051202e-05 5.56913448e-04] [ 1.06638979e-04 -2.55339691e-04 -2.52144684e-05] [-1.06638978e-04 2.55339692e-04 -2.52144686e-05] [ 1.28019415e-03 6.51506484e-06 -1.72141227e-04] [-1.28019415e-03 -6.51506160e-06 -1.72141226e-04] [ 1.08506757e-03 -9.21625942e-05 -1.52926737e-04] [-1.08506757e-03 9.21625955e-05 -1.52926739e-04] [-1.66644646e-04 -3.55628964e-04 -4.09052272e-04] [ 1.66644646e-04 3.55628964e-04 -4.09052272e-04] [ 7.10398757e-04 -1.14075829e-06 5.13593498e-04] [-7.10398757e-04 1.14075861e-06 5.13593498e-04] [-4.07482869e-04 1.32287708e-04 -3.38247378e-04] [ 4.07482870e-04 -1.32287704e-04 -3.38247378e-04] [-1.03236889e-03 2.06911125e-04 -1.85528776e-04] [ 1.03236889e-03 -2.06911125e-04 -1.85528777e-04] [ 3.48358824e-04 -1.32157016e-04 8.83894200e-05] [-3.48358823e-04 1.32157016e-04 8.83894199e-05] [ 1.59305778e-04 6.42389821e-05 5.87359193e-05] [-1.59305778e-04 -6.42389884e-05 5.87359179e-05] [-9.98126330e-04 2.49589957e-04 -1.84952297e-04] [ 9.98126329e-04 -2.49589955e-04 -1.84952296e-04] [ 3.50865033e-04 9.45492927e-04 2.11518275e-04] [-3.50865032e-04 -9.45492926e-04 2.11518276e-04] [-2.73963137e-04 6.16979971e-04 -1.27667701e-04] [ 2.73963137e-04 -6.16979973e-04 -1.27667698e-04] [-1.96380990e-04 1.30195577e-04 4.24402953e-04] [ 1.96380989e-04 -1.30195577e-04 4.24402950e-04]] Final stress: [ 1.09695367e-05 7.71614559e-07 5.78379371e-05 -3.28648440e-16 3.44184548e-16 -3.97561024e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 8.61193318e-05 -1.94868841e-03 -1.76679900e-03] [-8.61193300e-05 1.94868840e-03 -1.76679899e-03] [ 2.89206732e-04 -3.67710529e-04 6.16231892e-04] [-2.89206730e-04 3.67710515e-04 6.16231894e-04] [-2.13414495e-03 2.11956896e-03 1.62296564e-03] [ 2.13414495e-03 -2.11956897e-03 1.62296564e-03] [-4.58856988e-04 4.34410466e-04 -3.05223150e-03] [ 4.58856997e-04 -4.34410466e-04 -3.05223149e-03] [-2.02446496e-03 1.93054455e-03 3.25044024e-03] [ 2.02446497e-03 -1.93054453e-03 3.25044023e-03] [ 6.54962154e-04 2.68615504e-04 -6.89662407e-04] [-6.54962153e-04 -2.68615505e-04 -6.89662421e-04] [ 2.21403357e-03 -1.23699793e-03 1.97852182e-03] [-2.21403358e-03 1.23699794e-03 1.97852182e-03] [ 7.40807757e-03 1.31922422e-03 7.83585511e-03] [-7.40807757e-03 -1.31922421e-03 7.83585512e-03] [-2.24785178e-03 -8.52759277e-04 1.38886285e-03] [ 2.24785177e-03 8.52759278e-04 1.38886285e-03] [-2.88359282e-03 1.07169403e-03 -1.78952638e-03] [ 2.88359282e-03 -1.07169403e-03 -1.78952638e-03] [-3.16061043e-04 -2.39529350e-03 -2.40235533e-03] [ 3.16061040e-04 2.39529348e-03 -2.40235532e-03] [ 5.23869478e-05 -5.20387070e-03 -8.26640392e-04] [-5.23869521e-05 5.20387075e-03 -8.26640406e-04] [ 1.57700027e-03 -2.16870554e-03 3.05879655e-03] [-1.57700027e-03 2.16870553e-03 3.05879652e-03] [-1.15011505e-03 1.23184170e-03 -7.25254471e-03] [ 1.15011505e-03 -1.23184171e-03 -7.25254472e-03] [-7.08021270e-04 3.86764266e-03 -4.43784903e-03] [ 7.08021285e-04 -3.86764267e-03 -4.43784903e-03] [-2.10168205e-03 -2.93442133e-03 5.82961640e-04] [ 2.10168206e-03 2.93442133e-03 5.82961644e-04] [-2.27218450e-03 8.58512852e-04 3.99769464e-04] [ 2.27218450e-03 -8.58512851e-04 3.99769465e-04] [-3.44322208e-04 8.26606943e-04 -2.18314582e-03] [ 3.44322208e-04 -8.26606944e-04 -2.18314581e-03] [-7.26099801e-04 -2.17800124e-03 -6.38462851e-04] [ 7.26099800e-04 2.17800123e-03 -6.38462852e-04] [-3.17807033e-03 -2.81397333e-04 2.44524109e-03] [ 3.17807032e-03 2.81397339e-04 2.44524109e-03] [ 1.64523861e-03 -2.14800655e-03 -1.07620004e-03] [-1.64523860e-03 2.14800656e-03 -1.07620005e-03] [-1.95203939e-03 2.61971314e-03 1.72199136e-03] [ 1.95203939e-03 -2.61971314e-03 1.72199136e-03] [-4.12492868e-04 -3.53012118e-04 2.66741506e-03] [ 4.12492865e-04 3.53012115e-04 2.66741507e-03] [-1.93629481e-03 1.70990023e-03 1.68199956e-03] [ 1.93629481e-03 -1.70990022e-03 1.68199955e-03] [ 5.81136407e-06 2.65227070e-03 -4.20731890e-03] [-5.81138016e-06 -2.65227069e-03 -4.20731890e-03] [-3.78420791e-03 -1.72232755e-03 -1.01350512e-03] [ 3.78420792e-03 1.72232755e-03 -1.01350512e-03] [-2.54449988e-04 -5.75508884e-04 2.35383299e-03] [ 2.54449979e-04 5.75508887e-04 2.35383299e-03] [-2.42991777e-03 4.16659779e-03 2.58703776e-03] [ 2.42991779e-03 -4.16659778e-03 2.58703776e-03] [-4.44845937e-03 6.09630797e-04 1.71885194e-03] [ 4.44845937e-03 -6.09630791e-04 1.71885194e-03] [-2.91483454e-03 -4.33690173e-04 -4.17318828e-04] [ 2.91483454e-03 4.33690174e-04 -4.17318827e-04] [ 1.60908830e-03 4.26862281e-03 -3.21748571e-03] [-1.60908829e-03 -4.26862282e-03 -3.21748571e-03] [ 6.74345161e-04 -3.86074719e-03 4.80663436e-03] [-6.74345174e-04 3.86074719e-03 4.80663436e-03] [-4.72954803e-03 2.52823163e-04 -4.40688065e-03] [ 4.72954803e-03 -2.52823161e-04 -4.40688065e-03] [-2.23225445e-03 -1.73698032e-03 2.39690349e-04] [ 2.23225446e-03 1.73698032e-03 2.39690346e-04] [ 5.72491488e-03 1.67234581e-03 5.01583262e-03] [-5.72491488e-03 -1.67234581e-03 5.01583262e-03] [-4.60825925e-04 -1.82854134e-04 -4.52514239e-03] [ 4.60825914e-04 1.82854140e-04 -4.52514240e-03] [-3.98329392e-03 2.53800899e-03 1.10980204e-03] [ 3.98329393e-03 -2.53800899e-03 1.10980205e-03] [ 1.29433096e-03 7.72598593e-04 -2.32579797e-03] [-1.29433096e-03 -7.72598589e-04 -2.32579798e-03] [ 3.38975053e-03 -6.19526432e-04 1.35696421e-03] [-3.38975053e-03 6.19526436e-04 1.35696420e-03] [-4.89158934e-03 1.05011934e-03 -2.57769078e-03] [ 4.89158934e-03 -1.05011933e-03 -2.57769079e-03] [-7.48804466e-03 1.94477872e-05 1.86098393e-04] [ 7.48804466e-03 -1.94477861e-05 1.86098377e-04] [ 1.05576757e-04 -9.54572494e-04 -2.90059482e-03] [-1.05576765e-04 9.54572494e-04 -2.90059483e-03] [-4.23341330e-03 1.48658249e-04 3.22936848e-03] [ 4.23341330e-03 -1.48658261e-04 3.22936849e-03] [ 4.56201222e-03 2.57204357e-03 -1.84588667e-03] [-4.56201222e-03 -2.57204356e-03 -1.84588666e-03] [ 7.19995028e-03 6.22346537e-04 -1.61832707e-03] [-7.19995027e-03 -6.22346539e-04 -1.61832706e-03] [-2.04270134e-03 -1.08007926e-03 8.72990086e-04] [ 2.04270134e-03 1.08007926e-03 8.72990084e-04] [ 8.32721808e-05 1.78735681e-03 8.36872500e-04] [-8.32721634e-05 -1.78735685e-03 8.36872496e-04] [ 2.04318432e-03 -3.91716579e-03 1.69101781e-03] [-2.04318432e-03 3.91716579e-03 1.69101781e-03] [-4.23014419e-03 -2.56610889e-03 -7.51856456e-04] [ 4.23014419e-03 2.56610889e-03 -7.51856446e-04] [-1.02164293e-04 -1.28119854e-04 1.33798758e-03] [ 1.02164286e-04 1.28119846e-04 1.33798759e-03] [ 1.10738288e-04 -2.08474540e-03 -6.70810541e-04] [-1.10738293e-04 2.08474540e-03 -6.70810556e-04]] Final stress: [-1.66761365e-06 -1.84104733e-05 1.63130829e-04 -1.41521994e-14 9.60848530e-15 1.47054369e-04] Minimization converged after 124 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.09397605e-03 7.95245352e-04 1.56348303e-03] [-1.09397605e-03 -7.95245332e-04 1.56348302e-03] [ 7.05310971e-04 2.05968274e-03 -1.77272068e-03] [-7.05310971e-04 -2.05968275e-03 -1.77272067e-03] [-6.73119519e-04 -2.01764641e-03 8.35294010e-04] [ 6.73119519e-04 2.01764641e-03 8.35294005e-04] [ 1.75285716e-04 1.10661934e-03 -6.41975468e-04] [-1.75285719e-04 -1.10661936e-03 -6.41975496e-04] [-5.95451573e-04 -6.87753851e-04 -9.41168247e-04] [ 5.95451575e-04 6.87753847e-04 -9.41168244e-04] [ 6.73034026e-04 5.99503726e-04 -8.95460588e-04] [-6.73034025e-04 -5.99503728e-04 -8.95460587e-04] [ 7.32491049e-04 1.07552127e-03 8.33149066e-05] [-7.32491046e-04 -1.07552127e-03 8.33148939e-05] [ 2.91841818e-03 -9.35519610e-04 -7.34059515e-04] [-2.91841818e-03 9.35519600e-04 -7.34059523e-04] [-1.79295308e-03 -5.14311082e-04 -1.14552562e-04] [ 1.79295308e-03 5.14311086e-04 -1.14552558e-04] [-8.35190226e-04 -4.24997754e-04 -2.68762295e-04] [ 8.35190223e-04 4.24997758e-04 -2.68762281e-04] [-1.39248266e-04 4.50100725e-05 -6.17728687e-04] [ 1.39248267e-04 -4.50100747e-05 -6.17728687e-04] [ 1.35097491e-03 1.96585154e-03 -7.89976451e-04] [-1.35097491e-03 -1.96585151e-03 -7.89976456e-04] [-1.10301855e-04 -6.96095263e-04 2.61343367e-03] [ 1.10301859e-04 6.96095268e-04 2.61343367e-03] [-7.55502227e-04 -5.70223945e-04 -1.84188398e-04] [ 7.55502228e-04 5.70223938e-04 -1.84188399e-04] [ 6.70569788e-05 -2.34620459e-03 2.72740455e-03] [-6.70569859e-05 2.34620459e-03 2.72740456e-03] [-1.42265634e-03 2.52938810e-03 -1.80545274e-04] [ 1.42265634e-03 -2.52938809e-03 -1.80545274e-04] [-1.90452063e-03 -1.33925515e-03 1.65503216e-03] [ 1.90452063e-03 1.33925515e-03 1.65503217e-03] [-2.28809688e-03 3.59364374e-04 3.04268847e-04] [ 2.28809687e-03 -3.59364372e-04 3.04268844e-04] [-5.09408492e-04 1.33236612e-03 3.57473894e-04] [ 5.09408492e-04 -1.33236612e-03 3.57473894e-04] [ 1.41908398e-03 -1.01467984e-03 1.14919438e-03] [-1.41908398e-03 1.01467984e-03 1.14919438e-03] [-6.98796397e-05 5.48920829e-04 -7.36518386e-04] [ 6.98796522e-05 -5.48920819e-04 -7.36518397e-04] [-8.72362862e-04 5.04927777e-04 -1.59563602e-03] [ 8.72362866e-04 -5.04927776e-04 -1.59563601e-03] [-3.76397020e-04 1.71247966e-03 -3.88582682e-04] [ 3.76397019e-04 -1.71247965e-03 -3.88582685e-04] [ 2.05531061e-03 6.20467438e-04 2.77801142e-03] [-2.05531061e-03 -6.20467431e-04 2.77801142e-03] [ 3.89334041e-04 1.24054106e-03 -2.03296663e-03] [-3.89334043e-04 -1.24054106e-03 -2.03296662e-03] [-1.64129552e-03 -1.18281985e-03 -1.38687401e-03] [ 1.64129552e-03 1.18281985e-03 -1.38687401e-03] [ 3.14537725e-04 -2.83678194e-04 5.83924917e-04] [-3.14537725e-04 2.83678195e-04 5.83924919e-04] [-5.56970809e-04 -1.41050277e-03 -1.24355248e-03] [ 5.56970811e-04 1.41050276e-03 -1.24355248e-03] [-1.34816247e-03 2.30368613e-03 -7.22512341e-04] [ 1.34816247e-03 -2.30368614e-03 -7.22512343e-04] [-8.07883258e-04 1.74474079e-03 2.24066167e-03] [ 8.07883263e-04 -1.74474079e-03 2.24066167e-03] [ 7.62449124e-04 6.41268545e-04 1.15876218e-03] [-7.62449126e-04 -6.41268546e-04 1.15876218e-03] [ 2.55145503e-03 8.52674006e-04 7.46941379e-04] [-2.55145503e-03 -8.52674002e-04 7.46941382e-04] [ 4.15153558e-04 -3.17068127e-04 -1.47933491e-03] [-4.15153562e-04 3.17068128e-04 -1.47933490e-03] [-3.09174739e-03 2.58788853e-03 -5.09736295e-04] [ 3.09174739e-03 -2.58788853e-03 -5.09736295e-04] [ 1.60019242e-03 -4.63467136e-04 -1.43490125e-04] [-1.60019242e-03 4.63467132e-04 -1.43490129e-04] [-1.03949146e-03 4.32528757e-03 -2.00494709e-03] [ 1.03949146e-03 -4.32528757e-03 -2.00494708e-03] [-1.17864123e-03 1.52535199e-03 2.88635438e-03] [ 1.17864123e-03 -1.52535199e-03 2.88635438e-03] [-2.25490421e-03 -2.18111840e-04 -1.85469006e-03] [ 2.25490420e-03 2.18111842e-04 -1.85469007e-03] [-8.61115254e-04 1.27616661e-03 -4.79441763e-04] [ 8.61115251e-04 -1.27616661e-03 -4.79441758e-04] [-2.70169198e-03 9.04393171e-04 -7.25615783e-04] [ 2.70169198e-03 -9.04393174e-04 -7.25615788e-04] [-1.69054911e-03 -1.25516613e-04 1.09873456e-04] [ 1.69054911e-03 1.25516617e-04 1.09873453e-04] [ 9.91064289e-04 1.32399661e-03 1.41747015e-03] [-9.91064286e-04 -1.32399660e-03 1.41747015e-03] [-1.68590520e-03 -1.04020610e-04 -6.90248159e-04] [ 1.68590520e-03 1.04020621e-04 -6.90248150e-04] [-7.58852490e-04 -1.52239064e-03 9.64014945e-04] [ 7.58852486e-04 1.52239063e-03 9.64014945e-04] [ 1.84634169e-03 -6.32138235e-05 1.18310305e-03] [-1.84634168e-03 6.32138227e-05 1.18310305e-03] [-1.65347684e-03 5.56596618e-04 5.89981460e-04] [ 1.65347685e-03 -5.56596617e-04 5.89981458e-04] [-4.51828131e-04 1.63591574e-04 -5.28717350e-04] [ 4.51828120e-04 -1.63591600e-04 -5.28717350e-04] [ 2.42564153e-03 1.35977735e-04 -7.34118576e-04] [-2.42564153e-03 -1.35977735e-04 -7.34118563e-04] [-1.38729078e-03 -1.30224774e-03 -2.55059048e-04] [ 1.38729079e-03 1.30224774e-03 -2.55059064e-04] [ 8.10160192e-04 -1.84302356e-03 1.70446202e-04] [-8.10160193e-04 1.84302356e-03 1.70446208e-04] [ 1.47555216e-03 7.39698001e-05 -1.46526479e-03] [-1.47555216e-03 -7.39697985e-05 -1.46526479e-03]] Final stress: [-2.50341560e-05 1.10196461e-05 -9.68976950e-05 1.35696297e-14 -4.94788328e-15 9.73662435e-05] Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 149 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-1.21586279e-04 1.03581708e-02 1.13266510e-03] [-1.49294846e-04 3.67885982e-03 -1.04020000e-03] [-1.30711814e-03 -1.94552640e-03 -7.86768848e-04] [ 1.38336937e-03 -2.48171947e-03 3.18856772e-04] [-1.70852621e-03 -6.67465701e-04 -4.86785689e-03] [ 1.88343488e-03 3.10300230e-04 4.44284553e-03] [ 1.64507096e-03 -3.26979841e-04 4.21875513e-03] [-1.53355210e-03 -3.17583354e-04 -2.89420336e-03] [ 5.16642016e-06 -1.88043273e-03 1.24264425e-03] [-3.74904358e-05 -2.27022061e-03 -1.79287636e-03] [-1.18860168e-03 -1.16003998e-03 5.61169054e-03] [ 1.21007848e-03 -1.45891777e-03 -5.42217549e-03] [ 7.02279072e-04 2.62766088e-03 1.16483905e-03] [-6.76204548e-04 2.85168288e-03 -1.42957062e-03] [ 4.33125801e-03 -3.19613773e-03 4.91333145e-03] [-4.37521040e-03 -1.45049710e-03 -2.44741535e-03] [ 7.71242525e-04 4.49408483e-04 4.07461810e-04] [-9.04751054e-04 -1.48088647e-04 -1.14673490e-03] [-5.62332031e-04 -1.88517003e-03 -1.12487910e-03] [ 5.32410716e-04 -1.67189727e-03 1.95386302e-03] [-3.52210662e-03 1.22171322e-03 4.54643066e-04] [ 3.53050516e-03 9.96835195e-04 -2.81912294e-04] [ 1.60000443e-03 1.64182135e-03 1.22574817e-03] [-1.55882367e-03 2.11636736e-03 -2.18861690e-04] [-6.16684117e-05 -5.99768275e-03 -6.06756814e-04] [-1.94712876e-05 -4.24465264e-03 -6.61687042e-06] [-1.77961348e-04 -6.84248805e-04 -5.20727225e-03] [ 1.86924217e-04 -8.55895109e-04 3.07637807e-03] [-2.00334760e-03 3.25083714e-03 5.97832752e-03] [ 1.72934920e-03 2.64951430e-03 -2.89764992e-03] [-4.83574446e-04 -1.60821452e-03 6.51074284e-04] [ 4.73044977e-04 -9.38234865e-04 -2.25064875e-03] [ 2.64827539e-03 -4.06722344e-03 -1.63463057e-03] [-2.69492517e-03 -1.53495822e-03 9.93328411e-04] [ 2.28112016e-04 6.86856332e-05 7.56760867e-05] [-1.45327551e-03 4.62178119e-03 4.71325120e-05] [-1.95005552e-03 9.44310747e-04 1.12641137e-03] [ 2.59870842e-03 4.12506076e-03 1.19437480e-03] [ 1.03938572e-03 5.28418835e-04 1.02232139e-03] [ 1.90774470e-03 3.54678750e-03 -2.56214779e-04] [-1.19277228e-03 8.95468623e-04 -6.29396991e-04] [-1.66697929e-03 3.29539907e-03 5.44871797e-04] [ 3.21305194e-03 5.08730164e-04 4.62565129e-03] [ 9.92447472e-04 1.63962031e-03 3.52285573e-03] [-2.93127740e-03 2.82338531e-03 -4.46911373e-03] [-1.07980078e-03 -6.96194119e-04 -3.33976283e-03] [ 1.56594046e-03 -1.44461777e-04 2.07707683e-03] [-1.64469663e-03 -2.34032108e-04 -3.68214522e-04] [-7.66924820e-04 -1.48770896e-03 -7.83453939e-04] [ 1.15457553e-03 1.10752398e-03 1.63503497e-03] [-4.98741407e-04 4.98145227e-04 2.15920439e-03] [ 3.04533350e-03 6.99190101e-04 -3.56053591e-03] [-2.55626251e-04 4.16099305e-04 -3.02581203e-03] [-1.96463903e-03 8.97710459e-04 2.87978696e-03] [-1.63109695e-03 -4.70546407e-04 -2.17742095e-03] [ 7.31438016e-03 3.83196319e-05 1.60533982e-03] [ 7.44990711e-04 -6.56255977e-05 2.11581395e-03] [-6.80812945e-03 -4.29349313e-04 -1.66844611e-03] [ 6.50750670e-04 -2.48742696e-03 2.80021350e-03] [ 6.40981371e-03 -1.03936954e-03 1.69999924e-03] [-3.88595938e-04 -4.12836845e-03 -2.76018480e-03] [-6.61105544e-03 5.68396541e-04 -1.72693405e-03] [ 2.15348189e-03 -9.75587305e-04 -4.48180573e-03] [ 1.74961494e-03 2.44755250e-03 -1.52677776e-03] [-2.06860598e-03 -2.05407839e-03 2.75822523e-03] [-1.80001238e-03 3.61912419e-03 -2.22186307e-04] [-1.33769456e-03 -3.81778266e-03 -1.56017116e-03] [ 1.79962194e-04 1.59678708e-03 -1.26270747e-03] [ 1.82127837e-03 -3.67663411e-03 2.40733828e-03] [-5.43876746e-04 1.52824783e-03 2.13639461e-03] [-2.14941635e-03 2.89556491e-03 4.99328269e-03] [ 8.34338481e-03 2.18618120e-04 1.26844725e-03] [ 2.38144427e-03 3.08863451e-03 -5.36988327e-03] [-8.30569716e-03 4.13388362e-04 -1.68127312e-03] [-1.07790782e-03 3.68294044e-04 2.97784342e-03] [ 1.03201118e-03 1.83251510e-03 -7.10039770e-04] [ 1.23293393e-03 3.83405650e-04 -3.75659942e-03] [-1.17939526e-03 1.75283533e-03 -6.08605258e-05] [-1.68174144e-03 -2.42037164e-04 3.03223222e-03] [ 1.74567276e-03 -6.35559512e-04 -2.64333572e-03] [-7.86005086e-04 5.62582287e-04 3.45617941e-05] [ 8.44495843e-04 -2.44872599e-04 7.29031592e-04] [-1.73038987e-03 -2.99386348e-04 -3.41041708e-03] [ 1.73991421e-03 -6.93262942e-04 2.30500886e-03] [ 2.57305226e-03 3.37997545e-03 -5.32971558e-03] [-2.60159645e-03 2.68992284e-03 3.85321484e-03] [ 1.00701926e-03 -1.04518359e-02 1.07130207e-03] [-1.24700361e-03 -3.23298858e-03 -2.33274772e-03] [ 1.72238756e-04 -1.94161029e-03 -3.82506332e-05] [-1.66002738e-04 -9.66783583e-04 -1.00663708e-03] [ 3.02510807e-03 2.20884594e-03 3.50471158e-03] [-2.90125152e-03 2.47858373e-03 -3.39573874e-03] [-2.59327635e-03 -2.25453846e-03 -4.19721943e-03] [ 2.37740361e-03 -4.05979990e-03 5.00795559e-03] [ 4.99872432e-04 2.02483704e-03 1.72799536e-03] [ 6.21515088e-04 1.30440665e-03 1.16070135e-04] [ 1.34829637e-04 2.02086890e-03 -1.82092382e-03] [-1.18365282e-03 1.29475761e-03 -3.58377405e-04] [ 1.58425776e-03 -3.24755522e-03 -1.33715083e-03] [-1.12553406e-03 -1.76490290e-03 4.31572875e-03] [-1.79370219e-03 -2.56677345e-03 1.79797999e-03] [ 1.48583527e-03 -2.38509360e-03 -3.63020180e-03]] Final stress: [-2.16969990e-05 2.02885502e-05 -4.51545426e-05 2.25234851e-05 -1.73867346e-07 8.94021505e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-1.10129626e-04 -1.00097375e-03 -3.29586443e-04] [ 9.24078097e-05 -2.66612736e-03 4.37493515e-04] [ 3.56213877e-04 5.36566882e-04 1.65904834e-04] [-3.51183311e-04 4.17764550e-04 -1.28543669e-04] [ 4.16803881e-04 -3.24298026e-05 1.03215019e-03] [-4.05345071e-04 6.09862355e-05 -1.07966803e-03] [-3.36641845e-04 -1.33250639e-04 -5.40404906e-04] [ 3.42843151e-04 6.43312383e-05 1.08489032e-03] [-9.16045870e-06 6.36565993e-04 -4.15147149e-04] [ 7.74603444e-06 5.83501325e-04 2.45159161e-04] [ 3.55962790e-04 3.76393082e-04 -1.27372103e-03] [-3.56107628e-04 3.85630215e-04 1.36125675e-03] [-1.59210146e-04 -7.79583241e-04 -1.65746169e-04] [ 1.62304265e-04 -7.22496133e-04 1.86650444e-04] [-9.40575868e-04 3.93363188e-04 -6.61670510e-04] [ 9.38730569e-04 8.04938920e-04 1.30822356e-03] [-2.22794839e-04 1.75558183e-05 -2.51492243e-04] [ 2.15563330e-04 -1.95024410e-04 1.37972616e-04] [ 4.33211098e-05 4.60629689e-04 3.60460216e-04] [-4.53227630e-05 4.96847104e-04 -2.05591679e-04] [ 8.42699837e-04 -3.46989321e-04 -2.49672020e-05] [-8.44822444e-04 -4.22757795e-04 1.53952500e-04] [-3.51774787e-04 -6.85530718e-04 -2.28310200e-05] [ 3.54829190e-04 -5.41668905e-04 2.70216341e-04] [-5.22116008e-05 1.38306770e-03 -2.77459340e-04] [ 4.60688724e-05 1.53054080e-03 -7.28203638e-05] [-4.98075666e-05 2.42826889e-04 7.74372326e-04] [ 4.92951248e-05 2.42397278e-04 -1.29113676e-03] [ 3.71391196e-04 -8.00430153e-04 -6.67042518e-04] [-3.88740985e-04 -8.09783257e-04 1.48055072e-03] [ 1.80553122e-04 3.18677363e-04 -5.18662150e-04] [-1.81703524e-04 4.23832788e-04 1.62389546e-04] [-7.09309730e-04 5.58635445e-04 2.50342631e-04] [ 7.07470811e-04 1.07414669e-03 -4.28496637e-04] [-2.41757891e-04 -2.44877835e-04 2.55573857e-04] [ 6.16856740e-04 -1.04056703e-03 2.70499871e-04] [ 1.25818466e-04 -1.17479760e-04 3.00997485e-05] [-5.39728698e-04 -1.14733500e-03 9.86640961e-06] [-3.02550404e-04 -2.95429413e-04 -7.76890714e-05] [-4.00241673e-04 -6.90727388e-04 2.50388398e-04] [ 2.71210348e-04 -2.06707257e-04 1.20220993e-04] [ 4.39105752e-04 -7.72992130e-04 -2.14633244e-04] [-8.13405312e-04 -5.32593662e-04 -1.29380161e-03] [-3.21571274e-04 1.48540598e-04 -9.74450858e-04] [ 8.98314436e-04 -1.27055960e-04 1.13742231e-03] [ 2.50159750e-04 -2.60162502e-04 8.19231272e-04] [-2.50185224e-04 3.41684486e-04 -2.43847382e-04] [ 2.97667703e-04 -3.29679969e-04 4.75664781e-04] [ 3.63731108e-04 5.73767880e-05 5.05897530e-04] [-3.93035846e-04 -4.39145136e-05 -2.15718910e-04] [ 1.04395936e-04 -9.43610771e-05 -7.40787853e-04] [-5.62874722e-04 -1.17793435e-04 6.56910976e-04] [-1.22122822e-04 -7.54907866e-05 5.44129672e-04] [ 6.01738474e-04 -1.29251759e-04 -8.46468022e-04] [ 1.11052388e-04 -3.64798125e-05 4.39982755e-04] [-1.59429409e-03 1.94959768e-04 -4.80093862e-04] [-2.44123798e-04 2.04482008e-05 -4.91216974e-04] [ 1.70645808e-03 1.38319285e-04 4.29347957e-04] [-1.31604295e-04 9.75327592e-04 -6.81407314e-04] [-1.70562451e-03 -1.90465578e-04 -4.70112990e-04] [ 1.97801281e-04 6.14794874e-04 7.37166763e-04] [ 1.64309852e-03 1.66100554e-04 5.21896894e-04] [-5.29397591e-04 3.96007373e-04 9.30586534e-04] [-5.28690184e-04 -9.08401300e-04 4.94060228e-05] [ 5.51257998e-04 8.10248602e-05 -1.27816095e-03] [ 5.08883427e-04 -5.86310223e-04 -3.99608095e-04] [ 4.24102134e-04 9.36982598e-04 6.02773219e-04] [-1.75060618e-04 -3.83455098e-04 5.35582312e-04] [-3.42621925e-04 9.51875681e-04 -3.58606991e-04] [ 9.98376890e-05 -3.95438483e-04 -2.90918206e-04] [ 6.55809646e-04 -9.33075866e-04 -1.36085752e-03] [-2.23430870e-03 5.97571537e-05 -5.08912525e-04] [-5.34762508e-04 -7.50805205e-04 1.26713817e-03] [ 2.12815552e-03 -9.64200771e-05 4.10878695e-04] [ 2.56633534e-04 -4.05968201e-05 -9.44704567e-04] [-2.70660040e-04 -4.25877382e-04 -2.18470979e-05] [-2.21411994e-04 -2.87541233e-05 7.56635570e-04] [ 2.36769583e-04 -4.42128567e-04 -1.66072688e-04] [ 3.54745287e-04 1.43018820e-04 -6.44962801e-04] [-3.53235832e-04 2.21881850e-05 5.45282686e-04] [ 3.85135601e-05 4.71945828e-06 1.47550898e-04] [-3.45823081e-05 -1.63563405e-04 -4.32961576e-06] [ 3.99287947e-04 9.67566990e-05 5.93789300e-04] [-3.99001438e-04 -3.69080665e-05 -8.40790681e-04] [-5.78413213e-04 -6.91005257e-04 9.88492074e-04] [ 5.79041914e-04 -7.96376189e-04 -1.22114402e-03] [-1.36785179e-04 1.06564110e-03 -4.93879756e-04] [ 1.23660304e-04 2.44836648e-03 3.08566041e-04] [ 1.11220816e-04 2.68872428e-04 -2.88144288e-04] [-1.13294260e-04 4.50310920e-04 4.12899773e-05] [-7.00707713e-04 -6.21427873e-04 -8.29723632e-04] [ 7.08794161e-04 -4.83282758e-04 8.57276985e-04] [ 5.40252059e-04 1.10248642e-03 1.16855680e-03] [-5.54238055e-04 7.73326676e-04 -1.03135407e-03] [ 5.11210820e-05 -5.96661359e-04 -5.74192812e-04] [-3.46334788e-04 -1.47014474e-04 -1.43970252e-04] [ 1.62266165e-04 -4.73091915e-04 3.85962079e-04] [ 1.41094933e-04 -2.69592500e-04 -5.60832873e-05] [-4.14639645e-04 5.82408365e-04 5.43558290e-04] [ 2.90408033e-04 6.12251326e-04 -9.87773607e-04] [ 3.69780263e-04 6.66554836e-04 -3.80953309e-04] [-2.37141269e-04 5.31296576e-04 1.16259518e-03]] Final stress: [-3.76067939e-06 1.90124100e-06 -1.37101564e-05 -1.41214529e-05 -1.55874098e-08 -2.04204015e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.58086496e-04 -3.85697390e-03 -1.14731535e-03] [ 1.32889172e-04 -1.09124510e-02 1.25949546e-03] [-1.43830147e-03 2.58278807e-03 3.28818911e-04] [ 1.35662046e-03 2.03011728e-03 -8.44136955e-04] [-1.94989155e-03 -3.13496349e-04 4.54886012e-03] [ 1.76260414e-03 7.20037639e-04 -5.00081565e-03] [ 1.57231429e-03 3.99866784e-04 -3.07930632e-03] [-1.69315144e-03 4.14688602e-04 4.46848741e-03] [ 2.96397884e-05 2.32650590e-03 -1.84384425e-03] [ 4.99116430e-06 1.91852473e-03 1.26285872e-03] [-1.25493415e-03 1.51603560e-03 -5.57074082e-03] [ 1.23157343e-03 1.20334292e-03 5.77251358e-03] [ 6.84066283e-04 -2.95890301e-03 -1.47214964e-03] [-7.11618489e-04 -2.70486200e-03 1.19440314e-03] [ 4.52359647e-03 1.45561561e-03 -2.56695651e-03] [-4.47660757e-03 3.34913980e-03 5.11461473e-03] [ 9.35139879e-04 1.37407819e-04 -1.19439210e-03] [-7.92652557e-04 -4.70853250e-04 4.16666419e-04] [-5.28203692e-04 1.70692087e-03 2.04187863e-03] [ 5.60459675e-04 1.89987517e-03 -1.18866547e-03] [-3.64307174e-03 -9.88882134e-04 -2.79250624e-04] [ 3.63349278e-03 -1.21789447e-03 4.49727086e-04] [ 1.61707133e-03 -2.32204783e-03 -2.26605219e-04] [-1.66226473e-03 -1.79255243e-03 1.25671711e-03] [ 9.17713549e-06 4.38599130e-03 -3.21562293e-05] [ 7.82323215e-05 6.21279133e-03 -5.96276271e-04] [-2.15275060e-04 9.45057423e-04 3.15053379e-03] [ 2.05359256e-04 7.13640503e-04 -5.35389972e-03] [-1.77159406e-03 -2.76602532e-03 -2.98460957e-03] [ 2.06655561e-03 -3.40116429e-03 6.17395346e-03] [-4.90990474e-04 9.84279297e-04 -2.32884405e-03] [ 5.02808011e-04 1.68251278e-03 6.63317299e-04] [ 2.80433992e-03 1.60017452e-03 1.02909530e-03] [-2.75372288e-03 4.24696321e-03 -1.69890640e-03] [ 1.46002677e-03 -4.78538560e-03 4.96700342e-05] [-2.09379755e-04 -7.77778834e-05 1.08806441e-04] [-2.68252692e-03 -4.25870267e-03 1.24147660e-03] [ 2.04852676e-03 -1.01070410e-03 1.13894180e-03] [-1.90131769e-03 -3.68592161e-03 -2.46481619e-04] [-1.04496300e-03 -5.71663633e-04 1.06704980e-03] [ 1.66376582e-03 -3.42603207e-03 5.45473110e-04] [ 1.19072086e-03 -9.56000493e-04 -6.56897063e-04] [-1.03122357e-03 -1.67813436e-03 3.65156161e-03] [-3.32755335e-03 -5.11183041e-04 4.79945387e-03] [ 1.11487808e-03 7.62639412e-04 -3.42745926e-03] [ 3.03626356e-03 -2.93010700e-03 -4.60308230e-03] [ 1.66078545e-03 2.28006028e-04 -3.91862149e-04] [-1.64448470e-03 1.08173644e-04 2.16491760e-03] [-1.13111998e-03 -1.17796397e-03 1.72748666e-03] [ 7.86097419e-04 1.51526811e-03 -8.00121143e-04] [-3.16682781e-03 -7.12661562e-04 -3.66947067e-03] [ 5.29631830e-04 -4.88464470e-04 2.22554899e-03] [ 2.00994282e-03 -9.34260413e-04 2.96781429e-03] [ 2.77640064e-04 -3.92382140e-04 -3.12787205e-03] [-7.56923324e-03 -1.04590991e-04 1.63464614e-03] [ 1.71722948e-03 4.85883997e-04 -2.22991760e-03] [ 7.05275798e-03 3.93354931e-04 -1.69906453e-03] [-7.93219799e-04 5.41339718e-05 2.16633252e-03] [-6.63241732e-03 1.07981530e-03 1.75067542e-03] [-6.87536400e-04 2.55183955e-03 2.88013018e-03] [ 6.84150976e-03 -5.87923551e-04 -1.78985944e-03] [ 4.12928793e-04 4.25504439e-03 -2.84776614e-03] [-1.81453132e-03 -2.53307128e-03 -1.57911268e-03] [-2.23514836e-03 9.82592023e-04 -4.64304075e-03] [ 1.88696646e-03 -3.76892788e-03 -2.62910797e-04] [ 2.12385740e-03 2.11950528e-03 2.82702801e-03] [-2.15358488e-04 -1.66939688e-03 -1.33352307e-03] [ 1.41533986e-03 3.91635723e-03 -1.58413838e-03] [ 5.81507540e-04 -1.60515683e-03 2.22799674e-03] [-1.90841354e-03 3.77413611e-03 2.44893601e-03] [-8.63476396e-03 -1.72332708e-04 1.35751114e-03] [ 2.22671085e-03 -2.96780725e-03 5.11670787e-03] [ 8.58065342e-03 -4.08220459e-04 -1.78207756e-03] [-2.46252735e-03 -3.14616827e-03 -5.50213921e-03] [-1.05296784e-03 -1.86748415e-03 -7.22421249e-04] [ 1.12448000e-03 -3.53941587e-04 3.08911282e-03] [ 1.18948076e-03 -1.77615537e-03 -6.51976398e-05] [-1.26793643e-03 -3.75289516e-04 -3.88586638e-03] [-1.79958861e-03 6.07451102e-04 -2.66861919e-03] [ 1.73061106e-03 2.20287152e-04 3.12465148e-03] [-8.56004678e-04 2.34192491e-04 7.14972074e-04] [ 7.92672746e-04 -6.17309429e-04 8.22147973e-05] [-1.79469460e-03 6.99680769e-04 2.37050913e-03] [ 1.78410277e-03 3.10539005e-04 -3.50903856e-03] [ 2.70111987e-03 -2.76639019e-03 3.94662310e-03] [-2.67020154e-03 -3.50987910e-03 -5.52426464e-03] [ 1.33880024e-03 3.34774004e-03 -2.41551270e-03] [-1.08239560e-03 1.10004061e-02 1.08225094e-03] [ 1.54465097e-04 1.00619984e-03 -1.02264325e-03] [-1.61849781e-04 2.03046484e-03 -5.77731659e-05] [ 2.99868203e-03 -2.53119414e-03 -3.49302124e-03] [-3.13109206e-03 -2.28374114e-03 3.60644767e-03] [-2.46975372e-03 4.30773060e-03 5.17273236e-03] [ 2.69977029e-03 2.38746407e-03 -4.32103876e-03] [-6.30341614e-04 -1.33652196e-03 2.11872639e-04] [-5.25957853e-04 -2.07877351e-03 1.69443244e-03] [ 1.20542192e-03 -1.32798905e-03 -4.73504217e-04] [-1.26656255e-04 -2.07273875e-03 -1.80146081e-03] [ 1.15313341e-03 1.82088953e-03 4.48011743e-03] [-1.63052710e-03 3.38850225e-03 -1.37904955e-03] [-1.53153340e-03 2.46780482e-03 -3.74950266e-03] [ 1.84682875e-03 2.67607528e-03 1.86853868e-03]] Final stress: [-2.29113305e-05 2.14708892e-05 -4.65628843e-05 -2.28413590e-05 1.84275904e-07 9.21212828e-05] Minimization converged after 31 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 4.88901998e-04 -1.56722730e-04 -3.49610394e-05] [ 3.92805147e-04 1.60483121e-04 -4.31539492e-05] [ 5.34085978e-04 5.81781254e-05 2.19834218e-06] [ 8.81521109e-05 -5.72149506e-05 -9.41699007e-06] [ 4.23850704e-04 -1.54802965e-04 4.58488021e-05] [ 5.84401995e-04 1.35690197e-04 4.48625894e-05] [-4.57028514e-04 -2.14777031e-04 2.53528486e-04] [-2.10033760e-04 2.03275720e-04 2.41380741e-04] [ 7.44549550e-04 -1.21235901e-04 -1.64944774e-04] [-1.25167450e-05 1.13252981e-04 -1.61104291e-04] [-2.03485717e-05 1.10408093e-04 -2.13252960e-05] [-9.10580661e-04 -1.21962593e-04 -2.78691108e-05] [-2.76613563e-04 -2.72940869e-05 1.63022387e-04] [ 6.83304222e-04 1.62880203e-05 1.40190963e-04] [-6.68267033e-04 2.09795556e-04 8.68566401e-05] [ 9.39649200e-04 -2.15086614e-04 8.59849333e-05] [ 1.77901719e-04 -1.11767615e-05 4.96592959e-05] [-4.12073309e-04 1.33825618e-05 5.18941366e-05] [ 3.75030658e-04 -3.12635227e-05 -5.30106045e-05] [-1.60191788e-04 3.05862381e-05 -5.65140103e-05] [-2.74236009e-04 4.30932336e-05 1.03981831e-04] [-3.54235683e-04 -5.07908785e-05 1.02856179e-04] [-3.77035882e-04 2.11741724e-04 4.21572396e-05] [ 2.50332341e-04 -1.93906145e-04 4.51344682e-05] [-1.50681807e-04 2.70652584e-04 -4.11585528e-04] [ 3.25791822e-04 -2.52232104e-04 -3.69101590e-04] [-1.39168522e-04 -2.81986213e-04 -1.78347863e-04] [ 1.49057315e-05 2.73056610e-04 -1.50092750e-04] [ 4.59735600e-04 3.41116934e-06 2.33719797e-04] [-2.08895506e-04 1.15998159e-05 2.32504834e-04] [ 1.07592816e-03 1.75705319e-05 -1.20993069e-04] [ 3.18911908e-04 -9.94989475e-06 -1.35108450e-04] [-3.55073314e-05 -3.38052424e-05 -9.75301501e-06] [ 1.16606218e-04 3.95211018e-05 -8.15379335e-06] [-4.17398276e-04 8.62614184e-07 -6.25935833e-05] [ 5.00064741e-04 -1.97071814e-04 1.15556306e-04] [ 3.11399185e-04 2.11283972e-04 1.12108757e-04] [-2.92039336e-04 -6.41663255e-06 2.80187286e-04] [ 4.42090096e-04 1.69248164e-04 4.04576866e-04] [ 4.67294825e-05 -1.80660272e-04 -3.75643597e-04] [ 1.10071314e-04 2.90518404e-04 4.98650906e-04] [ 3.79477166e-04 -2.67738753e-04 -2.83240815e-04] [-5.67014780e-04 -2.90727866e-04 2.85603083e-04] [-4.19486436e-04 8.81623990e-04 -5.88734839e-04] [-3.51134375e-04 -7.22602015e-04 4.89537133e-04] [-6.21105796e-04 1.05905868e-04 -3.41172248e-04] [-2.34047337e-04 1.72526396e-04 -4.52200078e-04] [ 1.30475068e-04 -1.09263550e-04 -2.63283180e-04] [ 1.26413498e-04 7.93931084e-05 3.33738045e-04] [-2.23048833e-04 -1.45434662e-04 5.10843426e-04] [ 4.59035648e-04 1.47402783e-04 -1.51861350e-04] [-3.10656379e-04 6.23716653e-05 7.71003958e-05] [-3.40945707e-04 -1.43338466e-05 -2.65400287e-04] [ 5.26448639e-04 -1.86602586e-04 -4.07610747e-05] [ 1.59202451e-04 1.43940550e-04 1.33454951e-04] [ 3.92764082e-04 9.12627376e-04 -7.67392545e-04] [ 2.26521799e-05 -2.68925099e-04 3.79940771e-04] [ 4.89149978e-04 -7.26810067e-04 -5.03723386e-04] [ 4.44507926e-04 3.16143242e-04 2.09713451e-04] [-4.60114357e-04 7.20569999e-04 -3.07768359e-04] [-4.28688654e-04 -8.91144413e-04 3.20827014e-04] [ 4.06851912e-04 -1.52155209e-04 -1.77108334e-04] [-3.83382939e-04 8.12987952e-04 2.81150575e-04] [ 3.23022295e-04 5.02409657e-05 -4.20974385e-04] [ 4.45519901e-04 -1.68314483e-04 2.17206516e-04] [-4.77336820e-04 -7.04971955e-04 -4.63897820e-04] [ 6.15157994e-04 -1.95512830e-05 4.20274219e-04] [-5.50066610e-04 -2.95080878e-04 2.86310020e-04] [-5.56631935e-04 3.72899796e-04 -2.83532829e-04] [ 6.26367360e-04 -5.09015635e-05 -4.58865505e-04] [-2.58379343e-04 7.38983366e-04 4.40691356e-04] [-8.82085817e-05 -2.79639401e-04 -2.23416953e-04] [-2.38155845e-04 -1.28597454e-04 4.08433064e-04] [-9.42402095e-05 -2.74540234e-04 -2.47098002e-04] [ 4.68353972e-04 1.67285336e-04 2.50381145e-04] [ 1.92523995e-04 -4.58985075e-04 4.42206728e-05] [ 1.85351572e-04 3.32526348e-04 2.48744965e-05] [ 4.87444456e-04 -4.74351503e-05 -2.09899783e-04] [ 2.82341598e-04 -1.68322316e-04 1.48489430e-04] [-5.34799774e-04 1.50519013e-04 1.12424895e-04] [ 8.67840595e-04 1.95290705e-05 5.45624071e-06] [-1.01589922e-03 -2.30407411e-05 6.46628178e-06] [-2.26366535e-04 1.01209338e-04 -7.95381284e-05] [-1.79080144e-04 -1.04267574e-04 -8.21855979e-05] [ 7.98158024e-04 2.36461931e-04 -1.97066014e-04] [-7.25149367e-04 -2.49745639e-04 -2.13364084e-04] [-5.39886476e-04 7.33416176e-05 6.66879498e-06] [-2.34199588e-04 -3.70550297e-05 -2.91856116e-06] [-1.35165981e-03 -4.43128653e-05 4.33124202e-06] [ 5.33403269e-04 3.22978284e-05 1.21186732e-05] [-2.32120538e-04 -4.63627295e-05 6.75877471e-05] [ 9.52266082e-05 4.87150068e-05 5.82231673e-05] [ 1.29512913e-04 -8.83652559e-05 1.14768636e-05] [-5.96222690e-04 8.45140588e-05 8.51333107e-06] [-2.46377904e-04 9.43690790e-04 -4.51316122e-04] [ 4.89975115e-04 -1.26355207e-04 -1.78967105e-04] [ 3.79521398e-04 -2.05685769e-04 4.37041926e-05] [-1.54563874e-04 -6.38155734e-04 3.20846653e-04] [-6.47989043e-04 -2.07848552e-04 -2.95870919e-04] [-2.96838222e-04 4.04981836e-05 5.36699212e-04] [-5.05522731e-04 3.55870300e-04 -1.82565026e-04] [-3.95726352e-04 -2.36347108e-04 7.33627789e-04]] Final stress: [-6.20414041e-07 -1.77169955e-06 -8.79199023e-06 -3.68007059e-10 2.00358470e-06 -6.77425333e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 2.63894224e-04 -3.36234967e-05 -1.50024740e-05] [ 3.93706418e-04 2.90393866e-05 -7.03135125e-06] [ 9.74856226e-05 3.52792417e-05 -1.27940979e-05] [ 5.55699629e-04 -3.55096987e-05 -2.81736162e-06] [ 6.27399338e-04 -1.48775627e-04 6.04206216e-05] [ 4.05559748e-04 1.66041090e-04 6.13191023e-05] [-9.24101525e-05 -2.94133241e-04 3.44641152e-04] [-5.25279935e-04 3.05717612e-04 3.59294257e-04] [ 1.17584607e-06 -9.54600170e-05 -1.68381232e-04] [ 6.18139110e-04 1.04174619e-04 -1.73570542e-04] [-8.87099018e-04 1.34048690e-04 -1.33614937e-05] [-3.75215831e-05 -1.23404431e-04 -7.23854696e-06] [ 5.04153287e-04 -1.23055785e-05 2.05537119e-04] [-3.32261767e-04 2.20510431e-05 2.30006393e-04] [ 8.02734441e-04 2.03565813e-04 1.69205535e-04] [-5.75977444e-04 -1.98206565e-04 1.72261550e-04] [-3.34746383e-04 -4.71060537e-06 5.51977834e-05] [ 1.12498561e-04 3.30011054e-06 5.32159580e-05] [-2.16569546e-04 -2.58699193e-05 -8.86435802e-05] [ 3.22275380e-04 2.65973795e-05 -8.56288679e-05] [-4.11834940e-04 5.51265450e-05 1.06172565e-04] [-1.56172162e-04 -5.01608125e-05 1.10961626e-04] [ 1.80796941e-04 3.21718113e-04 6.73470805e-05] [-5.79244161e-04 -3.43107054e-04 6.46416581e-05] [ 3.82699373e-04 3.10523368e-04 -4.13581371e-04] [ 1.45785600e-04 -3.35052876e-04 -4.64589011e-04] [ 8.32733924e-05 -3.33555730e-04 -2.20965584e-04] [-1.28692157e-04 3.44684833e-04 -2.51873313e-04] [-3.04804249e-04 4.70929019e-06 2.40799575e-04] [ 4.57488127e-04 -1.73303473e-05 2.41382364e-04] [ 4.97542430e-05 -9.58075462e-06 -1.30632050e-04] [ 5.62932695e-04 9.19787400e-07 -1.16540517e-04] [ 8.94542402e-05 -6.87354865e-05 -3.57512767e-05] [-1.61488568e-04 6.40236211e-05 -3.79475878e-05] [ 2.33641493e-04 -2.66474908e-04 1.74219020e-04] [-2.71399995e-04 -5.49160876e-05 3.43551000e-04] [-4.25886456e-04 4.99819532e-05 -9.50228869e-05] [ 4.42793003e-04 2.65440241e-04 8.68003196e-05] [ 1.42540671e-04 -1.66653484e-04 3.67820175e-04] [ 2.43090115e-04 2.20515280e-04 -4.22175345e-04] [ 2.89766815e-04 -1.74437074e-04 4.98709102e-04] [ 9.18392915e-05 1.05916399e-04 -2.87270877e-04] [-2.78845603e-04 7.32179417e-04 4.78488775e-04] [-5.65459500e-04 -1.52382814e-04 -2.99215583e-04] [-5.21658099e-04 3.32679380e-04 2.46793530e-04] [-3.33226707e-04 -8.91384596e-04 -5.68332358e-04] [ 2.01597525e-04 -1.30769032e-04 3.32150302e-04] [-1.49621723e-04 1.49500463e-04 4.76930855e-04] [-1.92484066e-04 -2.45706653e-04 -3.48357016e-04] [ 2.34828257e-04 2.27584930e-04 -1.95350805e-04] [-3.25743449e-04 -6.97158197e-05 -2.87955975e-04] [ 4.61869418e-04 4.36594800e-05 3.21698179e-05] [ 3.82931340e-04 2.40589921e-05 -2.60674289e-04] [-2.80352710e-04 -4.53499824e-06 6.36035899e-05] [-9.75489211e-05 -4.55839970e-06 2.05894775e-04] [ 6.21264284e-04 6.61829149e-04 -4.58745125e-04] [ 1.57965178e-04 3.93809689e-05 5.36105014e-05] [ 4.10160950e-04 -7.53143578e-04 -6.28502512e-04] [-3.34159586e-04 8.34351304e-04 2.68174775e-04] [ 4.33571871e-04 9.85484727e-05 -1.61030107e-04] [ 4.66613001e-04 -2.66465330e-04 1.70225768e-04] [-3.59426762e-04 -6.57870090e-04 -2.78417050e-04] [ 2.48148866e-04 2.35513524e-04 4.69357536e-05] [-3.99439142e-04 5.43416393e-04 -6.60017417e-04] [-2.80373424e-04 -7.13817010e-04 3.96179015e-04] [ 9.97910825e-05 -5.38420137e-05 -3.31725092e-04] [-4.76213576e-04 -3.80108461e-04 -3.18004175e-04] [ 3.61723361e-04 1.18162303e-04 -4.26441562e-04] [ 3.65543049e-04 -2.26089164e-05 4.08735726e-04] [-4.87556718e-04 2.78247385e-04 3.44611163e-04] [-3.84760375e-04 1.95724605e-04 3.63790710e-04] [ 1.26272603e-04 2.72807234e-04 -1.50355877e-04] [-1.03972841e-04 -7.21321648e-04 3.33453970e-04] [-1.66424213e-04 1.96360832e-04 -1.89551161e-04] [ 1.29007305e-04 -2.25582057e-04 1.14107416e-04] [ 5.24318172e-04 9.05179286e-05 -1.54175882e-04] [ 4.98572108e-04 -2.28574582e-04 2.52346025e-04] [ 1.43015025e-04 3.69555407e-04 8.06334244e-06] [-3.78608102e-04 -1.70348789e-04 1.10480694e-04] [ 3.10665466e-04 1.92311941e-04 1.47996426e-04] [-8.22748817e-04 2.55379300e-05 4.44370309e-06] [ 6.90234594e-04 -2.27625666e-05 2.30527472e-06] [-1.50628515e-04 1.15880944e-04 -1.03264118e-04] [-2.02336611e-04 -1.14834082e-04 -1.01349026e-04] [-4.60290854e-04 3.20208498e-04 -2.66120690e-04] [ 6.94228579e-04 -3.08342024e-04 -2.53198244e-04] [-2.18771021e-04 -5.41426738e-05 -8.91986087e-06] [-4.79429679e-04 2.11395358e-05 -1.08206637e-06] [ 3.16349235e-04 -2.43461849e-05 -7.86276889e-07] [-1.08677016e-03 3.58474245e-05 -6.70459485e-06] [ 1.22560923e-04 -6.54642247e-05 7.49032569e-05] [-2.86018338e-04 6.34364690e-05 8.43424258e-05] [-5.50813367e-04 -1.86354586e-04 4.88145798e-06] [ 1.95149774e-04 1.96812740e-04 7.46897054e-06] [ 3.31547728e-04 2.66407801e-04 -8.67121831e-05] [-5.51202541e-05 5.91555521e-04 2.82121055e-04] [-1.43273372e-04 -8.79692274e-04 -5.16303497e-04] [ 4.35354696e-04 4.75885290e-05 -1.47762735e-04] [-2.91968792e-04 -2.43794568e-04 -1.16800175e-04] [-2.10833793e-04 4.56126690e-04 6.52221776e-04] [-5.19891732e-04 7.94553916e-05 -1.42982817e-04] [-2.77026565e-05 -2.45290236e-04 5.38722827e-04]] Final stress: [-4.24828250e-07 -2.07404501e-06 -8.38078249e-06 -4.88231942e-09 2.33951205e-06 6.23927124e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-6.00049954e-04 -2.21194119e-04 -6.27067854e-05] [-7.32803796e-04 2.23488779e-04 -4.60922672e-05] [-1.19276929e-04 9.12771622e-05 -3.64814833e-05] [-7.74348971e-04 -9.47581472e-05 -8.05606690e-06] [-8.74755741e-04 -2.15338942e-04 7.58608634e-05] [-6.31741660e-04 2.56719055e-04 7.52026471e-05] [ 3.16686375e-04 -3.37065652e-04 4.03131496e-04] [ 6.80445073e-04 3.70403719e-04 4.36093720e-04] [ 2.14595419e-05 -1.77242997e-04 -2.52750967e-04] [-1.10953433e-03 1.91989288e-04 -2.62392210e-04] [ 1.35557320e-03 2.00037960e-04 -4.27860720e-05] [ 2.34177091e-05 -1.74515755e-04 -2.63303669e-05] [-1.05467673e-03 -1.95658687e-05 2.50455886e-04] [ 3.76331180e-04 3.91362565e-05 2.87422846e-04] [-1.43211470e-03 3.44278037e-04 1.63234431e-04] [ 1.00685039e-03 -3.39145224e-04 1.65694421e-04] [ 6.37007367e-04 -2.97449270e-05 8.80079554e-05] [-2.72371155e-04 1.88706061e-05 7.78625481e-05] [ 2.50043692e-04 -4.76113058e-05 -1.05353217e-04] [-5.61194001e-04 4.90785179e-05 -1.00897080e-04] [ 5.27315074e-04 8.43954601e-05 1.63630939e-04] [ 4.33360377e-04 -6.84477793e-05 1.59394317e-04] [-3.83041700e-04 3.54465349e-04 7.13760033e-05] [ 5.44888951e-04 -3.82647610e-04 6.58104072e-05] [-4.35874627e-04 4.23045026e-04 -6.01124146e-04] [ 2.75872603e-04 -4.33269084e-04 -6.58131988e-04] [ 1.23748833e-05 -4.62488975e-04 -2.69636343e-04] [ 2.14039652e-04 4.74873144e-04 -3.18838618e-04] [ 3.30989102e-04 -1.58226514e-05 3.55113919e-04] [-6.83338925e-04 -1.88898929e-05 3.55612154e-04] [-4.96059430e-04 5.21413543e-06 -2.14293334e-04] [-1.64493694e-03 -2.34543302e-05 -1.84754952e-04] [-1.76866544e-04 -8.37725493e-05 -1.02087446e-05] [ 1.26302252e-05 6.76648572e-05 -1.14533713e-05] [-8.07079379e-04 2.71458975e-04 1.94881918e-04] [ 6.28726313e-04 -2.21075552e-05 -8.99576532e-05] [ 4.08448674e-04 2.06585480e-05 4.38472917e-04] [-4.42040614e-04 -2.92763355e-04 1.67093907e-04] [-7.92673156e-05 2.97954035e-04 -5.88300992e-04] [-6.85803075e-04 -2.62146899e-04 5.84732646e-04] [-5.81927393e-04 4.01077665e-04 -3.99157899e-04] [-1.82937916e-04 -4.54674590e-04 7.74453230e-04] [ 6.26840682e-04 -1.34123995e-03 -8.84059538e-04] [ 8.72584936e-04 4.36176805e-04 4.64682493e-04] [ 9.31855425e-04 -1.32569989e-04 -5.10600354e-04] [ 5.31245509e-04 1.09758878e-03 7.38791884e-04] [-2.31009657e-04 1.64151053e-04 -4.05222681e-04] [ 3.58779989e-04 -2.62811103e-04 -7.09865713e-04] [ 3.48834167e-04 2.09235923e-04 8.17289872e-04] [-2.38657663e-04 -9.65697513e-05 5.47150953e-04] [ 4.58753123e-04 -1.23131342e-04 1.15137133e-04] [-6.55712970e-04 -2.57981347e-04 -2.31863317e-04] [-8.04354703e-04 3.30873868e-04 -7.71353920e-05] [ 5.20004328e-04 2.75729467e-05 -4.18729149e-04] [-6.55338432e-04 -1.45422086e-03 -1.18862498e-03] [-1.86276623e-04 -1.76025076e-04 1.82918932e-04] [-7.78347677e-04 1.15953915e-03 -7.83627313e-04] [ 9.56095401e-06 3.61243033e-04 5.64099668e-04] [ 6.88597503e-04 -1.10477379e-03 -4.77952569e-04] [-6.47804330e-04 -4.81133823e-04 3.21132190e-04] [-5.97018448e-04 2.31136049e-04 -2.80438723e-04] [ 6.51168500e-04 1.37110413e-03 4.76410275e-04] [-4.92484151e-04 -6.74972411e-05 -6.63491018e-04] [ 5.81677001e-04 -1.23495555e-03 3.66458845e-04] [ 7.53453429e-04 1.04490288e-03 -6.85377716e-04] [-7.14804136e-04 2.74703897e-04 3.01572514e-04] [ 8.26986208e-04 4.42225804e-04 4.13999022e-04] [-9.68541761e-04 3.83532999e-05 6.34736039e-04] [-9.72275989e-04 8.42346678e-05 -6.98249862e-04] [ 8.29634241e-04 -5.78386427e-04 -4.06008885e-04] [ 1.01524369e-04 4.47675745e-04 -3.38889360e-04] [ 4.53795879e-04 -1.14769763e-03 6.88735114e-04] [ 1.41216251e-04 3.70671502e-04 -3.84650440e-04] [ 3.85473111e-04 2.19274368e-04 6.25054945e-04] [-2.88003400e-04 7.20763447e-04 9.79700566e-05] [-6.98285235e-04 -2.43297706e-04 3.96455598e-04] [-7.34002552e-04 4.62633370e-05 -3.13643397e-04] [-2.83809203e-04 -5.10615508e-04 3.91475908e-05] [ 8.18832057e-04 -2.55498405e-04 1.84971183e-04] [-4.17491549e-04 2.78899590e-04 2.51998435e-04] [ 1.53816554e-03 3.92317889e-05 7.41660106e-06] [-1.31558070e-03 -3.25550410e-05 3.96781612e-06] [ 2.85759688e-04 1.69531926e-04 -1.31739368e-04] [ 3.42219112e-04 -1.60485425e-04 -1.25741610e-04] [ 1.12274394e-03 4.28615138e-04 -3.63532133e-04] [-1.20980807e-03 -4.09696464e-04 -3.32809715e-04] [ 3.75996472e-04 -1.03872165e-05 -1.28069581e-05] [ 7.99597593e-04 -8.00570146e-05 1.05084537e-05] [-8.23102334e-04 -4.98859048e-05 2.08952229e-05] [ 2.05160267e-03 7.42412650e-05 4.36731864e-06] [-1.36818133e-04 -7.88946160e-05 9.58536034e-05] [ 3.39194022e-04 7.51401601e-05 1.13504223e-04] [ 9.41419678e-04 -1.59109051e-04 8.24429583e-06] [-1.79567392e-04 1.55083462e-04 1.70961154e-05] [-7.61382580e-04 2.34328064e-04 -3.00544906e-04] [ 3.85239618e-04 -1.43075585e-03 -6.87503380e-04] [ 2.27147826e-04 9.40198520e-04 4.46687030e-04] [-5.63702736e-04 3.09514135e-04 4.99398776e-05] [ 4.31388775e-04 -6.52314383e-05 8.50179691e-04] [ 9.89752735e-04 3.77465947e-04 -4.17186025e-04] [ 5.53395342e-04 3.84103557e-04 1.16367861e-03] [ 7.85321188e-04 -6.07999080e-04 -2.54591714e-04]] Final stress: [-5.77506572e-07 -1.61015145e-06 -1.17237175e-05 2.05980077e-08 1.90074916e-06 -1.04824716e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-7.08291273e-04 -1.32609119e-04 -5.20727567e-05] [-5.02554840e-04 1.19013596e-04 -6.60379789e-05] [-7.95059342e-04 5.34965530e-05 1.93555864e-05] [-1.43054596e-04 -4.88524328e-05 -1.04554176e-05] [-5.89177570e-04 -2.06781794e-04 3.43494157e-05] [-8.84155586e-04 1.70364360e-04 3.62894701e-05] [ 6.45411920e-04 -1.20940985e-04 1.70534820e-04] [ 2.24047282e-04 8.46869623e-05 1.38679873e-04] [-1.05875250e-03 -1.16601565e-04 -1.76951101e-04] [ 4.07823287e-05 1.05781333e-04 -1.69331378e-04] [ 9.49526855e-06 1.22217030e-04 -4.92996405e-05] [ 1.29314214e-03 -1.44219947e-04 -6.62407239e-05] [ 3.58084302e-04 -4.93970215e-05 5.12461217e-05] [-9.20886071e-04 3.41901434e-05 3.61317727e-05] [ 9.29304333e-04 1.43097490e-04 1.26408787e-05] [-1.26506064e-03 -1.40669102e-04 1.30917977e-05] [-2.21861723e-04 4.85875821e-06 1.69690440e-05] [ 5.27406165e-04 1.13152276e-05 3.06627639e-05] [-5.09367920e-04 -2.75203592e-05 1.16465088e-05] [ 2.92395719e-04 2.72664779e-05 9.93936577e-06] [ 2.57553417e-04 2.84540966e-05 8.19512248e-05] [ 5.49285929e-04 -4.29964556e-05 9.60248969e-05] [ 7.28499329e-04 9.84946320e-05 5.76352374e-05] [-2.53069886e-04 -8.89209244e-05 6.14736152e-05] [-5.76591255e-05 1.12183947e-04 -2.98866393e-04] [-5.15479554e-04 -1.44088502e-04 -2.97673143e-04] [ 1.48821195e-04 -1.77660818e-04 -8.32200612e-05] [-1.05923099e-04 1.78388725e-04 -5.94595988e-05] [-6.77859232e-04 1.16567099e-05 3.26020039e-04] [ 2.92557968e-04 2.32250917e-05 3.24498365e-04] [-1.33479345e-03 2.78185821e-05 -1.59752848e-04] [-4.34060015e-04 -1.08821065e-05 -1.83295710e-04] [ 1.60967495e-04 -1.60955506e-05 -1.24311449e-05] [-1.96515375e-04 3.52068976e-05 -1.26568793e-05] [ 4.43073245e-04 -5.54167761e-05 3.84435801e-04] [-3.98325783e-04 3.28843626e-04 1.36553455e-04] [-6.77086981e-04 -2.21537821e-04 9.93199962e-05] [ 5.82735650e-04 -2.22981656e-05 -1.47194064e-04] [-4.02415288e-04 -4.50782777e-04 -3.80603897e-04] [-8.58394048e-05 3.00210242e-04 5.80769990e-04] [-3.57796295e-05 -1.42530487e-04 -4.29502475e-04] [-4.57639741e-04 3.02560364e-04 5.36802216e-04] [ 8.77584286e-04 1.44481684e-04 -4.68282327e-04] [ 4.96324522e-04 -1.08911792e-03 7.03793582e-04] [ 6.15961157e-04 1.33243258e-03 -8.41009937e-04] [ 7.94895214e-04 -4.49755739e-04 4.29022048e-04] [ 2.84763374e-04 -2.10692190e-04 6.40863289e-04] [-2.42985095e-05 1.69759620e-04 4.74811396e-04] [-1.85741127e-05 -2.15539857e-04 -3.94283000e-04] [ 2.92828408e-04 2.33723038e-04 -6.00633190e-04] [-7.41050907e-04 -1.65816943e-04 2.90214376e-05] [ 5.10981675e-04 -3.56657515e-05 -3.34610467e-04] [ 4.91342859e-04 2.22788476e-05 1.55698249e-04] [-6.37338837e-04 2.04015321e-04 -2.07511334e-04] [-5.43122603e-04 -7.37223141e-04 -6.08275173e-04] [ 4.74362837e-06 -3.60899249e-04 5.23989018e-04] [-1.56233422e-04 8.54713310e-04 -8.69550437e-04] [-4.21002438e-04 3.16122008e-04 2.66336104e-04] [-6.45225080e-04 -1.59995766e-04 -2.27573035e-04] [ 5.51661380e-04 -1.26455906e-03 4.70614237e-04] [ 6.22917523e-04 1.00235880e-03 -4.29241970e-04] [-7.27331831e-04 4.07115629e-04 3.01752945e-04] [ 5.57607136e-04 -1.00970088e-03 -6.08401735e-04] [-3.84184378e-04 -1.89892198e-04 3.66332871e-04] [-3.10216630e-04 8.79126041e-05 -5.45439360e-04] [ 5.13290312e-04 1.10118284e-03 4.62168471e-04] [-7.41132463e-04 -1.14341608e-04 -6.50977742e-04] [ 8.28419592e-04 4.88410949e-04 -4.16442045e-04] [ 7.87528655e-04 -4.64291111e-04 4.36584604e-04] [-7.13859534e-04 1.00406901e-04 6.30889977e-04] [-1.67237546e-05 -3.44588104e-04 -3.22428204e-04] [ 3.39963891e-04 -1.21658800e-04 5.56700798e-04] [ 3.23180300e-04 -2.59223215e-04 -3.54501692e-04] [ 2.45162830e-05 8.04878739e-04 5.35734603e-04] [-7.70552154e-04 -1.45120394e-04 -3.67304381e-04] [-2.20512886e-04 4.64302347e-04 6.73818926e-05] [-2.48101660e-04 -5.52602069e-04 -9.66225132e-05] [-7.10103397e-04 2.22582929e-04 2.96319178e-04] [-3.44668548e-04 -9.73350848e-05 1.63187270e-04] [ 7.05392592e-04 9.85401696e-05 1.19411109e-04] [-1.19145433e-03 2.77657649e-05 2.52884394e-05] [ 1.37799005e-03 -3.31840017e-05 2.74159506e-05] [ 3.08314174e-04 9.58251150e-05 -9.41448203e-05] [ 2.49067341e-04 -1.07850713e-04 -1.00062210e-04] [-1.17377043e-03 1.48004978e-04 -1.73915529e-04] [ 7.36570835e-04 -1.56438391e-04 -1.96836045e-04] [ 8.50655121e-04 8.56686327e-05 -1.48391980e-05] [ 8.99207988e-05 5.11833163e-06 -4.09034377e-05] [ 1.77905677e-03 -7.23712741e-05 -1.62816539e-05] [-6.60766791e-04 5.22222917e-05 -3.88770449e-07] [ 3.64429641e-04 -2.14483007e-05 6.25330367e-05] [-1.99262326e-04 2.37565287e-05 4.87602435e-05] [-3.37123516e-04 -3.63450861e-06 4.49899639e-05] [ 5.81233706e-04 2.63145033e-05 3.69304746e-05] [ 2.72197528e-04 -9.73583679e-04 5.95638449e-04] [-5.57202076e-04 -3.23687708e-04 5.85998392e-05] [-6.26303893e-04 -1.32770386e-05 -7.47149545e-05] [ 3.06284049e-04 1.26913559e-03 -5.99770906e-04] [ 6.13395403e-04 -3.58583707e-04 8.19108748e-04] [ 5.23262914e-04 2.66490915e-04 -3.80173171e-04] [ 3.88056631e-04 1.77759720e-05 5.91613663e-04] [ 8.02883687e-04 1.62533363e-05 -5.18349694e-04]] Final stress: [-1.49482315e-06 -5.99266512e-07 -1.21940422e-05 -3.69642792e-08 1.71651513e-06 1.03662202e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 7.39245439e-04 -9.75059098e-05 -7.79081033e-05] [-7.39245438e-04 9.75059141e-05 -7.79081049e-05] [ 7.49685401e-04 8.43298882e-05 7.32491960e-05] [-7.49685400e-04 -8.43298898e-05 7.32491965e-05] [ 9.49186924e-04 -1.41398090e-04 5.34170566e-05] [-9.49186923e-04 1.41398089e-04 5.34170552e-05] [-1.71665920e-03 1.36241715e-05 -5.66784347e-05] [ 1.71665920e-03 -1.36241730e-05 -5.66784351e-05] [-5.08537419e-04 7.38965267e-05 6.41164929e-05] [ 5.08537419e-04 -7.38965302e-05 6.41164935e-05] [ 2.79120616e-04 1.33568178e-04 -1.37342627e-04] [-2.79120616e-04 -1.33568179e-04 -1.37342626e-04] [-1.47432694e-04 5.34989140e-05 2.68399404e-05] [ 1.47432695e-04 -5.34989135e-05 2.68399377e-05] [-1.94034071e-03 3.28124889e-04 4.24049332e-04] [ 1.94034071e-03 -3.28124893e-04 4.24049331e-04] [-1.20037829e-04 7.96277758e-05 -3.70785213e-05] [ 1.20037830e-04 -7.96277758e-05 -3.70785201e-05] [-2.65789509e-04 -1.73992785e-04 5.20476826e-05] [ 2.65789509e-04 1.73992788e-04 5.20476858e-05] [ 1.73828732e-03 4.85912875e-05 1.99822239e-05] [-1.73828732e-03 -4.85912870e-05 1.99822244e-05] [-6.67763011e-04 -9.93332946e-05 1.11279435e-05] [ 6.67763011e-04 9.93333025e-05 1.11279428e-05] [-3.15304025e-04 -2.05865870e-04 -6.98176401e-05] [ 3.15304028e-04 2.05865869e-04 -6.98176426e-05] [-3.41306363e-04 -2.72106921e-04 -4.69236589e-04] [ 3.41306362e-04 2.72106918e-04 -4.69236591e-04] [ 1.28653703e-03 1.52418004e-04 2.83585740e-04] [-1.28653703e-03 -1.52418002e-04 2.83585740e-04] [-3.30324280e-04 -1.19952335e-04 -1.81431251e-04] [ 3.30324282e-04 1.19952335e-04 -1.81431251e-04] [-1.32289754e-03 -1.81024564e-04 -5.18673295e-05] [ 1.32289754e-03 1.81024565e-04 -5.18673262e-05] [-1.03721464e-03 1.25547561e-03 5.17660897e-05] [ 1.03721464e-03 -1.25547561e-03 5.17660900e-05] [ 8.16714059e-04 1.30973303e-03 2.20555438e-04] [-8.16714058e-04 -1.30973303e-03 2.20555440e-04] [ 3.00743305e-04 -3.89351941e-04 1.50415496e-03] [-3.00743304e-04 3.89351942e-04 1.50415496e-03] [-5.32585676e-04 -2.34768921e-04 -1.16932043e-03] [ 5.32585677e-04 2.34768923e-04 -1.16932043e-03] [-5.13622083e-04 -1.12931399e-03 -1.17839888e-03] [ 5.13622083e-04 1.12931399e-03 -1.17839888e-03] [ 4.78947984e-04 -5.94423289e-04 1.14583008e-03] [-4.78947984e-04 5.94423287e-04 1.14583008e-03] [-8.44406928e-04 1.00590492e-03 1.20887876e-03] [ 8.44406927e-04 -1.00590492e-03 1.20887876e-03] [ 7.79912626e-04 8.40304924e-04 -1.24989159e-03] [-7.79912627e-04 -8.40304922e-04 -1.24989159e-03] [-2.77790229e-04 -6.51556444e-04 -9.62052372e-04] [ 2.77790228e-04 6.51556444e-04 -9.62052371e-04] [ 8.84665435e-05 -6.66641621e-04 7.24563220e-04] [-8.84665436e-05 6.66641623e-04 7.24563223e-04] [ 7.55302996e-04 -9.81240637e-04 3.45712487e-04] [-7.55302995e-04 9.81240635e-04 3.45712487e-04] [-1.22582720e-03 -9.75620580e-04 -2.77598884e-04] [ 1.22582720e-03 9.75620579e-04 -2.77598882e-04] [ 1.25926161e-03 4.48080278e-04 -1.18056700e-04] [-1.25926161e-03 -4.48080279e-04 -1.18056700e-04] [-1.28174090e-03 1.19485313e-04 1.03919462e-04] [ 1.28174090e-03 -1.19485312e-04 1.03919462e-04] [ 6.39017754e-04 5.14998641e-04 1.92911783e-03] [-6.39017756e-04 -5.14998642e-04 1.92911783e-03] [-9.71341420e-04 5.96015182e-04 -2.09915076e-03] [ 9.71341422e-04 -5.96015182e-04 -2.09915076e-03] [ 1.93560646e-05 1.12803546e-04 6.09959961e-04] [-1.93560655e-05 -1.12803546e-04 6.09959961e-04] [ 3.09721073e-04 2.90368336e-04 -2.77004508e-04] [-3.09721077e-04 -2.90368336e-04 -2.77004507e-04] [ 1.43066112e-03 8.86926670e-04 -1.01853192e-03] [-1.43066112e-03 -8.86926673e-04 -1.01853191e-03] [-1.67287131e-03 9.70855115e-04 8.21713610e-04] [ 1.67287131e-03 -9.70855117e-04 8.21713608e-04] [ 2.37567787e-04 1.74905119e-04 -1.02423424e-03] [-2.37567784e-04 -1.74905117e-04 -1.02423424e-03] [ 7.00386915e-05 5.61860373e-05 7.72103137e-04] [-7.00386914e-05 -5.61860372e-05 7.72103138e-04] [ 9.13767960e-04 9.06191402e-05 -1.23466511e-04] [-9.13767959e-04 -9.06191387e-05 -1.23466513e-04] [-8.09073507e-04 1.38544401e-05 5.73513415e-05] [ 8.09073507e-04 -1.38544409e-05 5.73513423e-05] [ 5.93030752e-04 1.26585351e-04 -2.55650775e-04] [-5.93030754e-04 -1.26585350e-04 -2.55650775e-04] [-7.30404626e-04 1.24564728e-05 2.51386868e-05] [ 7.30404626e-04 -1.24564725e-05 2.51386855e-05] [-2.21709432e-05 -4.01889116e-05 -6.90511790e-05] [ 2.21709410e-05 4.01889086e-05 -6.90511759e-05] [ 1.55313875e-03 -5.94335569e-05 -1.25989218e-04] [-1.55313875e-03 5.94335583e-05 -1.25989221e-04] [-1.86255950e-03 -1.91090703e-04 9.02376910e-05] [ 1.86255950e-03 1.91090703e-04 9.02376913e-05] [-5.62412110e-05 2.08942191e-04 8.89135467e-05] [ 5.62412100e-05 -2.08942198e-04 8.89135466e-05] [ 8.72599145e-04 -2.98879083e-04 -5.15424258e-04] [-8.72599145e-04 2.98879085e-04 -5.15424257e-04] [-7.69104966e-04 -4.51310546e-04 7.12472678e-04] [ 7.69104966e-04 4.51310547e-04 7.12472675e-04] [-1.31198307e-03 -1.17093384e-03 -2.10912521e-04] [ 1.31198307e-03 1.17093384e-03 -2.10912521e-04] [ 1.28215893e-03 -1.03440316e-03 3.35290661e-04] [-1.28215893e-03 1.03440316e-03 3.35290658e-04]] Final stress: [-4.29959365e-06 9.81421263e-07 -1.09729105e-05 2.81210104e-15 -5.35410653e-16 -2.50030587e-05] Minimization converged after 115 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 17 steps. Minimization converged after 15 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.45927152e-03 1.35609021e-03 1.08159983e-05] [-1.45927151e-03 -1.35609021e-03 1.08159977e-05] [ 1.47064667e-03 6.94290525e-04 -9.16171663e-04] [-1.47064666e-03 -6.94290526e-04 -9.16171672e-04] [ 1.23601761e-03 -4.45837928e-04 -6.62255184e-04] [-1.23601761e-03 4.45837930e-04 -6.62255175e-04] [-2.84409632e-03 4.74913951e-05 -1.29495979e-03] [ 2.84409632e-03 -4.74913860e-05 -1.29495979e-03] [-3.79753103e-05 4.49636207e-03 -1.42773393e-03] [ 3.79753050e-05 -4.49636206e-03 -1.42773393e-03] [-7.94661857e-05 -1.02570087e-03 -7.72875821e-04] [ 7.94661866e-05 1.02570086e-03 -7.72875809e-04] [-2.12293225e-03 -2.19176737e-05 -2.77646273e-04] [ 2.12293226e-03 2.19176774e-05 -2.77646288e-04] [-2.08196836e-03 6.56485715e-04 3.07372268e-03] [ 2.08196835e-03 -6.56485729e-04 3.07372270e-03] [ 7.85869135e-05 1.19555164e-03 -9.67869327e-04] [-7.85869240e-05 -1.19555163e-03 -9.67869319e-04] [-2.15509662e-04 -1.96735167e-03 8.65886359e-04] [ 2.15509664e-04 1.96735167e-03 8.65886372e-04] [ 4.10073694e-03 -3.84892992e-03 1.80284691e-03] [-4.10073693e-03 3.84892992e-03 1.80284691e-03] [-3.93279649e-03 6.54263143e-04 7.40505677e-05] [ 3.93279650e-03 -6.54263133e-04 7.40505696e-05] [ 1.28189629e-03 -4.06532213e-04 -3.82450191e-04] [-1.28189628e-03 4.06532206e-04 -3.82450199e-04] [-4.49449907e-04 -1.24615732e-04 -2.31473383e-03] [ 4.49449906e-04 1.24615725e-04 -2.31473382e-03] [ 1.57993962e-03 3.85302891e-03 6.99758638e-04] [-1.57993963e-03 -3.85302890e-03 6.99758640e-04] [ 1.99690203e-04 -3.36370560e-03 9.75296871e-04] [-1.99690200e-04 3.36370560e-03 9.75296865e-04] [-3.11306114e-03 -9.72756111e-04 -5.13917638e-04] [ 3.11306113e-03 9.72756108e-04 -5.13917633e-04] [-2.28736856e-03 3.82430050e-04 8.64473738e-04] [ 2.28736855e-03 -3.82430057e-04 8.64473743e-04] [ 3.81637557e-05 2.01499111e-03 3.50653540e-03] [-3.81637576e-05 -2.01499111e-03 3.50653540e-03] [-1.35031385e-03 4.31584442e-04 3.67698752e-03] [ 1.35031385e-03 -4.31584438e-04 3.67698752e-03] [ 4.13126136e-04 -8.48227051e-04 -1.39023165e-03] [-4.13126136e-04 8.48227044e-04 -1.39023164e-03] [-2.41714270e-03 -5.90443559e-03 -2.22583339e-03] [ 2.41714270e-03 5.90443558e-03 -2.22583339e-03] [-6.35807072e-04 3.97657652e-04 2.00837447e-03] [ 6.35807074e-04 -3.97657659e-04 2.00837448e-03] [-1.74367089e-03 2.65715379e-03 2.45073718e-03] [ 1.74367090e-03 -2.65715379e-03 2.45073718e-03] [ 7.10341324e-07 3.03098893e-04 -2.02944414e-03] [-7.10352806e-07 -3.03098885e-04 -2.02944413e-03] [ 8.30536880e-04 2.77541652e-04 -3.20251845e-03] [-8.30536883e-04 -2.77541665e-04 -3.20251845e-03] [-1.22910460e-03 -1.07564087e-03 -1.72854188e-03] [ 1.22910460e-03 1.07564087e-03 -1.72854189e-03] [ 5.57069535e-05 -4.74412517e-04 3.99777982e-03] [-5.57069425e-05 4.74412527e-04 3.99777982e-03] [-3.27699341e-03 8.10842450e-04 4.56959692e-04] [ 3.27699340e-03 -8.10842438e-04 4.56959702e-04] [ 6.09904514e-04 2.61664534e-03 -6.86674241e-04] [-6.09904519e-04 -2.61664534e-03 -6.86674236e-04] [-3.39836739e-03 -1.79174872e-03 -1.79423946e-04] [ 3.39836739e-03 1.79174873e-03 -1.79423943e-04] [ 2.17028761e-04 1.36311342e-03 4.05094563e-03] [-2.17028762e-04 -1.36311341e-03 4.05094564e-03] [-1.66784814e-03 1.28858389e-03 -6.18291957e-03] [ 1.66784813e-03 -1.28858389e-03 -6.18291957e-03] [-7.85885344e-04 -1.05962396e-03 2.51148295e-03] [ 7.85885341e-04 1.05962396e-03 2.51148295e-03] [-1.96556378e-04 3.53906045e-04 -4.63334810e-04] [ 1.96556372e-04 -3.53906055e-04 -4.63334813e-04] [ 3.83804657e-03 -1.47242023e-03 -2.85455287e-03] [-3.83804656e-03 1.47242024e-03 -2.85455286e-03] [-7.22397895e-03 -1.33827402e-04 -1.23926709e-03] [ 7.22397896e-03 1.33827399e-04 -1.23926710e-03] [ 1.72675871e-03 -2.79548453e-04 -2.10386347e-03] [-1.72675872e-03 2.79548450e-04 -2.10386347e-03] [-1.13728849e-03 7.52458279e-04 9.16574032e-04] [ 1.13728849e-03 -7.52458290e-04 9.16574024e-04] [ 8.41892749e-04 1.14031455e-03 1.50729175e-05] [-8.41892758e-04 -1.14031456e-03 1.50729051e-05] [-5.19423058e-04 9.05850796e-04 8.00271518e-04] [ 5.19423056e-04 -9.05850799e-04 8.00271511e-04] [-7.67692797e-04 1.79179764e-03 -1.95882408e-03] [ 7.67692798e-04 -1.79179763e-03 -1.95882409e-03] [-1.83286266e-03 -1.04998983e-03 -5.53528302e-04] [ 1.83286266e-03 1.04998983e-03 -5.53528306e-04] [ 8.08168014e-04 -8.75097833e-04 -1.00919523e-03] [-8.08168021e-04 8.75097826e-04 -1.00919522e-03] [ 1.69825816e-03 -1.11161523e-03 -1.05723964e-03] [-1.69825815e-03 1.11161523e-03 -1.05723965e-03] [-3.88309940e-03 -2.02740216e-03 9.59315666e-04] [ 3.88309940e-03 2.02740217e-03 9.59315655e-04] [ 8.56081903e-04 3.14290003e-04 1.84088242e-03] [-8.56081904e-04 -3.14290002e-04 1.84088242e-03] [ 2.82493672e-03 -2.33824284e-03 -4.68220028e-04] [-2.82493672e-03 2.33824285e-03 -4.68220033e-04] [ 1.51112284e-03 -2.93543479e-04 6.04209169e-04] [-1.51112284e-03 2.93543494e-04 6.04209174e-04] [-8.57207599e-04 1.09319816e-04 1.16431580e-03] [ 8.57207609e-04 -1.09319817e-04 1.16431580e-03] [ 3.57031790e-03 -1.97511538e-04 1.53693046e-03] [-3.57031790e-03 1.97511532e-04 1.53693046e-03]] Final stress: [ 2.45710008e-06 2.90240435e-05 -3.77337284e-05 5.14727705e-15 -1.95995690e-14 -7.58747025e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.78568335e-04 2.09999187e-04 -2.69286721e-05] [ 2.78568336e-04 -2.09999192e-04 -2.69286712e-05] [-2.69374518e-04 2.45389542e-05 1.78184603e-05] [ 2.69374519e-04 -2.45389533e-05 1.78184613e-05] [-2.54828012e-04 4.13960645e-05 -1.49311427e-04] [ 2.54828011e-04 -4.13960655e-05 -1.49311427e-04] [ 4.90983637e-04 -8.01144431e-05 -5.61859711e-05] [-4.90983638e-04 8.01144450e-05 -5.61859673e-05] [-5.11849769e-05 7.17151697e-04 -3.66745870e-04] [ 5.11849767e-05 -7.17151697e-04 -3.66745870e-04] [-3.70705281e-05 -2.01458361e-04 -1.07223864e-04] [ 3.70705273e-05 2.01458360e-04 -1.07223865e-04] [ 3.09633951e-04 4.70590635e-05 -6.83315410e-05] [-3.09633952e-04 -4.70590617e-05 -6.83315424e-05] [ 5.44630896e-04 -1.17909026e-04 6.19363010e-04] [-5.44630896e-04 1.17909029e-04 6.19363014e-04] [ 2.40528396e-05 3.01604863e-04 -2.45141132e-04] [-2.40528387e-05 -3.01604863e-04 -2.45141133e-04] [-3.04135243e-05 -3.11148508e-04 1.32766343e-04] [ 3.04135249e-05 3.11148509e-04 1.32766342e-04] [-6.60817703e-04 -5.56724891e-04 4.94014075e-04] [ 6.60817704e-04 5.56724891e-04 4.94014073e-04] [ 6.18631475e-04 1.56948105e-04 1.47312860e-04] [-6.18631474e-04 -1.56948099e-04 1.47312859e-04] [-1.30520431e-04 -1.38698890e-04 -2.08907742e-04] [ 1.30520432e-04 1.38698891e-04 -2.08907742e-04] [ 1.55916084e-05 1.93989204e-04 -3.84751668e-04] [-1.55916090e-05 -1.93989205e-04 -3.84751670e-04] [-3.53743749e-04 6.09184006e-04 1.58613894e-04] [ 3.53743747e-04 -6.09184005e-04 1.58613893e-04] [ 3.91872828e-06 -5.80273986e-04 1.76078954e-04] [-3.91873026e-06 5.80273987e-04 1.76078955e-04] [ 5.05980911e-04 -5.65993079e-05 -1.55762128e-04] [-5.05980911e-04 5.65993092e-05 -1.55762129e-04] [ 1.43490072e-04 -3.57651661e-04 6.47054903e-04] [-1.43490071e-04 3.57651660e-04 6.47054904e-04] [-3.07471608e-04 -2.18559993e-04 2.42073935e-04] [ 3.07471608e-04 2.18559993e-04 2.42073935e-04] [-1.90379474e-05 1.44456226e-04 -1.71020593e-04] [ 1.90379471e-05 -1.44456224e-04 -1.71020591e-04] [-1.56392807e-04 -1.75663246e-04 5.04091745e-04] [ 1.56392809e-04 1.75663246e-04 5.04091745e-04] [-5.68989499e-05 1.10537873e-05 2.44588742e-04] [ 5.68989513e-05 -1.10537866e-05 2.44588743e-04] [-3.45796645e-04 1.03472405e-03 -3.99528372e-04] [ 3.45796645e-04 -1.03472405e-03 -3.99528373e-04] [-4.43030024e-05 -5.32269317e-05 -3.66021960e-04] [ 4.43030000e-05 5.32269313e-05 -3.66021962e-04] [-2.64308952e-04 -4.06893425e-04 3.17677574e-04] [ 2.64308952e-04 4.06893427e-04 3.17677574e-04] [-1.53896641e-04 1.26905746e-04 -3.36916268e-04] [ 1.53896641e-04 -1.26905747e-04 -3.36916270e-04] [ 2.04158799e-04 9.44229454e-06 -6.29111200e-04] [-2.04158799e-04 -9.44229615e-06 -6.29111200e-04] [-6.02612842e-04 -1.68011586e-04 1.12314285e-04] [ 6.02612843e-04 1.68011587e-04 1.12314285e-04] [ 2.51258025e-04 6.36203392e-05 6.91609979e-04] [-2.51258027e-04 -6.36203392e-05 6.91609980e-04] [-6.35864263e-04 4.06555514e-04 -4.25178729e-05] [ 6.35864263e-04 -4.06555514e-04 -4.25178727e-05] [ 1.87131330e-04 -3.97710053e-04 -6.59235594e-05] [-1.87131332e-04 3.97710051e-04 -6.59235598e-05] [-3.21488570e-04 -3.59904819e-04 -8.02259782e-04] [ 3.21488570e-04 3.59904818e-04 -8.02259782e-04] [-7.26017094e-05 -1.95377758e-04 6.00733059e-04] [ 7.26017109e-05 1.95377755e-04 6.00733062e-04] [-2.49911971e-04 -1.43893659e-04 -2.45996136e-04] [ 2.49911969e-04 1.43893659e-04 -2.45996135e-04] [-1.27579069e-04 1.09418954e-04 4.31587123e-04] [ 1.27579071e-04 -1.09418953e-04 4.31587124e-04] [-1.01989095e-03 -7.23933498e-05 -1.38931766e-04] [ 1.01989095e-03 7.23933494e-05 -1.38931765e-04] [ 6.84496282e-04 1.25691673e-04 -4.64314062e-04] [-6.84496283e-04 -1.25691672e-04 -4.64314062e-04] [-2.65237926e-04 -1.51287823e-04 1.82531394e-04] [ 2.65237926e-04 1.51287823e-04 1.82531393e-04] [ 1.72574468e-04 4.53668359e-05 -2.70850144e-04] [-1.72574468e-04 -4.53668359e-05 -2.70850144e-04] [-1.70663862e-04 1.04015667e-04 3.55905806e-05] [ 1.70663861e-04 -1.04015667e-04 3.55905799e-05] [-8.98783633e-05 4.85987189e-05 1.46916624e-04] [ 8.98783625e-05 -4.85987185e-05 1.46916623e-04] [ 4.06982243e-05 2.82054207e-04 -3.49348817e-04] [-4.06982241e-05 -2.82054207e-04 -3.49348817e-04] [ 2.78739040e-04 -1.41138332e-04 -1.75432574e-04] [-2.78739040e-04 1.41138329e-04 -1.75432577e-04] [ 1.30050104e-04 2.20769507e-04 -2.54377235e-04] [-1.30050105e-04 -2.20769503e-04 -2.54377234e-04] [-1.08846622e-04 -5.37714785e-05 -1.48307803e-04] [ 1.08846623e-04 5.37714782e-05 -1.48307804e-04] [ 6.54823811e-04 -2.73574323e-04 8.79638858e-05] [-6.54823811e-04 2.73574321e-04 8.79638848e-05] [-2.60698586e-04 -1.07990502e-04 3.63972119e-04] [ 2.60698586e-04 1.07990495e-04 3.63972119e-04] [ 2.69520495e-04 -1.09401371e-04 6.78368108e-05] [-2.69520496e-04 1.09401372e-04 6.78368096e-05] [ 4.53019736e-04 3.30407901e-04 -2.00210567e-04] [-4.53019735e-04 -3.30407901e-04 -2.00210566e-04] [ 6.12566292e-04 2.91577961e-05 2.65899921e-04] [-6.12566292e-04 -2.91577980e-05 2.65899921e-04] [-1.51322115e-04 -6.93526733e-05 1.41948450e-04] [ 1.51322116e-04 6.93526734e-05 1.41948450e-04]] Final stress: [ 1.23902411e-05 8.77601660e-06 -4.47516982e-06 -4.76843173e-16 -4.89989225e-16 1.32192334e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 4.32596012e-04 -3.19018358e-04 -2.96071448e-04] [-4.32596011e-04 3.19018363e-04 -2.96071446e-04] [ 4.79614934e-04 -1.36496937e-04 3.53242393e-04] [-4.79614935e-04 1.36496933e-04 3.53242392e-04] [ 5.18192573e-04 -7.72441079e-04 2.14916761e-04] [-5.18192572e-04 7.72441080e-04 2.14916760e-04] [-9.94988222e-04 -1.48141732e-04 3.35124891e-04] [ 9.94988223e-04 1.48141734e-04 3.35124888e-04] [-2.04492655e-05 -1.29119281e-03 4.47783547e-04] [ 2.04492643e-05 1.29119281e-03 4.47783547e-04] [ 8.24058819e-05 8.02435302e-04 -1.04849740e-04] [-8.24058814e-05 -8.02435303e-04 -1.04849742e-04] [-4.70764776e-04 -5.85977641e-04 -2.18964430e-04] [ 4.70764775e-04 5.85977642e-04 -2.18964431e-04] [-1.10739804e-03 7.86732618e-06 -1.30454979e-03] [ 1.10739804e-03 -7.86732667e-06 -1.30454979e-03] [-1.44227530e-04 -2.55362908e-04 3.30658127e-04] [ 1.44227530e-04 2.55362909e-04 3.30658129e-04] [ 2.26976349e-04 6.92751207e-04 -6.12685298e-05] [-2.26976348e-04 -6.92751206e-04 -6.12685278e-05] [ 1.34024357e-03 1.00546088e-03 -8.16462904e-04] [-1.34024357e-03 -1.00546087e-03 -8.16462907e-04] [-1.18353698e-03 -7.20461019e-04 1.87085578e-06] [ 1.18353698e-03 7.20461015e-04 1.87085828e-06] [ 3.23748673e-04 1.82157460e-04 5.26565258e-05] [-3.23748671e-04 -1.82157457e-04 5.26565321e-05] [ 1.04002577e-04 -1.03981404e-04 9.87028616e-04] [-1.04002579e-04 1.03981403e-04 9.87028619e-04] [ 7.09390241e-04 -1.06445522e-03 9.32767157e-04] [-7.09390236e-04 1.06445522e-03 9.32767156e-04] [-9.03468290e-05 1.00456003e-03 -8.44628843e-04] [ 9.03468296e-05 -1.00456003e-03 -8.44628843e-04] [-8.89100550e-04 7.73574981e-05 -9.00904206e-05] [ 8.89100549e-04 -7.73574970e-05 -9.00904212e-05] [-2.10708605e-04 1.71752834e-04 -7.08933248e-04] [ 2.10708603e-04 -1.71752837e-04 -7.08933248e-04] [ 3.91369116e-04 9.84367236e-04 6.65470337e-05] [-3.91369114e-04 -9.84367236e-04 6.65470344e-05] [-1.23728678e-04 -5.30360425e-04 5.32990671e-04] [ 1.23728677e-04 5.30360424e-04 5.32990668e-04] [ 1.82652045e-06 5.92631650e-04 -4.74944571e-04] [-1.82652203e-06 -5.92631653e-04 -4.74944571e-04] [ 3.43163952e-04 -6.87422177e-04 -7.38818933e-04] [-3.43163952e-04 6.87422178e-04 -7.38818932e-04] [ 9.04914575e-04 -1.22800242e-03 6.15635906e-04] [-9.04914578e-04 1.22800242e-03 6.15635905e-04] [-2.44613479e-04 3.01435559e-04 5.79058375e-04] [ 2.44613481e-04 -3.01435559e-04 5.79058378e-04] [ 3.97888390e-04 4.37048174e-04 -3.66682632e-04] [-3.97888392e-04 -4.37048174e-04 -3.66682627e-04] [ 2.11141863e-04 2.00264097e-04 2.68195135e-04] [-2.11141863e-04 -2.00264097e-04 2.68195134e-04] [-3.02786928e-04 -2.83571226e-04 7.06690642e-04] [ 3.02786931e-04 2.83571223e-04 7.06690643e-04] [ 1.56711921e-03 4.62259090e-04 -4.06641560e-04] [-1.56711921e-03 -4.62259093e-04 -4.06641563e-04] [-7.60635605e-05 -2.21759704e-04 -1.43868384e-03] [ 7.60635601e-05 2.21759704e-04 -1.43868384e-03] [ 1.39409949e-03 -1.99533839e-04 1.11321205e-04] [-1.39409949e-03 1.99533840e-04 1.11321204e-04] [-6.58618825e-05 1.79944232e-04 3.51159015e-04] [ 6.58618823e-05 -1.79944231e-04 3.51159015e-04] [-3.86607099e-05 4.46157364e-04 1.34222006e-03] [ 3.86607054e-05 -4.46157364e-04 1.34222007e-03] [-1.64125077e-04 2.59973532e-04 -1.21410123e-03] [ 1.64125074e-04 -2.59973529e-04 -1.21410123e-03] [ 3.80886165e-04 5.03025186e-04 7.05141586e-04] [-3.80886162e-04 -5.03025188e-04 7.05141585e-04] [ 3.56890465e-04 -2.41014815e-05 -7.50488741e-04] [-3.56890464e-04 2.41014810e-05 -7.50488743e-04] [ 2.65009831e-03 -9.57864003e-05 3.07095050e-04] [-2.65009832e-03 9.57864019e-05 3.07095050e-04] [-1.27374940e-03 -6.29118723e-04 1.15951449e-03] [ 1.27374940e-03 6.29118725e-04 1.15951449e-03] [ 6.41366672e-04 1.71976315e-04 -5.81819123e-04] [-6.41366672e-04 -1.71976315e-04 -5.81819123e-04] [-3.91305375e-04 -5.91107802e-05 2.69393937e-04] [ 3.91305377e-04 5.91107782e-05 2.69393939e-04] [ 2.55807532e-04 -2.04437070e-04 1.02921208e-04] [-2.55807533e-04 2.04437061e-04 1.02921205e-04] [ 1.58320398e-04 1.05835647e-04 -7.61667404e-05] [-1.58320396e-04 -1.05835648e-04 -7.61667393e-05] [ 4.43885195e-05 -5.16040904e-04 3.02818076e-04] [-4.43885232e-05 5.16040908e-04 3.02818072e-04] [-7.11795900e-04 2.81644309e-04 -1.34540882e-04] [ 7.11795900e-04 -2.81644308e-04 -1.34540883e-04] [-1.85710585e-04 -1.25274625e-04 3.50683675e-04] [ 1.85710588e-04 1.25274625e-04 3.50683679e-04] [ 2.03282835e-04 -2.24055146e-04 -5.37858853e-05] [-2.03282832e-04 2.24055144e-04 -5.37858867e-05] [-1.15007166e-03 3.78700366e-04 -1.52228115e-04] [ 1.15007166e-03 -3.78700365e-04 -1.52228117e-04] [ 6.33055921e-04 2.89577584e-04 -3.30657343e-04] [-6.33055919e-04 -2.89577578e-04 -3.30657344e-04] [-1.78527231e-04 4.85057990e-04 2.36055964e-04] [ 1.78527227e-04 -4.85057991e-04 2.36055967e-04] [-6.10579266e-04 -9.54219623e-04 6.52823586e-04] [ 6.10579269e-04 9.54219622e-04 6.52823586e-04] [-1.00707164e-03 5.93752728e-05 -7.44504575e-04] [ 1.00707164e-03 -5.93752717e-05 -7.44504578e-04] [ 4.17308672e-04 2.36740916e-04 -4.06430979e-04] [-4.17308671e-04 -2.36740915e-04 -4.06430974e-04]] Final stress: [-1.76095297e-05 -6.25977210e-06 -3.74239618e-05 2.99619205e-15 -4.30246963e-15 -2.79886644e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.07036936e-03 -8.08474877e-04 -7.23687998e-04] [ 1.07036937e-03 8.08474902e-04 -7.23688001e-04] [-9.82162008e-04 -3.91715109e-04 6.90317457e-04] [ 9.82162014e-04 3.91715106e-04 6.90317448e-04] [-1.15515306e-03 -1.65668862e-03 3.84405456e-04] [ 1.15515306e-03 1.65668862e-03 3.84405450e-04] [ 2.30576035e-03 -3.01734808e-04 5.21121378e-04] [-2.30576035e-03 3.01734820e-04 5.21121395e-04] [ 1.34377616e-04 -2.82029755e-03 9.67652785e-04] [-1.34377615e-04 2.82029755e-03 9.67652781e-04] [-6.76306798e-05 1.68101976e-03 -2.31686419e-04] [ 6.76306770e-05 -1.68101976e-03 -2.31686410e-04] [ 9.27225742e-04 -1.37689713e-03 -6.99504679e-04] [-9.27225741e-04 1.37689713e-03 -6.99504684e-04] [ 2.43397796e-03 -3.02613994e-04 -3.35772447e-03] [-2.43397797e-03 3.02613987e-04 -3.35772447e-03] [ 4.27217207e-04 -5.64815834e-04 6.34395470e-04] [-4.27217201e-04 5.64815829e-04 6.34395470e-04] [-6.26383131e-04 1.60538691e-03 -7.05176131e-05] [ 6.26383126e-04 -1.60538690e-03 -7.05176173e-05] [-2.99170765e-03 2.21028870e-03 -1.80935480e-03] [ 2.99170765e-03 -2.21028870e-03 -1.80935480e-03] [ 2.69099137e-03 -1.68153191e-03 -3.87898580e-05] [-2.69099137e-03 1.68153191e-03 -3.87898578e-05] [-8.12762081e-04 2.31066937e-04 4.36141708e-04] [ 8.12762084e-04 -2.31066950e-04 4.36141697e-04] [-3.98912268e-04 2.08981790e-04 2.69249993e-03] [ 3.98912264e-04 -2.08981789e-04 2.69249993e-03] [-1.64404485e-03 -2.23199863e-03 1.87508651e-03] [ 1.64404485e-03 2.23199863e-03 1.87508651e-03] [ 3.96269854e-04 2.16023902e-03 -1.79100178e-03] [-3.96269860e-04 -2.16023902e-03 -1.79100178e-03] [ 1.84979562e-03 2.47301603e-04 -2.01247916e-04] [-1.84979562e-03 -2.47301607e-04 -2.01247916e-04] [ 6.91077615e-04 -2.27299584e-03 1.52021622e-04] [-6.91077617e-04 2.27299584e-03 1.52021614e-04] [-4.34839437e-04 -2.92555248e-04 -1.58115236e-03] [ 4.34839439e-04 2.92555247e-04 -1.58115235e-03] [ 6.77345105e-05 -1.39055928e-03 -8.26682664e-04] [-6.77345149e-05 1.39055928e-03 -8.26682662e-04] [-3.07079129e-04 1.15971387e-03 1.07041388e-03] [ 3.07079133e-04 -1.15971387e-03 1.07041389e-03] [ 1.94087061e-03 2.63933859e-03 1.28990211e-03] [-1.94087062e-03 -2.63933860e-03 1.28990211e-03] [ 7.00911779e-04 1.58354640e-03 -1.38822719e-03] [-7.00911781e-04 -1.58354640e-03 -1.38822719e-03] [ 9.95957643e-04 -9.02355947e-04 -8.04128235e-04] [-9.95957641e-04 9.02355946e-04 -8.04128246e-04] [-5.30952764e-04 -6.37339007e-04 1.32939614e-03] [ 5.30952755e-04 6.37339006e-04 1.32939614e-03] [-5.74027131e-04 7.49283082e-04 1.57558750e-03] [ 5.74027121e-04 -7.49283088e-04 1.57558750e-03] [ 2.75888456e-04 -5.49406858e-04 5.79973914e-04] [-2.75888451e-04 5.49406862e-04 5.79973912e-04] [-8.61817942e-05 4.18302914e-04 -3.20871316e-03] [ 8.61818069e-05 -4.18302902e-04 -3.20871316e-03] [ 3.92288727e-03 -1.36015101e-03 -6.94529634e-04] [-3.92288727e-03 1.36015101e-03 -6.94529626e-04] [-8.01101245e-05 -3.84375786e-04 6.36628441e-04] [ 8.01101319e-05 3.84375787e-04 6.36628440e-04] [ 2.98982288e-03 4.65496993e-04 3.97431601e-04] [-2.98982288e-03 -4.65496995e-04 3.97431606e-04] [-3.97913349e-04 -5.20289413e-04 -2.58902155e-03] [ 3.97913353e-04 5.20289417e-04 -2.58902155e-03] [-1.27672453e-04 -8.72281388e-04 2.86303038e-03] [ 1.27672444e-04 8.72281395e-04 2.86303038e-03] [ 8.81804216e-04 1.15944971e-04 -1.73004071e-03] [-8.81804217e-04 -1.15944974e-04 -1.73004072e-03] [ 6.40673408e-04 -1.11762367e-03 1.48006794e-03] [-6.40673423e-04 1.11762367e-03 1.48006795e-03] [-2.75705214e-03 1.46984161e-03 2.58687453e-03] [ 2.75705214e-03 -1.46984161e-03 2.58687453e-03] [ 5.96610809e-03 2.09350111e-04 7.68089754e-04] [-5.96610809e-03 -2.09350118e-04 7.68089751e-04] [-9.64835412e-04 1.75515741e-04 6.23716767e-04] [ 9.64835418e-04 -1.75515735e-04 6.23716762e-04] [ 1.36118377e-03 -2.10701699e-04 -1.24460430e-03] [-1.36118377e-03 2.10701701e-04 -1.24460430e-03] [-4.37842503e-04 -4.18912775e-04 3.16134746e-04] [ 4.37842509e-04 4.18912785e-04 3.16134759e-04] [-3.71440146e-04 2.31209580e-04 -2.12242295e-04] [ 3.71440142e-04 -2.31209572e-04 -2.12242308e-04] [-1.46766913e-04 -1.26493530e-03 7.63864831e-04] [ 1.46766913e-04 1.26493531e-03 7.63864832e-04] [ 1.85062508e-03 5.83241447e-04 -3.09812916e-04] [-1.85062508e-03 -5.83241455e-04 -3.09812925e-04] [ 4.80236675e-04 -5.30436831e-04 6.93436017e-04] [-4.80236680e-04 5.30436827e-04 6.93436023e-04] [-4.16196932e-04 -5.16330129e-04 -7.91720405e-05] [ 4.16196936e-04 5.16330127e-04 -7.91720396e-05] [ 2.53542702e-03 1.01454395e-03 -4.02973627e-04] [-2.53542701e-03 -1.01454395e-03 -4.02973631e-04] [-1.55019545e-03 8.67140649e-04 -7.14173276e-04] [ 1.55019545e-03 -8.67140635e-04 -7.14173276e-04] [-1.52224153e-03 2.22287078e-03 1.47772052e-03] [ 1.52224154e-03 -2.22287079e-03 1.47772052e-03] [-3.37710586e-04 -1.10474428e-03 7.42611724e-04] [ 3.37710580e-04 1.10474428e-03 7.42611725e-04] [ 1.01416569e-03 -5.15087132e-04 -1.04454924e-03] [-1.01416569e-03 5.15087121e-04 -1.04454924e-03] [-2.26671898e-03 -3.16025499e-04 -1.79498439e-03] [ 2.26671898e-03 3.16025496e-04 -1.79498439e-03]] Final stress: [-2.47220840e-05 8.92781283e-07 -6.86042120e-05 2.53845708e-15 6.98434237e-15 6.51170970e-05] Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 117 steps. Minimization converged after 119 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.16287051e-04 6.49903415e-05 -6.77197098e-06] [-1.16287052e-04 -6.49903505e-05 -6.77196944e-06] [ 1.72122991e-04 1.91271797e-04 7.16609129e-05] [-1.72122991e-04 -1.91271797e-04 7.16609123e-05] [ 6.34072633e-05 -1.56646712e-04 -1.38981717e-04] [-6.34072630e-05 1.56646712e-04 -1.38981717e-04] [-2.24266715e-04 -2.80504653e-04 -2.59806529e-06] [ 2.24266714e-04 2.80504651e-04 -2.59806696e-06] [ 4.19377046e-05 1.27960028e-04 -1.19548469e-04] [-4.19377042e-05 -1.27960028e-04 -1.19548468e-04] [ 6.08783766e-05 4.90430182e-05 1.60078213e-04] [-6.08783762e-05 -4.90430175e-05 1.60078213e-04] [-1.99447719e-04 -1.48825646e-05 -1.88150199e-04] [ 1.99447719e-04 1.48825651e-05 -1.88150199e-04] [-3.48185377e-04 -1.69828117e-04 -2.35958910e-04] [ 3.48185377e-04 1.69828121e-04 -2.35958910e-04] [ 1.14135491e-05 2.51049105e-04 -2.26772997e-04] [-1.14135494e-05 -2.51049105e-04 -2.26772997e-04] [ 6.53697578e-05 -3.38590901e-05 1.72585707e-04] [-6.53697579e-05 3.38590889e-05 1.72585708e-04] [ 2.98172015e-04 -1.63563830e-04 4.64376723e-05] [-2.98172015e-04 1.63563830e-04 4.64376721e-05] [-2.33223869e-04 1.24436872e-05 1.40439008e-04] [ 2.33223869e-04 -1.24436860e-05 1.40439007e-04] [ 2.84904130e-05 9.88436892e-05 -1.06242678e-04] [-2.84904133e-05 -9.88436904e-05 -1.06242680e-04] [-1.69671907e-05 1.48009959e-04 3.57564748e-04] [ 1.69671912e-05 -1.48009961e-04 3.57564746e-04] [ 1.68494803e-04 8.24694744e-05 1.03032333e-05] [-1.68494805e-04 -8.24694753e-05 1.03032328e-05] [ 2.65170875e-05 1.36696813e-04 3.84033872e-05] [-2.65170872e-05 -1.36696813e-04 3.84033881e-05] [-2.31220657e-04 -1.63142913e-04 -6.56743741e-05] [ 2.31220657e-04 1.63142915e-04 -6.56743742e-05] [-2.20425122e-04 1.95881455e-05 6.24724826e-05] [ 2.20425123e-04 -1.95881461e-05 6.24724820e-05] [ 9.62253784e-05 1.92016478e-04 1.66055404e-04] [-9.62253783e-05 -1.92016477e-04 1.66055405e-04] [-4.11818275e-05 1.60237098e-05 2.97212536e-04] [ 4.11818273e-05 -1.60237087e-05 2.97212537e-04] [ 1.51121895e-05 3.07483069e-06 -8.45702922e-05] [-1.51121880e-05 -3.07482972e-06 -8.45702924e-05] [-7.49963448e-05 -1.86588838e-04 -2.26836245e-04] [ 7.49963446e-05 1.86588838e-04 -2.26836245e-04] [ 2.43005454e-05 -2.12250795e-04 1.37496984e-04] [-2.43005451e-05 2.12250795e-04 1.37496983e-04] [-6.25666084e-05 2.51687161e-04 1.05838303e-04] [ 6.25666067e-05 -2.51687162e-04 1.05838304e-04] [ 1.77750341e-05 -3.94791399e-05 -2.18439512e-04] [-1.77750337e-05 3.94791384e-05 -2.18439514e-04] [ 1.25349319e-04 -1.13150049e-04 -1.29110828e-04] [-1.25349319e-04 1.13150049e-04 -1.29110829e-04] [-1.14824576e-04 -3.70041580e-05 -8.21364593e-05] [ 1.14824576e-04 3.70041589e-05 -8.21364578e-05] [ 1.12402487e-04 -7.18629500e-05 4.61676385e-05] [-1.12402488e-04 7.18629491e-05 4.61676389e-05] [-1.75789175e-04 -1.72958921e-05 -1.31292275e-04] [ 1.75789176e-04 1.72958914e-05 -1.31292276e-04] [ 2.38050600e-04 1.80414947e-04 -1.01152151e-04] [-2.38050600e-04 -1.80414948e-04 -1.01152152e-04] [-1.43514454e-04 -1.68136524e-04 4.46525220e-05] [ 1.43514454e-04 1.68136524e-04 4.46525215e-05] [ 5.61501146e-05 6.34506665e-05 1.53203050e-04] [-5.61501154e-05 -6.34506682e-05 1.53203048e-04] [-1.27150008e-04 2.29229680e-04 -4.47423368e-04] [ 1.27150008e-04 -2.29229684e-04 -4.47423367e-04] [-1.39009383e-04 -9.98756088e-05 1.37911011e-04] [ 1.39009384e-04 9.98756086e-05 1.37911010e-04] [-1.29252300e-04 1.16726299e-04 -1.71244449e-04] [ 1.29252300e-04 -1.16726299e-04 -1.71244448e-04] [ 2.42884714e-04 1.29100122e-04 3.82277321e-05] [-2.42884713e-04 -1.29100124e-04 3.82277330e-05] [-3.19369894e-04 2.86319210e-05 1.64002555e-04] [ 3.19369892e-04 -2.86319222e-05 1.64002555e-04] [ 1.15497471e-04 -8.10917724e-05 6.09477928e-05] [-1.15497471e-04 8.10917724e-05 6.09477914e-05] [-1.28476683e-04 1.38615296e-04 2.58575270e-04] [ 1.28476685e-04 -1.38615296e-04 2.58575271e-04] [ 1.28435168e-04 -6.16439398e-05 -5.48139867e-06] [-1.28435168e-04 6.16439405e-05 -5.48139716e-06] [ 9.85302694e-05 -3.45887688e-04 -2.42032235e-06] [-9.85302701e-05 3.45887688e-04 -2.42032275e-06] [-8.20641500e-06 -7.06937944e-05 -1.37063545e-04] [ 8.20641453e-06 7.06937939e-05 -1.37063545e-04] [-3.18388223e-05 -2.96102472e-05 4.28164656e-05] [ 3.18388216e-05 2.96102490e-05 4.28164675e-05] [-3.25172502e-05 1.23090932e-04 -3.22880603e-05] [ 3.25172497e-05 -1.23090924e-04 -3.22880608e-05] [ 1.32615752e-05 2.64484747e-04 -1.05013329e-04] [-1.32615751e-05 -2.64484745e-04 -1.05013328e-04] [-2.52174249e-04 -1.79109637e-04 1.50546969e-04] [ 2.52174250e-04 1.79109637e-04 1.50546969e-04] [ 1.10431401e-05 4.81215489e-05 6.53602532e-05] [-1.10431392e-05 -4.81215508e-05 6.53602524e-05] [ 5.20097401e-05 -1.05864623e-04 -3.98968797e-05] [-5.20097405e-05 1.05864626e-04 -3.98968791e-05] [ 1.22295938e-05 7.28534654e-05 1.90870859e-04] [-1.22295922e-05 -7.28534639e-05 1.90870859e-04] [-1.57512085e-04 -2.86358178e-05 -9.75085146e-05] [ 1.57512085e-04 2.86358191e-05 -9.75085138e-05] [ 1.84342562e-04 -3.89312251e-05 -1.72537001e-05] [-1.84342562e-04 3.89312261e-05 -1.72537014e-05]] Final stress: [-8.88522302e-06 -1.30602239e-05 -1.16275459e-05 -5.61711313e-16 -9.99129059e-16 -4.17211970e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.18192679e-04 5.99030765e-05 -4.88444601e-06] [ 1.18192679e-04 -5.99030756e-05 -4.88444741e-06] [-1.72253545e-04 1.90853023e-04 7.18933998e-05] [ 1.72253546e-04 -1.90853023e-04 7.18934006e-05] [-6.44302059e-05 -1.57057991e-04 -1.35296049e-04] [ 6.44302065e-05 1.57057991e-04 -1.35296050e-04] [ 2.24551200e-04 -2.79088673e-04 4.63204327e-07] [-2.24551201e-04 2.79088671e-04 4.63203052e-07] [-4.21934334e-05 1.27365345e-04 -1.17607129e-04] [ 4.21934334e-05 -1.27365345e-04 -1.17607129e-04] [-6.07357789e-05 4.82726361e-05 1.56105630e-04] [ 6.07357790e-05 -4.82726362e-05 1.56105630e-04] [ 2.02275070e-04 -1.22531393e-05 -1.88953067e-04] [-2.02275070e-04 1.22531400e-05 -1.88953067e-04] [ 3.49012861e-04 -1.65487333e-04 -2.29756228e-04] [-3.49012861e-04 1.65487333e-04 -2.29756229e-04] [-1.79351658e-05 2.49266363e-04 -2.23844295e-04] [ 1.79351663e-05 -2.49266362e-04 -2.23844295e-04] [-6.00775346e-05 -3.83678691e-05 1.71519140e-04] [ 6.00775343e-05 3.83678697e-05 1.71519141e-04] [-2.97010650e-04 -1.65974399e-04 4.17514056e-05] [ 2.97010650e-04 1.65974399e-04 4.17514066e-05] [ 2.33883321e-04 8.52319505e-06 1.36848907e-04] [-2.33883320e-04 -8.52318802e-06 1.36848906e-04] [-2.71241710e-05 9.59948354e-05 -1.04234423e-04] [ 2.71241705e-05 -9.59948383e-05 -1.04234428e-04] [ 1.86126920e-05 1.46053629e-04 3.51293548e-04] [-1.86126923e-05 -1.46053630e-04 3.51293546e-04] [-1.65751460e-04 8.24152528e-05 1.11997072e-05] [ 1.65751460e-04 -8.24152534e-05 1.11997075e-05] [-3.01404633e-05 1.37740718e-04 3.77203843e-05] [ 3.01404639e-05 -1.37740717e-04 3.77203849e-05] [ 2.31553174e-04 -1.58467541e-04 -6.62943963e-05] [-2.31553174e-04 1.58467540e-04 -6.62943951e-05] [ 9.73914122e-05 -1.92422993e-04 1.66158551e-04] [-9.73914121e-05 1.92422993e-04 1.66158551e-04] [-2.20141843e-04 -1.62206959e-05 6.00347296e-05] [ 2.20141843e-04 1.62206963e-05 6.00347299e-05] [ 1.65591061e-05 1.66040162e-07 -8.97841754e-05] [-1.65591072e-05 -1.66038287e-07 -8.97841745e-05] [-3.84276163e-05 -1.19607909e-05 3.01109631e-04] [ 3.84276162e-05 1.19607926e-05 3.01109629e-04] [ 2.40924112e-05 2.12955164e-04 1.35801010e-04] [-2.40924113e-05 -2.12955163e-04 1.35801010e-04] [-7.49097613e-05 1.87371472e-04 -2.25318658e-04] [ 7.49097611e-05 -1.87371472e-04 -2.25318658e-04] [ 1.89753398e-05 3.71931184e-05 -2.21872173e-04] [-1.89753393e-05 -3.71931179e-05 -2.21872174e-04] [-5.75863629e-05 -2.51929675e-04 1.08406480e-04] [ 5.75863630e-05 2.51929676e-04 1.08406481e-04] [-1.13652712e-04 3.80895784e-05 -8.05928512e-05] [ 1.13652712e-04 -3.80895788e-05 -8.05928516e-05] [ 1.24808824e-04 1.11803007e-04 -1.31920273e-04] [-1.24808823e-04 -1.11803007e-04 -1.31920273e-04] [-1.70466733e-04 2.62208990e-05 -1.27545991e-04] [ 1.70466731e-04 -2.62208999e-05 -1.27545990e-04] [ 1.00305657e-04 7.09708919e-05 4.66719402e-05] [-1.00305657e-04 -7.09708925e-05 4.66719399e-05] [-1.41617829e-04 1.68443660e-04 4.39548707e-05] [ 1.41617829e-04 -1.68443661e-04 4.39548697e-05] [ 2.39255089e-04 -1.79809031e-04 -9.85586371e-05] [-2.39255089e-04 1.79809031e-04 -9.85586370e-05] [-1.28433443e-04 -2.30419570e-04 -4.48026318e-04] [ 1.28433443e-04 2.30419570e-04 -4.48026319e-04] [ 5.74583106e-05 -6.31443083e-05 1.57111057e-04] [-5.74583112e-05 6.31443085e-05 1.57111057e-04] [-1.28978679e-04 -1.09097540e-04 -1.64427851e-04] [ 1.28978680e-04 1.09097539e-04 -1.64427851e-04] [-1.34432477e-04 1.05023685e-04 1.35810406e-04] [ 1.34432476e-04 -1.05023685e-04 1.35810407e-04] [-3.14760668e-04 -3.81679132e-05 1.55850074e-04] [ 3.14760669e-04 3.81679121e-05 1.55850076e-04] [ 2.31189167e-04 -1.33056875e-04 4.07919793e-05] [-2.31189168e-04 1.33056874e-04 4.07919785e-05] [-1.23568738e-04 -1.38536030e-04 2.57622439e-04] [ 1.23568737e-04 1.38536030e-04 2.57622439e-04] [ 1.15058857e-04 8.17860933e-05 5.82443691e-05] [-1.15058857e-04 -8.17860944e-05 5.82443693e-05] [-1.35661836e-04 -5.72526197e-05 -1.03112790e-05] [ 1.35661836e-04 5.72526220e-05 -1.03112770e-05] [-9.45829699e-05 -3.42505821e-04 -2.38723648e-06] [ 9.45829701e-05 3.42505821e-04 -2.38723592e-06] [ 1.24078868e-05 -6.94980579e-05 -1.40181135e-04] [-1.24078871e-05 6.94980587e-05 -1.40181135e-04] [ 2.58088066e-05 -3.25463913e-05 4.54868923e-05] [-2.58088060e-05 3.25463925e-05 4.54868928e-05] [ 3.22341199e-05 1.25722753e-04 -3.08719530e-05] [-3.22341201e-05 -1.25722753e-04 -3.08719529e-05] [-1.70459690e-05 2.62148273e-04 -1.03479959e-04] [ 1.70459690e-05 -2.62148273e-04 -1.03479959e-04] [ 2.52158778e-04 -1.79694795e-04 1.54795895e-04] [-2.52158779e-04 1.79694795e-04 1.54795896e-04] [-4.96230993e-06 5.21557997e-05 6.66285261e-05] [ 4.96231028e-06 -5.21558058e-05 6.66285263e-05] [ 1.35028427e-05 -7.36821086e-05 1.91656244e-04] [-1.35028423e-05 7.36821091e-05 1.91656246e-04] [ 4.98153708e-05 1.04670743e-04 -4.35628830e-05] [-4.98153707e-05 -1.04670743e-04 -4.35628848e-05] [ 1.87196018e-04 4.50479168e-05 -1.86936947e-05] [-1.87196017e-04 -4.50479167e-05 -1.86936919e-05] [-1.54867890e-04 3.15429367e-05 -9.65253165e-05] [ 1.54867889e-04 -3.15429360e-05 -9.65253189e-05]] Final stress: [-8.90331649e-06 -1.30610026e-05 -1.16198612e-05 -1.69589011e-15 -5.01954790e-16 4.15363525e-06] Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-4.98782029e-05 -2.18229568e-04 -1.38750429e-04] [ 4.98782028e-05 2.18229566e-04 -1.38750427e-04] [ 1.22113090e-05 -1.24445896e-04 -8.90114010e-06] [-1.22113086e-05 1.24445898e-04 -8.90114245e-06] [ 3.76471950e-04 5.05854406e-04 -2.12501702e-05] [-3.76471951e-04 -5.05854405e-04 -2.12501664e-05] [-1.70048143e-04 8.04470568e-05 -2.50423381e-04] [ 1.70048144e-04 -8.04470521e-05 -2.50423378e-04] [ 2.09731485e-04 1.87481671e-04 2.76528308e-04] [-2.09731485e-04 -1.87481671e-04 2.76528308e-04] [-1.09617861e-04 -2.01734902e-04 2.09003794e-04] [ 1.09617861e-04 2.01734902e-04 2.09003794e-04] [-3.11954705e-04 -5.52570857e-05 1.14314798e-04] [ 3.11954705e-04 5.52570838e-05 1.14314796e-04] [-1.05913864e-03 2.23931483e-04 3.29496050e-04] [ 1.05913864e-03 -2.23931485e-04 3.29496050e-04] [ 4.25348922e-04 -7.36232705e-05 1.30481924e-04] [-4.25348922e-04 7.36232691e-05 1.30481922e-04] [ 1.83176476e-04 1.03948835e-04 -3.38070458e-05] [-1.83176476e-04 -1.03948837e-04 -3.38070471e-05] [ 2.03473635e-04 -1.56879714e-04 -8.31300459e-05] [-2.03473634e-04 1.56879713e-04 -8.31300469e-05] [-3.73524572e-04 -3.54051450e-04 -6.54748419e-05] [ 3.73524571e-04 3.54051432e-04 -6.54748385e-05] [-8.50069121e-05 -7.11247558e-05 5.57075739e-06] [ 8.50069125e-05 7.11247644e-05 5.57076753e-06] [ 1.97659008e-04 1.04056507e-04 -2.30438669e-04] [-1.97659009e-04 -1.04056502e-04 -2.30438663e-04] [ 1.38870867e-04 4.81460275e-04 -9.28122133e-04] [-1.38870868e-04 -4.81460274e-04 -9.28122133e-04] [ 3.46241975e-04 -3.76436890e-04 2.42558425e-04] [-3.46241976e-04 3.76436890e-04 2.42558423e-04] [ 1.85550082e-04 1.80832370e-04 7.08549514e-05] [-1.85550082e-04 -1.80832370e-04 7.08549499e-05] [ 1.50764627e-04 2.47054603e-04 -3.38926786e-04] [-1.50764627e-04 -2.47054604e-04 -3.38926785e-04] [ 2.64290794e-05 -2.05153160e-04 -2.04292368e-04] [-2.64290806e-05 2.05153158e-04 -2.04292370e-04] [ 1.02884529e-04 2.44279561e-04 -1.30345599e-04] [-1.02884526e-04 -2.44279565e-04 -1.30345602e-04] [-4.75259141e-05 -1.64957555e-04 -2.13760630e-05] [ 4.75259134e-05 1.64957552e-04 -2.13760606e-05] [-7.74555811e-05 2.61825554e-05 2.07664790e-04] [ 7.74555819e-05 -2.61825559e-05 2.07664790e-04] [-1.02887134e-04 -7.44625056e-04 3.55170891e-04] [ 1.02887133e-04 7.44625055e-04 3.55170892e-04] [-1.25262445e-04 -2.53025713e-04 -4.64693400e-04] [ 1.25262446e-04 2.53025711e-04 -4.64693399e-04] [ 7.98233461e-05 -1.79230516e-04 2.07685344e-04] [-7.98233483e-05 1.79230514e-04 2.07685340e-04] [ 1.71617974e-04 1.32466780e-04 3.57587804e-04] [-1.71617974e-04 -1.32466779e-04 3.57587805e-04] [-2.82853960e-04 2.17745386e-04 3.73657166e-05] [ 2.82853960e-04 -2.17745385e-04 3.73657168e-05] [-3.02121787e-04 -2.74907850e-05 3.18337764e-04] [ 3.02121788e-04 2.74907838e-05 3.18337765e-04] [-5.23077656e-05 -4.97306314e-04 2.17555274e-04] [ 5.23077650e-05 4.97306314e-04 2.17555275e-04] [ 2.68247114e-04 -5.98233683e-04 -4.99437091e-04] [-2.68247115e-04 5.98233684e-04 -4.99437091e-04] [-4.38117790e-04 9.98261246e-05 -6.82557878e-05] [ 4.38117791e-04 -9.98261237e-05 -6.82557875e-05] [-3.54112123e-04 -4.98964539e-05 -9.21792290e-05] [ 3.54112121e-04 4.98964541e-05 -9.21792279e-05] [ 2.98266869e-04 2.91851939e-04 1.67291293e-04] [-2.98266866e-04 -2.91851940e-04 1.67291294e-04] [ 7.35923831e-04 -4.60610181e-04 3.98544334e-04] [-7.35923831e-04 4.60610182e-04 3.98544335e-04] [-5.04838866e-04 1.24083836e-04 -1.32893967e-04] [ 5.04838867e-04 -1.24083835e-04 -1.32893970e-04] [-4.47592297e-05 -5.02247883e-04 3.10888678e-04] [ 4.47592308e-05 5.02247884e-04 3.10888678e-04] [-1.17579434e-04 -1.83663247e-04 -6.56285613e-04] [ 1.17579434e-04 1.83663250e-04 -6.56285612e-04] [ 4.27753753e-04 -5.79564763e-07 3.17903057e-04] [-4.27753752e-04 5.79565331e-07 3.17903057e-04] [ 1.05573095e-04 -1.52215307e-04 3.09913961e-05] [-1.05573097e-04 1.52215308e-04 3.09913963e-05] [ 8.97346046e-04 -2.49265793e-05 -7.25423236e-05] [-8.97346047e-04 2.49265747e-05 -7.25423276e-05] [ 6.33170190e-04 -1.33545091e-04 -1.17032997e-04] [-6.33170191e-04 1.33545091e-04 -1.17032997e-04] [-1.71565318e-04 -2.42765006e-04 -2.39976469e-04] [ 1.71565318e-04 2.42765005e-04 -2.39976469e-04] [ 3.92600899e-04 -4.17398458e-05 3.44818863e-04] [-3.92600899e-04 4.17398436e-05 3.44818861e-04] [-2.39116441e-04 1.68776352e-04 -2.05609739e-04] [ 2.39116439e-04 -1.68776349e-04 -2.05609738e-04] [-6.09938558e-04 1.77620379e-04 -6.84470613e-05] [ 6.09938558e-04 -1.77620381e-04 -6.84470601e-05] [ 2.04742494e-04 -4.88204019e-05 8.08288975e-05] [-2.04742492e-04 4.88204027e-05 8.08288974e-05] [ 1.89016171e-04 6.74692316e-05 2.41613771e-05] [-1.89016171e-04 -6.74692169e-05 2.41613767e-05] [-6.56386298e-04 1.19523873e-04 -1.11163164e-04] [ 6.56386298e-04 -1.19523873e-04 -1.11163166e-04] [ 1.92299138e-04 5.61089997e-04 1.86706518e-04] [-1.92299137e-04 -5.61089998e-04 1.86706520e-04] [-1.86973165e-04 3.65778885e-04 -6.87192884e-05] [ 1.86973166e-04 -3.65778883e-04 -6.87192956e-05] [-1.13154564e-04 4.29043739e-05 3.10163792e-04] [ 1.13154565e-04 -4.29043734e-05 3.10163800e-04]] Final stress: [ 7.06766704e-06 -4.94116321e-07 3.80078269e-05 -1.19509567e-17 -9.32174623e-16 -2.65206912e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 5.31014675e-05 5.41826822e-06 -4.49783896e-05] [-5.31014683e-05 -5.41827170e-06 -4.49783882e-05] [ 8.43938192e-06 -9.88957276e-05 -6.92099030e-06] [-8.43938233e-06 9.88957291e-05 -6.92099178e-06] [-1.77745756e-04 2.24702488e-04 3.37145434e-05] [ 1.77745756e-04 -2.24702487e-04 3.37145445e-05] [ 4.95286641e-05 -2.18710207e-06 -1.09914602e-04] [-4.95286643e-05 2.18710415e-06 -1.09914599e-04] [-1.01904847e-04 8.54083733e-05 1.40513746e-04] [ 1.01904847e-04 -8.54083724e-05 1.40513745e-04] [ 5.48136947e-05 -7.28383391e-05 8.20109887e-05] [-5.48136946e-05 7.28383396e-05 8.20109881e-05] [ 1.47381296e-04 -7.45935703e-05 7.84215796e-05] [-1.47381295e-04 7.45935688e-05 7.84215781e-05] [ 5.12296846e-04 9.92883079e-05 1.70171292e-04] [-5.12296846e-04 -9.92883089e-05 1.70171293e-04] [-1.75885703e-04 -3.83782841e-05 8.43600398e-05] [ 1.75885703e-04 3.83782835e-05 8.43600387e-05] [-1.28134274e-04 9.33402776e-05 -8.17690431e-06] [ 1.28134274e-04 -9.33402785e-05 -8.17690431e-06] [-9.23145013e-05 -6.77257335e-05 -3.95009394e-05] [ 9.23145015e-05 6.77257343e-05 -3.95009418e-05] [ 1.92302681e-04 -7.54488848e-05 -1.88357065e-05] [-1.92302681e-04 7.54488703e-05 -1.88357037e-05] [ 3.18977479e-05 4.28557802e-05 -4.68520581e-05] [-3.18977482e-05 -4.28557744e-05 -4.68520485e-05] [-1.13483501e-04 6.20446039e-06 -1.21325861e-04] [ 1.13483501e-04 -6.20445654e-06 -1.21325857e-04] [-8.00762190e-05 2.43173012e-04 -4.46328837e-04] [ 8.00762191e-05 -2.43173012e-04 -4.46328837e-04] [-1.87729665e-04 -2.06958425e-04 1.18014587e-04] [ 1.87729665e-04 2.06958425e-04 1.18014586e-04] [-1.27602791e-04 7.85995000e-05 1.60294448e-05] [ 1.27602791e-04 -7.85994993e-05 1.60294437e-05] [ 2.24192595e-05 9.34433902e-05 -1.12970833e-04] [-2.24192595e-05 -9.34433904e-05 -1.12970832e-04] [ 9.46634401e-05 -1.20816619e-04 -1.23356963e-04] [-9.46634397e-05 1.20816619e-04 -1.23356964e-04] [-5.02849979e-05 4.73332950e-05 4.35394637e-05] [ 5.02850008e-05 -4.73332981e-05 4.35394610e-05] [-2.47395524e-05 -1.97727351e-04 -1.61993712e-04] [ 2.47395510e-05 1.97727349e-04 -1.61993711e-04] [-5.16580794e-05 3.65948348e-04 1.65096011e-04] [ 5.16580792e-05 -3.65948348e-04 1.65096012e-04] [-4.30092120e-05 -2.30861751e-05 9.74416671e-05] [ 4.30092122e-05 2.30861747e-05 9.74416672e-05] [ 4.71968504e-05 1.46157779e-04 2.27304895e-04] [-4.71968491e-05 -1.46157780e-04 2.27304898e-04] [-1.12387027e-04 1.14482308e-04 -2.82501083e-04] [ 1.12387026e-04 -1.14482310e-04 -2.82501084e-04] [-1.54181944e-04 -1.32725887e-04 -2.87873774e-05] [ 1.54181944e-04 1.32725887e-04 -2.87873768e-05] [ 1.28457052e-04 -8.96663555e-05 2.21095682e-04] [-1.28457052e-04 8.96663559e-05 2.21095681e-04] [-7.24606409e-05 1.62800536e-04 8.39840707e-05] [ 7.24606411e-05 -1.62800534e-04 8.39840697e-05] [-8.22665384e-05 -1.52160085e-05 1.56654112e-04] [ 8.22665383e-05 1.52160076e-05 1.56654112e-04] [-2.24353950e-04 -5.32448795e-05 -4.07107124e-05] [ 2.24353950e-04 5.32448801e-05 -4.07107129e-05] [ 1.28672264e-04 2.97258073e-04 -2.55858997e-04] [-1.28672264e-04 -2.97258073e-04 -2.55858997e-04] [ 1.69354829e-04 -1.33223058e-04 8.97505099e-05] [-1.69354831e-04 1.33223057e-04 8.97505097e-05] [-2.32829416e-04 -2.89214692e-05 -1.17528764e-04] [ 2.32829417e-04 2.89214685e-05 -1.17528764e-04] [-2.23745824e-04 -1.16213697e-04 -8.54018607e-05] [ 2.23745824e-04 1.16213697e-04 -8.54018592e-05] [ 3.88920627e-04 1.96733796e-04 2.31273958e-04] [-3.88920627e-04 -1.96733796e-04 2.31273957e-04] [-4.49818960e-05 1.36731366e-04 -3.14581966e-04] [ 4.49818951e-05 -1.36731363e-04 -3.14581967e-04] [ 2.38174917e-05 2.87111737e-04 1.29756589e-04] [-2.38174918e-05 -2.87111735e-04 1.29756588e-04] [ 3.96850904e-05 6.22234046e-05 -8.44879028e-06] [-3.96850904e-05 -6.22234051e-05 -8.44878952e-06] [ 2.58069461e-04 -3.84435156e-05 1.88587728e-04] [-2.58069462e-04 3.84435157e-05 1.88587727e-04] [-3.82762630e-04 -5.79114280e-05 -3.72161543e-05] [ 3.82762631e-04 5.79114237e-05 -3.72161568e-05] [-3.61650074e-04 -5.43337812e-05 -5.99710262e-05] [ 3.61650074e-04 5.43337807e-05 -5.99710252e-05] [ 5.06709494e-05 -1.22812727e-04 -1.18325108e-04] [-5.06709489e-05 1.22812728e-04 -1.18325108e-04] [-2.11556235e-04 5.07641058e-06 1.80051128e-04] [ 2.11556235e-04 -5.07641100e-06 1.80051128e-04] [ 6.04693014e-05 7.15149246e-07 -1.17930620e-04] [-6.04693012e-05 -7.15146074e-07 -1.17930620e-04] [ 3.79609331e-04 8.65677240e-05 -5.61751453e-05] [-3.79609331e-04 -8.65677243e-05 -5.61751445e-05] [-9.18990817e-05 -4.24495654e-05 2.86538326e-05] [ 9.18990819e-05 4.24495657e-05 2.86538320e-05] [-1.53905384e-04 -8.32194683e-05 2.65496124e-05] [ 1.53905382e-04 8.32194793e-05 2.65496123e-05] [ 1.18081644e-04 -3.10452380e-04 7.02341688e-05] [-1.18081644e-04 3.10452380e-04 7.02341665e-05] [-3.26770709e-04 -5.18790387e-05 -4.28330732e-05] [ 3.26770709e-04 5.18790383e-05 -4.28330704e-05] [-1.00882440e-04 -8.55352113e-05 1.73847047e-04] [ 1.00882439e-04 8.55352115e-05 1.73847040e-04] [-9.12240463e-05 -2.31430978e-04 -2.96302271e-05] [ 9.12240467e-05 2.31430980e-04 -2.96302213e-05]] Final stress: [ 6.43878590e-06 2.20020168e-06 2.27556518e-05 7.20642690e-16 -5.54524391e-16 1.28437318e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-4.97809309e-04 -7.59661086e-05 7.45641173e-04] [ 4.97809309e-04 7.59661241e-05 7.45641169e-04] [-3.36543936e-04 9.68508705e-04 -6.52803778e-04] [ 3.36543937e-04 -9.68508711e-04 -6.52803777e-04] [ 3.79477071e-04 -1.00441613e-03 4.18284843e-04] [-3.79477071e-04 1.00441613e-03 4.18284839e-04] [-1.59925004e-04 4.01265967e-04 -3.45945029e-05] [ 1.59925004e-04 -4.01265971e-04 -3.45945065e-05] [ 2.52354892e-04 -2.85563142e-04 -5.08714626e-04] [-2.52354891e-04 2.85563143e-04 -5.08714628e-04] [-4.24130521e-04 3.47707706e-04 -5.58754369e-04] [ 4.24130520e-04 -3.47707707e-04 -5.58754374e-04] [-1.41299203e-04 4.94464901e-04 2.41044832e-05] [ 1.41299203e-04 -4.94464897e-04 2.41044849e-05] [-1.45958673e-03 -5.03348887e-04 -4.54411617e-04] [ 1.45958673e-03 5.03348884e-04 -4.54411618e-04] [ 6.39113981e-04 -3.05038056e-04 6.85675734e-05] [-6.39113980e-04 3.05038056e-04 6.85675753e-05] [ 6.06758742e-04 -2.72238891e-04 -3.86002436e-05] [-6.06758743e-04 2.72238890e-04 -3.86002455e-05] [ 2.56160629e-04 2.88994534e-04 1.11441897e-04] [-2.56160629e-04 -2.88994539e-04 1.11441898e-04] [-5.42378907e-04 -1.38940041e-04 -6.74586509e-04] [ 5.42378906e-04 1.38940077e-04 -6.74586517e-04] [ 2.00909451e-04 2.11703103e-04 -2.23348389e-04] [-2.00909449e-04 -2.11703113e-04 -2.23348403e-04] [ 4.06665332e-04 2.73226142e-04 -2.54086593e-04] [-4.06665332e-04 -2.73226149e-04 -2.54086596e-04] [ 6.33881565e-05 -1.15334101e-03 1.42877937e-03] [-6.33881573e-05 1.15334100e-03 1.42877937e-03] [ 3.91576630e-04 1.23816396e-03 -3.00283247e-04] [-3.91576627e-04 -1.23816396e-03 -3.00283244e-04] [ 8.98750076e-04 -4.90377652e-04 8.59419231e-04] [-8.98750078e-04 4.90377644e-04 8.59419235e-04] [-1.34344927e-04 -4.67901533e-04 2.69745454e-04] [ 1.34344927e-04 4.67901534e-04 2.69745455e-04] [-1.16049462e-03 -3.45953360e-05 2.29195650e-04] [ 1.16049462e-03 3.45953383e-05 2.29195649e-04] [ 1.62496219e-04 -4.65072400e-04 -3.44818269e-04] [-1.62496223e-04 4.65072408e-04 -3.44818264e-04] [ 6.84457792e-04 5.98613173e-04 5.49495426e-04] [-6.84457788e-04 -5.98613169e-04 5.49495420e-04] [ 1.13596084e-05 -9.81300115e-04 -1.28027414e-04] [-1.13596065e-05 9.81300117e-04 -1.28027412e-04] [-4.27295528e-04 -4.10538730e-04 -9.33355668e-04] [ 4.27295527e-04 4.10538730e-04 -9.33355669e-04] [ 3.41317725e-04 -7.13886663e-04 -1.13964210e-03] [-3.41317726e-04 7.13886670e-04 -1.13964211e-03] [ 7.06938444e-04 -2.60654432e-04 1.08535553e-03] [-7.06938442e-04 2.60654440e-04 1.08535554e-03] [ 1.60925533e-04 2.06120301e-04 2.46107267e-04] [-1.60925531e-04 -2.06120302e-04 2.46107266e-04] [-7.15002256e-04 4.42712663e-04 -6.16705689e-04] [ 7.15002257e-04 -4.42712664e-04 -6.16705689e-04] [-2.97570822e-04 -8.16861228e-04 -2.65170288e-04] [ 2.97570824e-04 8.16861229e-04 -2.65170288e-04] [-3.81590302e-04 2.92696211e-04 -7.67617856e-04] [ 3.81590304e-04 -2.92696206e-04 -7.67617856e-04] [ 4.10753067e-04 -4.88062891e-04 6.05253724e-04] [-4.10753066e-04 4.88062888e-04 6.05253722e-04] [-4.15117751e-04 -1.02973820e-03 1.04169652e-03] [ 4.15117750e-04 1.02973819e-03 1.04169651e-03] [ 6.09907901e-04 -4.62354267e-05 -6.19834883e-04] [-6.09907898e-04 4.62354303e-05 -6.19834884e-04] [ 1.13314621e-03 -2.60804091e-04 9.55283900e-04] [-1.13314621e-03 2.60804092e-04 9.55283900e-04] [ 5.22864269e-04 4.38005019e-04 7.80562455e-06] [-5.22864270e-04 -4.38005019e-04 7.80562371e-06] [-1.49369458e-03 -1.12261022e-03 -5.41084317e-04] [ 1.49369458e-03 1.12261023e-03 -5.41084315e-04] [ 2.47610002e-05 -1.10052639e-03 1.25122949e-03] [-2.47610017e-05 1.10052639e-03 1.25122949e-03] [-8.20019476e-04 -2.41557561e-03 -9.59543494e-04] [ 8.20019480e-04 2.41557561e-03 -9.59543494e-04] [-3.61842345e-04 -7.05204760e-04 -3.38030637e-04] [ 3.61842346e-04 7.05204761e-04 -3.38030638e-04] [-1.25994382e-03 1.33093591e-04 -9.99437021e-04] [ 1.25994382e-03 -1.33093591e-04 -9.99437022e-04] [ 9.67467798e-04 4.56320992e-05 -1.04307650e-05] [-9.67467796e-04 -4.56320911e-05 -1.04307603e-05] [ 8.52640333e-04 -2.56124062e-04 2.00237865e-05] [-8.52640333e-04 2.56124066e-04 2.00237855e-05] [-3.12097148e-04 6.44003346e-04 5.46154457e-04] [ 3.12097144e-04 -6.44003349e-04 5.46154457e-04] [ 6.85222677e-04 -6.20446674e-05 -4.96341207e-04] [-6.85222676e-04 6.20446706e-05 -4.96341205e-04] [-1.35947064e-04 -9.20244409e-05 4.68742317e-04] [ 1.35947062e-04 9.20244323e-05 4.68742322e-04] [-7.30417432e-04 -1.67281360e-05 5.95908550e-04] [ 7.30417430e-04 1.67281341e-05 5.95908551e-04] [ 7.16854939e-04 3.41175225e-04 3.56527999e-04] [-7.16854939e-04 -3.41175225e-04 3.56527999e-04] [ 6.71510945e-06 4.78912084e-04 -1.56415216e-04] [-6.71510848e-06 -4.78912117e-04 -1.56415216e-04] [-6.14134348e-04 4.99507927e-04 -1.25648740e-04] [ 6.14134350e-04 -4.99507930e-04 -1.25648735e-04] [ 1.13002372e-03 -1.35613466e-04 -5.07917349e-04] [-1.13002372e-03 1.35613463e-04 -5.07917353e-04] [ 5.63775366e-04 2.80105192e-04 6.32167633e-06] [-5.63775371e-04 -2.80105196e-04 6.32168466e-06] [ 4.65189315e-04 6.06279511e-04 7.59118867e-04] [-4.65189316e-04 -6.06279516e-04 7.59118857e-04]] Final stress: [-1.06510299e-05 4.51220371e-07 -5.32128168e-05 -7.01780602e-15 -2.49543239e-15 -4.60508301e-05] Minimization converged after 121 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.17290847e-04 3.54400933e-03 3.45911706e-04] [-1.77793622e-04 1.06534674e-03 -4.42901059e-04] [ 5.73147977e-04 -9.02972017e-04 -7.90391297e-05] [-5.87719928e-04 -1.11813778e-03 2.32489548e-04] [ 8.37813313e-04 -5.05319601e-04 -1.92655647e-03] [-8.70556112e-04 -9.41737420e-05 1.71714840e-03] [-6.33064401e-04 -4.06052563e-04 1.94487929e-03] [ 6.10359548e-04 -1.78879501e-04 -9.17060311e-04] [ 1.87998508e-04 -8.34784835e-05 6.80767303e-04] [-1.85983866e-04 -1.39453901e-04 -1.21955840e-03] [ 4.95969332e-04 -1.70259166e-04 1.80179389e-03] [-4.97333432e-04 -2.84258511e-04 -1.72490069e-03] [-4.48671685e-04 7.64928980e-04 4.95496707e-04] [ 4.45971780e-04 9.17660258e-04 -8.50048402e-04] [-2.22200522e-03 -1.08234118e-03 1.66764482e-03] [ 2.22694998e-03 -2.86409242e-04 -8.07536868e-04] [-6.13713361e-05 1.51705801e-04 1.55927806e-04] [ 8.56997146e-05 -3.41009618e-04 -4.86051270e-04] [ 2.82608551e-04 -5.72618525e-04 -4.41013568e-04] [-2.77120586e-04 -4.30031814e-04 1.00231551e-03] [ 1.30513750e-03 -2.74744509e-04 -7.76801290e-05] [-1.30840908e-03 -4.17508192e-04 4.49759007e-04] [-6.52179924e-04 2.18462189e-04 5.37382186e-04] [ 6.47128973e-04 1.30545662e-04 2.60862381e-04] [-1.15092532e-04 -1.93329921e-03 -5.72786362e-04] [ 1.27951115e-04 -1.38320241e-03 -2.47579858e-04] [ 1.48742082e-04 5.21468840e-05 -1.58973216e-03] [-1.49931567e-04 -1.02682770e-04 1.03745671e-03] [ 8.02182559e-04 1.23174982e-03 2.92818829e-03] [-7.56390089e-04 1.24060626e-03 -8.68266385e-04] [ 3.08291746e-04 -6.37808816e-04 1.18172084e-04] [-3.06410715e-04 -4.38802596e-04 -1.02346926e-03] [-1.00759112e-03 -1.30516895e-03 -6.50491127e-04] [ 1.01443270e-03 -3.42633440e-04 2.44643446e-04] [-6.29155858e-04 1.64543348e-03 7.85014459e-04] [ 9.24265372e-04 3.75333881e-04 3.91657770e-04] [ 4.32782418e-04 1.95171375e-03 -4.65778124e-05] [-6.19254450e-04 -1.51853807e-06 3.42068400e-04] [ 6.70814961e-04 1.30608748e-03 1.64078825e-04] [ 4.81657354e-05 3.76882044e-04 -3.76933329e-04] [-8.33140284e-04 1.45458409e-03 -7.93241226e-05] [ 1.01931284e-04 2.11220406e-04 4.80200173e-04] [ 4.35197311e-04 -3.15108422e-04 -1.32433842e-03] [ 7.95386927e-04 1.44217261e-03 -1.93163221e-03] [-1.77523834e-04 7.87654586e-04 9.86650863e-04] [-1.08285395e-03 3.41662792e-04 1.58830614e-03] [ 2.06183690e-06 1.15718800e-04 3.27974168e-04] [ 4.66030277e-04 -6.24998574e-04 4.22763568e-05] [ 6.14240108e-05 -4.61648228e-04 1.86994415e-04] [-5.76290951e-04 -4.89949122e-05 4.79352168e-04] [ 1.13742387e-03 4.50215493e-04 9.99399894e-04] [ 9.25788428e-05 1.53957002e-04 -1.16924424e-03] [-1.22957518e-03 4.15622693e-04 -1.44626719e-03] [-6.31533149e-05 1.68760303e-04 6.90778584e-04] [ 2.46412057e-03 -1.98632375e-05 -7.02246283e-04] [-4.18227808e-04 3.14538210e-04 6.36934799e-04] [-2.34442638e-03 6.62584540e-05 5.41841612e-04] [ 3.64362338e-04 2.37429213e-04 -7.96337414e-04] [ 2.69421936e-03 1.79354315e-04 -6.35383797e-04] [-1.35021330e-04 -1.74815154e-03 -9.32474373e-04] [-2.48066895e-03 -7.90887012e-04 7.98001320e-04] [-8.78495061e-05 -7.73372704e-04 1.11003312e-03] [ 2.32394755e-04 1.36308739e-03 -1.12378172e-04] [ 8.05773837e-04 -1.24195478e-03 4.37482481e-04] [-3.72398450e-04 9.26888133e-04 -4.69516077e-04] [-6.68781921e-04 -8.20079683e-04 -1.02019647e-03] [ 3.39874739e-04 6.91484882e-04 1.21714441e-03] [-1.05932157e-03 -1.16992887e-03 8.00069760e-04] [-2.74356422e-04 6.46889417e-04 -8.24024212e-04] [ 9.73776198e-04 -1.13720777e-03 -4.11912404e-04] [ 2.87645068e-03 1.13430705e-04 -3.56650795e-04] [-8.42683182e-04 5.19987481e-04 -1.70915037e-03] [-2.43230248e-03 1.69880322e-04 2.92592481e-04] [ 3.52343365e-04 3.92091339e-04 1.65310577e-03] [ 2.94870565e-04 6.02044546e-04 -1.42333934e-04] [-5.80316608e-04 1.31241318e-04 -1.27902349e-03] [-2.69594696e-04 6.95487477e-04 -3.46018343e-04] [ 5.60583496e-04 4.44310640e-05 7.90253207e-04] [ 1.13150497e-03 1.26457624e-04 1.15625899e-03] [-1.14578616e-03 -4.88265905e-05 -1.10285230e-03] [ 8.62814226e-04 4.13857049e-04 3.88448602e-04] [-8.75777364e-04 3.71405813e-05 5.15277096e-05] [ 6.36388740e-04 -3.00077997e-04 -1.30241481e-03] [-6.37691398e-04 -5.48153041e-04 8.00710233e-04] [-5.73165874e-04 1.06417942e-03 -1.80133714e-03] [ 5.77446195e-04 8.63861568e-04 1.13117888e-03] [-9.62549641e-04 -3.34360488e-03 4.43386831e-04] [ 1.00458480e-03 -1.32490211e-03 -9.17000267e-04] [-5.93279076e-04 -1.03867298e-03 -4.84748282e-04] [ 5.88392067e-04 -5.41119801e-04 -1.14413140e-04] [-1.08967066e-03 7.63913838e-04 1.19405909e-03] [ 1.06903644e-03 9.62959799e-04 -1.25328290e-03] [ 8.77197050e-04 -5.08798625e-04 -1.60667079e-03] [-8.44010180e-04 -7.66129859e-04 2.02620524e-03] [ 3.01894475e-04 1.03325777e-03 -5.17711868e-04] [ 4.74217778e-06 5.43663755e-04 -7.40131574e-04] [ 1.11169409e-04 1.01409248e-03 3.95598762e-04] [-4.26966377e-04 5.66544674e-04 6.42730026e-04] [-5.55415248e-04 -8.96068899e-04 -1.32865591e-03] [ 7.77671186e-04 -1.09478877e-03 5.32107949e-04] [ 4.53959257e-04 -6.91164764e-04 1.49199755e-03] [-7.02475636e-04 -1.31136504e-03 -4.11406214e-04]] Final stress: [-6.70296732e-06 7.18272136e-06 -3.27299266e-05 1.18165527e-05 3.53664346e-08 -4.18182402e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-3.81064512e-04 7.32979883e-03 1.80846604e-04] [ 1.05973307e-04 1.10409681e-03 -8.54411920e-04] [-1.41986983e-03 -1.71102306e-03 -4.15421357e-04] [ 1.51427141e-03 -2.59184374e-03 1.66896771e-04] [-1.99170051e-03 -1.16157708e-03 -5.22734833e-03] [ 2.21326740e-03 5.15471417e-04 4.62971104e-03] [ 1.92114457e-03 6.85005592e-04 3.34465666e-03] [-1.79815692e-03 1.90889681e-04 -2.27775291e-03] [ 4.72005877e-06 -1.75577373e-03 1.44314402e-03] [-4.20369169e-05 -2.28958457e-03 -2.25221714e-03] [-1.31615438e-03 -6.12260785e-04 5.17117590e-03] [ 1.33978718e-03 -1.32496406e-03 -5.23624275e-03] [ 1.08514415e-03 2.24456468e-03 1.17937462e-03] [-1.06266934e-03 2.56767905e-03 -2.03586672e-03] [ 5.33782133e-03 -2.53283618e-03 4.10988834e-03] [-5.38608294e-03 -1.18082904e-03 -1.10614014e-03] [ 2.24141688e-04 3.17579570e-04 5.40044291e-04] [-4.00246048e-04 -6.85151741e-04 -1.62604027e-03] [-6.10353970e-04 -2.35149067e-03 -7.26613508e-04] [ 5.75306385e-04 -1.61842552e-03 2.24467276e-03] [-3.90458508e-03 9.60838177e-04 4.88175917e-04] [ 3.92538698e-03 7.68006764e-04 -1.33737158e-04] [ 1.98119657e-03 7.01652164e-05 9.95969853e-04] [-1.93897683e-03 8.45917407e-05 8.96011212e-04] [-9.17830987e-05 -6.16669811e-03 -1.57995737e-03] [ 1.08651091e-05 -3.25959768e-03 7.14616488e-04] [-2.47219928e-04 -3.68608167e-04 -5.08468026e-03] [ 2.64988248e-04 -2.76580976e-04 2.48807374e-03] [-2.20717909e-03 3.80606994e-03 7.78548067e-03] [ 1.87201358e-03 2.98301603e-03 -2.59977329e-03] [-8.34284249e-04 -2.19694025e-03 4.00654334e-04] [ 8.11718799e-04 -1.26782580e-03 -2.98427908e-03] [ 2.77209109e-03 -3.88059018e-03 -1.59932893e-03] [-2.82149522e-03 -5.66968595e-04 7.15217523e-04] [ 3.96414225e-04 3.65718757e-05 6.71625687e-04] [-1.14854969e-03 5.16364334e-03 3.19295815e-04] [-2.55498823e-03 1.33252958e-03 1.31687560e-03] [ 2.58923988e-03 4.35774689e-03 1.74020347e-03] [ 9.06231619e-04 4.54214034e-04 1.34937496e-03] [ 2.74574776e-03 3.61702025e-03 -3.49622388e-04] [-1.51647558e-03 1.14132258e-03 -4.78181274e-04] [-2.02508999e-03 3.06841604e-03 1.08545966e-03] [ 3.46746767e-03 3.12441739e-04 4.84962993e-03] [ 9.53114363e-04 2.45931601e-03 3.40474609e-03] [-2.93912517e-03 4.09581012e-03 -4.99178473e-03] [-1.25354342e-03 -1.32720556e-03 -3.53149455e-03] [ 1.56557036e-03 -5.86562858e-04 1.70359243e-03] [-1.41095537e-03 -1.13385751e-03 4.71934668e-04] [-8.69432711e-04 -2.32275898e-03 -1.97171661e-04] [ 1.07575977e-03 5.86081696e-04 1.01454501e-03] [-4.05563913e-04 3.39353441e-04 1.88643762e-03] [ 3.40260889e-03 8.63339899e-04 -3.91514194e-03] [-4.95691749e-04 1.65894868e-04 -3.29552514e-03] [-2.07758594e-03 1.17860469e-03 2.75719556e-03] [-1.32146482e-03 2.89417246e-04 -2.00823812e-03] [ 6.76489403e-03 1.77466455e-04 1.64539039e-03] [ 3.81540631e-04 7.17990926e-04 1.85013755e-03] [-6.30343411e-03 -3.39407601e-04 -1.81005950e-03] [ 6.15306728e-04 -1.96081900e-03 3.12907331e-03] [ 6.76835776e-03 -1.69282991e-03 1.93497351e-03] [-1.50466586e-04 -4.73204067e-03 -2.87128493e-03] [-7.16500703e-03 1.04567942e-03 -1.76722234e-03] [ 1.55844440e-03 -1.94403525e-03 -4.28175919e-03] [ 1.41536352e-03 1.95198921e-03 -2.18692778e-03] [-2.09039267e-03 -2.98048908e-03 2.19867632e-03] [-8.67257508e-04 3.08820607e-03 6.19709662e-05] [-1.44271841e-03 -3.81840517e-03 -1.22685365e-03] [ 1.28685339e-04 1.37195389e-03 -1.25472325e-03] [ 2.26839736e-03 -3.71155761e-03 2.53842075e-03] [-7.93360232e-04 1.36829057e-03 2.60151245e-03] [-1.97601282e-03 2.47942760e-03 4.77072328e-03] [ 8.03487861e-03 3.75914417e-04 7.80497606e-04] [ 2.51330701e-03 2.49224698e-03 -5.26027856e-03] [-8.24140596e-03 8.40969548e-04 -1.31176339e-03] [-1.09222070e-03 4.42325600e-04 2.36392498e-03] [ 1.01060277e-03 2.04873176e-03 -7.84506024e-04] [ 1.57353822e-03 5.34645061e-04 -3.90544238e-03] [-1.49114978e-03 1.88181270e-03 -7.49513607e-04] [-2.68444338e-03 -3.99208652e-04 3.20682590e-03] [ 2.77665905e-03 -1.15331111e-03 -2.88901111e-03] [-1.07991374e-03 6.04795508e-04 4.70454989e-04] [ 1.15432615e-03 -6.03110211e-04 9.15343585e-04] [-1.67905480e-03 -3.62099499e-04 -3.72241253e-03] [ 1.68717411e-03 -1.13571713e-03 1.98489163e-03] [ 2.11262008e-03 3.19078339e-03 -4.89922493e-03] [-2.15730559e-03 2.62359763e-03 3.12789829e-03] [ 1.31523636e-03 -8.24048595e-03 1.08031252e-03] [-1.63604503e-03 -8.06172955e-04 -2.82548170e-03] [ 3.52196074e-04 -2.40012001e-03 -7.23774295e-04] [-3.20535219e-04 -7.69071763e-04 -1.05842776e-03] [ 3.21126626e-03 2.31372707e-03 3.51670853e-03] [-3.06545743e-03 3.00685910e-03 -3.45725348e-03] [-2.39355825e-03 -9.46564032e-04 -4.27859442e-03] [ 2.13520342e-03 -3.00730507e-03 5.64845390e-03] [ 9.26691107e-04 2.43845909e-03 3.27737496e-03] [ 1.71059934e-04 1.89686824e-03 1.04071325e-04] [ 6.53231001e-05 1.83050393e-03 -2.57393801e-03] [-1.08600340e-03 2.45881713e-03 3.78255568e-04] [ 1.91293995e-03 -3.37473906e-03 -1.02231694e-03] [-1.24093338e-03 -1.71745698e-03 3.79067906e-03] [-2.07534924e-03 -2.36668708e-03 1.22820252e-03] [ 1.58834631e-03 -2.63997045e-03 -3.30256045e-03]] Final stress: [-2.86613107e-05 3.04670250e-05 -7.95949309e-05 1.86377492e-05 -2.24833090e-07 1.06923423e-04] Minimization converged after 142 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.73866362e-04 -1.26085601e-03 -4.53403406e-04] [ 2.01198343e-04 -3.87301044e-03 5.34097499e-04] [-5.16645337e-04 9.69079242e-04 1.88144122e-04] [ 5.07198538e-04 8.29089530e-04 -6.53132462e-05] [-6.53255513e-04 1.40663057e-04 1.50268402e-03] [ 6.31993391e-04 4.38440272e-04 -1.67288185e-03] [ 4.85765528e-04 3.66389564e-04 -7.77928575e-04] [-5.02674988e-04 7.00726503e-04 1.96472291e-03] [-2.10332631e-04 -2.81594684e-04 -1.19060337e-03] [ 2.09528300e-04 -2.87710360e-04 6.39607801e-04] [-4.80487129e-04 2.38590836e-04 -1.38831335e-03] [ 4.80763380e-04 1.97728050e-04 1.50220910e-03] [ 3.16110492e-04 -7.04286244e-04 -7.55181921e-04] [-3.17460381e-04 -5.66168299e-04 4.57685540e-04] [ 1.98544227e-03 1.08357589e-04 -9.65003805e-04] [-1.98267949e-03 1.09500361e-03 1.63406505e-03] [ 7.82385167e-05 2.48472663e-04 -3.03467656e-04] [-6.37700951e-05 -1.71285587e-04 4.48861131e-05] [-3.31599309e-04 2.81807839e-04 9.44060268e-04] [ 3.35428105e-04 2.96633070e-04 -4.64906820e-04] [-9.47159096e-04 6.99238594e-04 5.96835358e-04] [ 9.44479370e-04 5.14940667e-04 -2.27026806e-04] [ 4.49069025e-04 -2.49555577e-04 1.09406631e-04] [-4.51812043e-04 -4.15478493e-04 5.64114587e-04] [ 1.63205565e-04 1.18120272e-03 -5.06471710e-04] [-1.53622537e-04 1.50828937e-03 -3.17379021e-04] [-3.08713328e-04 8.00363803e-05 8.70080322e-04] [ 3.09164058e-04 -1.66882104e-04 -1.21562114e-03] [-6.02162943e-04 -1.02900451e-03 -5.94738833e-04] [ 6.31205849e-04 -9.35940202e-04 2.30108594e-03] [-2.20201288e-04 2.78720422e-04 -7.94570379e-04] [ 2.20476381e-04 4.14456409e-04 7.95017021e-05] [ 7.84340229e-04 3.09956471e-04 2.02554045e-04] [-7.79373345e-04 1.12883475e-03 -5.91214508e-04] [ 2.57744268e-04 -1.55177365e-03 -3.15191321e-05] [-5.80941043e-04 4.47509229e-06 2.45584275e-04] [-3.78909540e-04 -1.29246740e-03 6.19647923e-04] [ 7.73919902e-04 -3.00661350e-04 3.41448838e-04] [-6.60155856e-04 -1.22268536e-03 6.84535627e-05] [ 3.00526421e-04 -1.95588247e-04 5.50002303e-04] [ 5.65334969e-04 -1.15976545e-03 -1.35609291e-04] [-2.12886754e-04 -2.69683028e-04 -6.05577677e-04] [-4.17888126e-06 -4.74551037e-04 6.93005999e-04] [-6.85369043e-04 -2.63768063e-04 1.14420842e-03] [ 2.53794495e-04 3.43353050e-04 -9.87794036e-04] [ 4.17492022e-04 -1.08067850e-03 -1.44467245e-03] [-1.62888619e-04 3.70454571e-04 1.44753358e-04] [-6.04343529e-04 -1.68767938e-04 4.20016147e-04] [ 2.66550672e-04 -1.47390261e-04 3.53314020e-04] [ 4.75667142e-04 3.46110788e-04 8.42036271e-05] [-9.45024365e-04 -3.67760100e-04 -1.19972442e-03] [-9.07445230e-05 -1.18279965e-04 5.96063205e-04] [ 9.32415517e-04 -3.74796659e-04 8.53893039e-04] [ 6.14376828e-05 -1.23936002e-04 -9.61504478e-04] [-1.97672213e-03 -7.69743624e-05 4.95668276e-04] [ 2.57371189e-04 -8.63383828e-05 -6.56260549e-04] [ 2.16842014e-03 3.02245168e-06 -6.33244468e-04] [-4.07655326e-04 -1.64468439e-04 5.18835515e-04] [-1.87696858e-03 6.82238780e-04 5.90155648e-04] [ 2.70686504e-05 5.12202410e-04 8.30104113e-04] [ 2.08221387e-03 -8.96274023e-05 -4.57673404e-04] [-2.38735051e-04 1.28720109e-03 -6.87152625e-04] [-2.49977106e-04 -8.03532701e-04 -7.99942883e-05] [-8.13018697e-04 5.21314836e-04 -5.20707216e-04] [ 2.14470954e-04 -1.25326741e-03 -3.99148678e-04] [ 8.44199590e-04 9.62178346e-04 3.74586424e-05] [-3.42041226e-04 -6.91882126e-04 -7.55958935e-04] [ 1.01553416e-03 7.75980551e-04 -2.95134856e-04] [ 3.43110434e-04 -7.39861583e-04 1.04022976e-03] [-1.02708402e-03 8.17358665e-04 5.75618117e-04] [-1.86948630e-03 -8.20422311e-05 3.01933880e-04] [ 1.92070417e-04 -2.17109542e-04 1.33880159e-03] [ 2.34567874e-03 1.43527354e-05 -3.34953926e-04] [-6.98496200e-04 -3.60057329e-04 -1.36502013e-03] [-1.15447066e-04 -4.14677674e-04 -3.34806939e-04] [ 5.53639642e-04 5.07011698e-05 7.23543037e-04] [ 6.42373252e-05 -3.16386754e-04 -1.88862954e-05] [-4.93891156e-04 -4.43993437e-05 -1.07760288e-03] [-8.10876485e-04 -1.58057867e-04 -8.00130055e-04] [ 8.01292658e-04 -2.47700543e-04 8.95151599e-04] [-9.34365541e-04 -1.51664670e-04 -2.42883364e-04] [ 9.24844101e-04 -4.60992224e-04 5.95030423e-04] [-5.80589177e-04 5.50850742e-04 7.43358087e-04] [ 5.79128103e-04 3.72935888e-04 -1.08793375e-03] [ 3.72891054e-04 -5.86877213e-04 7.59300767e-04] [-3.71242439e-04 -8.37785556e-04 -1.42992198e-03] [ 1.00743987e-03 1.55241817e-03 -6.65664762e-04] [-9.83567691e-04 3.49091899e-03 2.36419459e-04] [ 7.03029446e-04 5.53405113e-04 1.76508812e-04] [-7.06914432e-04 9.28963348e-04 -6.52313036e-04] [ 7.90343408e-04 -6.66428899e-04 -1.01738087e-03] [-8.03799336e-04 -5.86910521e-04 9.57198361e-04] [-6.97033838e-04 4.96828045e-04 1.50358125e-03] [ 7.15376001e-04 4.58037671e-04 -1.15540937e-03] [ 1.20298090e-04 -7.87549267e-04 5.37028383e-04] [-4.03116069e-04 -2.57692287e-04 1.02674536e-04] [ 2.69731762e-04 -6.79836493e-04 -8.33681444e-04] [ 8.35855399e-06 -3.64703054e-04 -3.88309340e-04] [ 3.45216564e-04 5.18560692e-04 1.36105930e-03] [-6.10307824e-04 1.01467432e-03 -2.87397925e-04] [-4.16033225e-04 6.59455475e-04 -1.18128270e-03] [ 6.64171719e-04 8.66498793e-04 4.39286374e-04]] Final stress: [-4.95068608e-06 5.16491206e-06 -2.70498613e-05 -9.95236260e-06 2.46862111e-08 3.16360153e-05] Minimization converged after 27 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 4.51821940e-04 4.44405791e-05 -4.45387872e-05] [ 2.70567698e-04 -5.16400858e-05 -4.68379697e-05] [ 4.18695376e-04 -4.79297547e-05 5.66373380e-05] [ 1.17507889e-04 4.88197047e-05 4.88342230e-05] [ 2.78624832e-04 -9.38822296e-05 -2.78638835e-05] [ 4.39625967e-04 8.64940787e-05 -2.70885912e-05] [-2.73859499e-04 9.33045445e-05 -4.13044406e-05] [-6.67643139e-05 -1.03575217e-04 -4.94440779e-05] [ 4.96610503e-04 -8.48866446e-06 -8.78530112e-05] [-4.10415462e-05 6.98396994e-06 -8.65649202e-05] [-5.21738067e-06 4.18813042e-05 -4.25101380e-05] [-5.87001861e-04 -4.57107159e-05 -4.65749115e-05] [-1.19833328e-04 -5.82784334e-05 -1.94847291e-04] [ 3.92458707e-04 5.52100308e-05 -1.91240079e-04] [-4.55749013e-04 -1.76099600e-04 -1.81758879e-04] [ 4.72639998e-04 1.77389303e-04 -1.79567170e-04] [ 1.19265071e-05 3.97440701e-05 -5.40229592e-05] [-1.29963582e-04 -3.45041202e-05 -5.01239750e-05] [ 2.38928746e-04 2.33054774e-05 1.20151983e-04] [-2.65180219e-04 -2.21987585e-05 1.20433248e-04] [ 3.96976381e-05 -1.09063738e-05 2.41369042e-05] [-2.81451796e-04 7.90843251e-06 3.07657194e-05] [-5.66586434e-04 -1.07561349e-04 7.94382959e-05] [-3.83904553e-05 1.03704145e-04 7.99884498e-05] [ 3.58347463e-04 -1.40689716e-04 3.60224665e-05] [ 4.03676477e-04 1.21094508e-04 1.88944810e-05] [ 4.69505327e-05 2.07297164e-04 2.41914871e-04] [ 1.61900216e-04 -2.01580416e-04 2.38698859e-04] [ 3.70327703e-04 -1.58139594e-05 2.26198978e-04] [-1.06024709e-04 2.45401870e-05 2.25299758e-04] [ 5.15510267e-04 1.84974737e-05 -9.05030398e-05] [ 2.98685205e-04 -1.56134308e-05 -9.37779916e-05] [-1.45380074e-04 5.76944153e-05 -5.19605935e-05] [ 1.51590935e-04 -5.17584073e-05 -5.22567999e-05] [-2.52403781e-04 -4.77223689e-05 -1.31692683e-04] [ 1.97023049e-04 -8.98857035e-05 3.41895901e-05] [ 1.63410406e-04 2.46433754e-04 5.12805184e-05] [-2.49768564e-04 -9.98213266e-05 2.22623331e-04] [ 2.91582132e-05 2.08591373e-04 1.62341111e-04] [-6.89226224e-05 4.08053925e-05 -1.14404894e-04] [-8.38436058e-05 2.40379709e-05 1.19772435e-04] [ 4.20461957e-05 -2.73113135e-04 -1.53882079e-04] [-3.37387837e-04 -3.01511274e-04 1.96240132e-04] [-3.67246705e-04 6.73398568e-04 -3.94385383e-04] [-2.25507205e-04 -4.96341524e-04 3.05742224e-04] [-4.71073397e-04 1.09350475e-04 -2.61729497e-04] [-1.27468956e-04 1.02090114e-04 -1.96738720e-04] [-2.22700160e-04 -1.47788293e-04 -1.45117693e-04] [-2.86676272e-04 1.12381966e-04 1.75645983e-04] [-6.10332734e-05 -7.52031896e-05 2.15403617e-04] [ 3.18901311e-04 8.34823685e-05 -1.49526212e-04] [-2.89475020e-04 -1.04038735e-04 1.52721206e-04] [-2.36215444e-04 -2.15407358e-05 -1.78106773e-04] [ 2.84335618e-04 4.88941032e-05 1.25751836e-04] [ 4.76809569e-04 2.45158272e-04 1.47326026e-04] [-4.65635817e-04 -1.11193614e-04 -1.84954706e-04] [ 2.27468997e-06 -1.09251396e-04 1.73573356e-04] [ 1.24028038e-05 -1.92913247e-05 -1.64041895e-04] [ 4.78072922e-04 1.50427849e-04 1.63355130e-04] [-2.59562717e-04 3.86035840e-04 -1.64624312e-04] [-1.49281375e-04 -5.92092871e-04 2.38637127e-04] [ 3.65431198e-04 5.26127313e-05 -8.53842343e-05] [-1.82054315e-04 4.47684953e-04 2.68023626e-04] [ 6.95457879e-05 6.18325322e-05 -2.24178703e-04] [-2.15026383e-05 -4.62292069e-05 2.83755490e-04] [-8.96063169e-05 -4.65180396e-04 -2.03377902e-04] [ 7.26044843e-05 2.24164721e-04 3.40989152e-04] [-3.39673445e-04 -3.11376600e-04 2.99159557e-04] [-4.69536378e-04 1.98454550e-04 -3.24433051e-04] [ 1.93934016e-04 -1.10198932e-04 -3.65823196e-04] [ 4.32325310e-04 1.36478316e-04 1.53983144e-04] [-3.95604907e-04 -4.88370466e-06 -1.66129073e-04] [-7.15284749e-05 1.38572608e-05 2.71425842e-04] [ 1.14298909e-04 -1.35967796e-04 -4.86717764e-05] [ 3.43633346e-04 1.01731750e-04 1.27264173e-04] [ 1.21283358e-04 -1.05522979e-04 -1.94495672e-04] [ 6.32483503e-06 1.81531862e-04 6.61743478e-05] [ 4.66220547e-04 -1.79491620e-04 -2.61878781e-04] [ 1.06221000e-04 6.54826476e-05 6.60276604e-05] [-1.84709039e-04 -5.74915777e-05 6.29955088e-05] [ 5.90230609e-04 1.29800375e-05 4.46715775e-05] [-5.98675440e-04 -1.34718875e-05 4.45184884e-05] [-1.31899274e-04 -7.36511170e-06 -2.93936424e-05] [-1.35022643e-04 3.32060205e-06 -3.10448550e-05] [ 5.57416576e-04 -1.18167548e-04 -2.97374354e-05] [ 2.79788536e-05 1.19970782e-04 -3.21162167e-05] [-6.29328046e-04 8.47314355e-05 -4.79314196e-05] [ 2.63802143e-04 -6.16533417e-05 -5.50683192e-05] [-7.67095703e-04 -3.51139394e-05 -3.13651224e-05] [ 2.05927458e-04 3.15037868e-05 -2.74678429e-05] [-2.20972991e-04 6.18496914e-05 -2.17907086e-05] [ 1.07135967e-04 -6.11042578e-05 -2.37447771e-05] [ 4.41059184e-04 -1.29061750e-06 6.15415577e-05] [ 7.77511466e-06 1.19558851e-05 6.00687496e-05] [-1.21224041e-04 5.85900320e-04 -2.50770371e-04] [ 1.59170561e-04 1.76643038e-04 1.19867054e-04] [ 2.45173935e-04 -1.94613502e-04 4.40369235e-05] [-2.13974740e-04 -5.74440311e-04 4.17694862e-04] [-3.11721059e-04 3.77764499e-04 -2.96185030e-04] [-2.04523072e-04 -3.50697495e-05 4.90645493e-05] [-1.27691252e-04 -1.29818901e-04 -2.64646138e-04] [-3.85031833e-04 -2.16370131e-04 8.21971621e-05]] Final stress: [-1.42678094e-06 -4.85253641e-07 -1.04776612e-05 -1.40836630e-08 7.12533822e-07 -5.89346626e-06] Minimization converged after 152 steps. Minimization converged after 153 steps. Minimization converged after 151 steps. Minimization converged after 123 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.30906319e-03 -1.28226380e-02 -3.29757331e-03] [ 2.30906321e-03 1.28226379e-02 -3.29757327e-03] [-3.38061622e-03 3.42225155e-03 3.45355198e-04] [ 3.38061623e-03 -3.42225155e-03 3.45355159e-04] [-4.76680981e-03 -1.79588281e-03 3.71303837e-05] [ 4.76680980e-03 1.79588281e-03 3.71303994e-05] [ 1.11862960e-02 6.74654992e-03 -1.10197808e-02] [-1.11862960e-02 -6.74654988e-03 -1.10197807e-02] [ 4.29761427e-03 5.91170744e-04 3.25612765e-03] [-4.29761427e-03 -5.91170734e-04 3.25612763e-03] [-1.30602270e-03 2.01581461e-03 -3.03737522e-03] [ 1.30602270e-03 -2.01581461e-03 -3.03737523e-03] [ 1.29549981e-04 6.23004383e-04 -1.71714615e-03] [-1.29549994e-04 -6.23004387e-04 -1.71714618e-03] [ 8.69677105e-03 9.35193166e-03 2.81861451e-03] [-8.69677106e-03 -9.35193167e-03 2.81861454e-03] [-1.21542970e-03 -7.17991626e-04 -1.55330989e-04] [ 1.21542969e-03 7.17991626e-04 -1.55330975e-04] [ 4.07663677e-03 -3.47537703e-03 1.32982578e-03] [-4.07663676e-03 3.47537703e-03 1.32982575e-03] [-7.76654834e-03 -4.06501611e-04 -1.45120485e-03] [ 7.76654835e-03 4.06501618e-04 -1.45120481e-03] [ 6.36759417e-03 -1.20869461e-02 -3.21933862e-03] [-6.36759419e-03 1.20869460e-02 -3.21933861e-03] [ 2.48845430e-03 -6.96394399e-03 3.74508649e-03] [-2.48845429e-03 6.96394398e-03 3.74508646e-03] [ 2.71643500e-03 -2.45519651e-03 -5.83143637e-03] [-2.71643500e-03 2.45519654e-03 -5.83143637e-03] [-8.47342332e-03 2.86245179e-03 6.42764031e-04] [ 8.47342331e-03 -2.86245178e-03 6.42764023e-04] [-1.08999303e-06 -9.97406631e-04 -2.26595814e-03] [ 1.08998553e-06 9.97406625e-04 -2.26595814e-03] [ 6.01474253e-03 -9.23639444e-04 1.86738683e-03] [-6.01474253e-03 9.23639455e-04 1.86738680e-03] [ 2.12411739e-03 -6.14984550e-03 1.43804237e-03] [-2.12411741e-03 6.14984551e-03 1.43804237e-03] [-7.30466384e-03 -5.70333179e-03 -5.44187092e-04] [ 7.30466384e-03 5.70333180e-03 -5.44187101e-04] [-4.96467427e-04 -2.02452720e-03 -1.76526486e-03] [ 4.96467430e-04 2.02452716e-03 -1.76526490e-03] [-1.54217163e-03 5.17695562e-03 1.20102353e-02] [ 1.54217164e-03 -5.17695564e-03 1.20102353e-02] [ 3.49355324e-03 2.83669279e-04 7.70166305e-03] [-3.49355327e-03 -2.83669295e-04 7.70166304e-03] [-4.58742770e-03 8.07397880e-03 -5.91418192e-03] [ 4.58742770e-03 -8.07397878e-03 -5.91418192e-03] [ 1.25939494e-02 -7.26834313e-03 -7.58816934e-03] [-1.25939495e-02 7.26834309e-03 -7.58816928e-03] [-1.10243732e-02 -4.21848188e-03 1.32264776e-03] [ 1.10243731e-02 4.21848185e-03 1.32264771e-03] [-4.39217435e-04 4.60470985e-03 4.61442498e-03] [ 4.39217438e-04 -4.60470983e-03 4.61442499e-03] [-4.46000197e-03 2.58121733e-03 -5.29045559e-03] [ 4.46000199e-03 -2.58121735e-03 -5.29045560e-03] [-6.84409763e-03 6.18588472e-03 -1.09901193e-03] [ 6.84409766e-03 -6.18588473e-03 -1.09901193e-03] [ 1.64332234e-03 1.93539775e-03 4.10244859e-03] [-1.64332234e-03 -1.93539775e-03 4.10244859e-03] [-6.09737720e-03 -1.11327979e-03 -2.08190063e-04] [ 6.09737721e-03 1.11327979e-03 -2.08190067e-04] [ 5.17002513e-03 -3.39604592e-03 1.54335964e-04] [-5.17002512e-03 3.39604592e-03 1.54335974e-04] [-3.48783586e-03 -2.66463595e-03 -1.55461626e-02] [ 3.48783589e-03 2.66463591e-03 -1.55461627e-02] [-2.42938476e-03 3.17296473e-03 1.75851627e-02] [ 2.42938480e-03 -3.17296479e-03 1.75851628e-02] [ 3.39532642e-03 -1.62465266e-04 2.12028914e-03] [-3.39532641e-03 1.62465266e-04 2.12028913e-03] [ 2.38711597e-03 1.95332391e-03 1.49701351e-03] [-2.38711599e-03 -1.95332392e-03 1.49701351e-03] [-9.58302426e-03 -3.99152678e-03 1.80107734e-03] [ 9.58302425e-03 3.99152677e-03 1.80107733e-03] [ 4.01923180e-03 -6.65435189e-03 -4.97566068e-03] [-4.01923178e-03 6.65435190e-03 -4.97566066e-03] [ 3.50033930e-03 3.57939461e-04 1.87394032e-03] [-3.50033929e-03 -3.57939453e-04 1.87394032e-03] [ 3.28417702e-03 -1.73708073e-03 -8.06742186e-03] [-3.28417702e-03 1.73708073e-03 -8.06742186e-03] [-6.93703683e-03 2.51173931e-03 -1.48711934e-03] [ 6.93703682e-03 -2.51173929e-03 -1.48711933e-03] [ 8.70933919e-03 -1.37894753e-04 9.81050079e-04] [-8.70933919e-03 1.37894761e-04 9.81050077e-04] [-2.21812440e-03 1.73456450e-03 -3.28788557e-03] [ 2.21812438e-03 -1.73456449e-03 -3.28788557e-03] [ 3.49939241e-03 -3.60762094e-03 4.38023012e-03] [-3.49939243e-03 3.60762092e-03 4.38023011e-03] [-1.40550412e-02 3.85292947e-03 -4.78723131e-04] [ 1.40550412e-02 -3.85292931e-03 -4.78723126e-04] [-9.73901353e-03 -1.38323879e-03 -7.09815702e-04] [ 9.73901351e-03 1.38323880e-03 -7.09815695e-04] [ 1.01923794e-02 -2.44202023e-03 1.32148427e-03] [-1.01923794e-02 2.44202024e-03 1.32148429e-03] [-3.42870653e-03 1.38117905e-02 1.30935249e-03] [ 3.42870655e-03 -1.38117904e-02 1.30935250e-03] [-5.38948754e-03 5.10476350e-03 7.60347490e-03] [ 5.38948756e-03 -5.10476350e-03 7.60347486e-03] [ 4.98494100e-03 -5.77694718e-04 3.58851719e-03] [-4.98494099e-03 5.77694714e-04 3.58851719e-03] [ 7.42188665e-03 6.41730720e-03 2.48895753e-03] [-7.42188665e-03 -6.41730720e-03 2.48895752e-03] [-4.53391038e-03 4.36977786e-03 -2.97924435e-03] [ 4.53391038e-03 -4.36977786e-03 -2.97924434e-03]] Final stress: [-8.33609799e-05 6.00651429e-05 -6.55126855e-05 -3.63601198e-14 5.51903212e-15 1.44214714e-04] Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 2.02025699e-04 2.85799345e-04 -1.14591372e-04] [-2.02025698e-04 -2.85799299e-04 -1.14591384e-04] [ 1.80330332e-04 -4.35648841e-06 8.21345169e-05] [-1.80330333e-04 4.35648136e-06 8.21345220e-05] [ 3.02589797e-04 7.95104381e-05 -1.81705111e-04] [-3.02589797e-04 -7.95104390e-05 -1.81705112e-04] [-2.18972272e-04 1.87938471e-04 -3.38539863e-04] [ 2.18972272e-04 -1.87938483e-04 -3.38539881e-04] [ 1.32179677e-04 1.27193998e-04 -4.72692083e-04] [-1.32179677e-04 -1.27193999e-04 -4.72692083e-04] [ 3.71510897e-05 -1.85219574e-04 3.32982990e-05] [-3.71510895e-05 1.85219572e-04 3.32982950e-05] [-3.44011761e-04 -2.71318396e-05 -1.44012636e-04] [ 3.44011760e-04 2.71318418e-05 -1.44012633e-04] [-7.15256743e-04 -1.42353945e-04 2.15705153e-04] [ 7.15256743e-04 1.42353933e-04 2.15705146e-04] [ 6.96022158e-05 2.47850310e-04 -1.89550742e-04] [-6.96022161e-05 -2.47850307e-04 -1.89550739e-04] [ 8.71000134e-05 -1.62307715e-04 3.14197689e-04] [-8.71000153e-05 1.62307720e-04 3.14197692e-04] [ 3.70307902e-04 -2.28724839e-04 5.51031947e-04] [-3.70307902e-04 2.28724839e-04 5.51031947e-04] [-2.63707752e-04 1.56158861e-04 2.91912027e-04] [ 2.63707752e-04 -1.56158834e-04 2.91912019e-04] [-2.07959495e-04 -2.13392899e-04 -2.76793302e-04] [ 2.07959496e-04 2.13392894e-04 -2.76793308e-04] [-4.06590215e-06 1.81710698e-04 -7.69776706e-06] [ 4.06590298e-06 -1.81710702e-04 -7.69776774e-06] [ 2.72402181e-04 3.22071589e-04 2.55018996e-04] [-2.72402181e-04 -3.22071587e-04 2.55018999e-04] [ 1.87293187e-04 -4.15588186e-04 8.00053766e-05] [-1.87293188e-04 4.15588187e-04 8.00053775e-05] [-2.49051998e-04 -7.70460327e-06 -1.06460444e-04] [ 2.49051999e-04 7.70459306e-06 -1.06460440e-04] [-2.68536900e-04 2.49629731e-04 3.84870288e-04] [ 2.68536902e-04 -2.49629734e-04 3.84870288e-04] [ 3.18513664e-04 3.61039022e-04 4.89188472e-04] [-3.18513665e-04 -3.61039023e-04 4.89188473e-04] [ 1.12317603e-04 1.78436638e-04 2.79697816e-04] [-1.12317611e-04 -1.78436632e-04 2.79697819e-04] [-2.81208008e-04 1.30977250e-05 -2.41079989e-05] [ 2.81208015e-04 -1.30977203e-05 -2.41080013e-05] [-1.13743247e-04 -6.96636224e-04 -4.26519979e-04] [ 1.13743247e-04 6.96636222e-04 -4.26519978e-04] [ 1.00158933e-04 -1.00877640e-05 5.07296857e-05] [-1.00158933e-04 1.00877619e-05 5.07296839e-05] [-5.77174161e-06 1.96442610e-04 1.92463694e-04] [ 5.77174129e-06 -1.96442601e-04 1.92463685e-04] [ 1.38061064e-04 -4.12841470e-05 -1.33497447e-04] [-1.38061066e-04 4.12841552e-05 -1.33497438e-04] [ 2.90559085e-04 4.16509299e-05 -4.26493754e-04] [-2.90559085e-04 -4.16509286e-05 -4.26493756e-04] [-5.67808227e-05 -6.11257864e-05 -3.36297984e-04] [ 5.67808222e-05 6.11257872e-05 -3.36297982e-04] [ 2.59886094e-04 -4.54872573e-04 2.09097638e-04] [-2.59886093e-04 4.54872571e-04 2.09097639e-04] [-6.33680053e-05 3.08401762e-05 2.98822248e-05] [ 6.33680051e-05 -3.08401783e-05 2.98822233e-05] [ 3.05389024e-04 3.15602834e-04 -4.01131793e-05] [-3.05389023e-04 -3.15602836e-04 -4.01131789e-05] [-5.20217819e-04 -4.00293307e-04 4.89702989e-05] [ 5.20217820e-04 4.00293306e-04 4.89702987e-05] [-3.36923989e-04 3.02062513e-04 1.52128105e-04] [ 3.36923995e-04 -3.02062505e-04 1.52128108e-04] [-2.45243987e-05 3.70870517e-04 -4.50626426e-04] [ 2.45243922e-05 -3.70870510e-04 -4.50626430e-04] [ 1.30240021e-04 -1.60210070e-04 2.62561530e-04] [-1.30240021e-04 1.60210071e-04 2.62561530e-04] [-4.52542380e-04 2.03351770e-04 -4.12923624e-04] [ 4.52542379e-04 -2.03351769e-04 -4.12923624e-04] [ 4.49250785e-04 4.02353979e-04 -1.01829636e-04] [-4.49250786e-04 -4.02353977e-04 -1.01829634e-04] [-9.97372083e-05 -1.90349746e-05 3.79673436e-05] [ 9.97372087e-05 1.90349758e-05 3.79673442e-05] [ 9.76230133e-05 1.33323842e-04 -1.90365940e-05] [-9.76230130e-05 -1.33323842e-04 -1.90365974e-05] [-7.53709417e-05 4.88657664e-05 3.35945228e-05] [ 7.53709413e-05 -4.88657662e-05 3.35945254e-05] [ 3.15014079e-04 -9.17797607e-05 7.45103280e-05] [-3.15014078e-04 9.17797623e-05 7.45103286e-05] [ 4.63614243e-04 -2.24928595e-05 3.19831956e-05] [-4.63614242e-04 2.24928605e-05 3.19831936e-05] [ 3.25635232e-05 2.08442219e-04 -2.70796008e-04] [-3.25635233e-05 -2.08442219e-04 -2.70796007e-04] [ 1.53451807e-04 -1.05865689e-04 -2.00327548e-05] [-1.53451806e-04 1.05865694e-04 -2.00327487e-05] [-2.34019616e-04 8.76450611e-05 -3.23598739e-04] [ 2.34019616e-04 -8.76450953e-05 -3.23598737e-04] [-3.58921822e-04 2.88982056e-05 4.10498974e-05] [ 3.58921822e-04 -2.88982056e-05 4.10498954e-05] [-3.92493719e-04 -1.31031167e-04 -4.74022777e-05] [ 3.92493719e-04 1.31031170e-04 -4.74022786e-05] [ 1.73561560e-04 -9.46715217e-06 3.61039580e-04] [-1.73561557e-04 9.46712863e-06 3.61039581e-04] [ 2.22075147e-04 5.80614033e-05 -1.44793942e-04] [-2.22075144e-04 -5.80614086e-05 -1.44793929e-04] [ 3.16862824e-04 1.78352301e-04 3.18274481e-04] [-3.16862826e-04 -1.78352307e-04 3.18274468e-04] [-1.17708272e-04 -1.46722952e-04 -3.81413130e-06] [ 1.17708271e-04 1.46722948e-04 -3.81412483e-06] [ 3.33728505e-04 2.83872233e-05 1.92614703e-04] [-3.33728507e-04 -2.83872248e-05 1.92614696e-04]] Final stress: [ 7.72318199e-06 6.83190984e-06 -1.09962342e-05 -2.47983705e-15 4.75650673e-16 -1.29762143e-05] Minimization converged after 20 steps. Minimization converged after 118 steps. Minimization converged after 20 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 118 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 9.42449985e-05 -1.85009721e-04 -1.29031605e-04] [-9.42450021e-05 1.85009973e-04 -1.29031676e-04] [-1.98739426e-04 -7.08097590e-04 2.08719584e-04] [ 1.98739424e-04 7.08097510e-04 2.08719628e-04] [-3.85197465e-04 -9.48164119e-05 -1.41558461e-04] [ 3.85197465e-04 9.48163783e-05 -1.41558496e-04] [ 3.68048785e-05 -6.68472773e-04 1.51958683e-03] [-3.68048772e-05 6.68472677e-04 1.51958671e-03] [-2.16643867e-04 9.48139244e-05 -1.63978072e-04] [ 2.16643868e-04 -9.48139433e-05 -1.63978055e-04] [ 1.32886303e-05 4.13328757e-05 -3.37798675e-04] [-1.32886300e-05 -4.13328947e-05 -3.37798696e-04] [ 5.28973987e-04 1.19597840e-04 -3.11474787e-04] [-5.28973986e-04 -1.19597804e-04 -3.11474792e-04] [ 1.05286050e-03 -5.77124497e-04 -4.45246502e-04] [-1.05286050e-03 5.77124444e-04 -4.45246533e-04] [-6.27208798e-05 2.06063600e-04 -3.84460712e-04] [ 6.27208793e-05 -2.06063592e-04 -3.84460707e-04] [-2.72190559e-04 -3.46341510e-05 -3.92391382e-04] [ 2.72190558e-04 3.46341885e-05 -3.92391349e-04] [-3.08809628e-04 3.35989530e-04 1.39709271e-04] [ 3.08809627e-04 -3.35989536e-04 1.39709267e-04] [ 3.53453405e-04 -3.14732358e-05 1.01464339e-04] [-3.53453403e-04 3.14737233e-05 1.01464230e-04] [ 3.69443563e-04 -5.38961287e-04 1.69894001e-04] [-3.69443555e-04 5.38961255e-04 1.69893933e-04] [-3.09192006e-04 5.05818558e-04 5.69239946e-04] [ 3.09192006e-04 -5.05818672e-04 5.69239903e-04] [-2.11211768e-04 -2.43054315e-04 9.16987794e-04] [ 2.11211765e-04 2.43054326e-04 9.16987810e-04] [-5.64407500e-04 -5.47385368e-05 -2.49112097e-04] [ 5.64407504e-04 5.47385575e-05 -2.49112075e-04] [ 7.90954547e-05 4.08201484e-04 -2.72590831e-04] [-7.90954537e-05 -4.08201539e-04 -2.72590787e-04] [ 4.65384083e-04 -5.23992935e-04 1.26886915e-04] [-4.65384077e-04 5.23992923e-04 1.26886923e-04] [-3.66712481e-05 6.24684094e-05 1.09558719e-04] [ 3.66712398e-05 -6.24684223e-05 1.09558712e-04] [-1.14820788e-05 -5.32576954e-04 3.25046153e-04] [ 1.14819987e-05 5.32577048e-04 3.25046215e-04] [ 2.68398273e-04 -1.45283443e-04 -1.86276127e-04] [-2.68398191e-04 1.45283539e-04 -1.86276195e-04] [ 2.31804342e-04 -2.66081822e-04 3.28384823e-04] [-2.31804340e-04 2.66081817e-04 3.28384828e-04] [-5.55762183e-05 1.01591228e-03 -4.28971679e-04] [ 5.55762206e-05 -1.01591228e-03 -4.28971687e-04] [ 1.93174204e-04 1.37935989e-05 8.85449443e-05] [-1.93174231e-04 -1.37935098e-05 8.85448690e-05] [-5.65202090e-04 3.11675220e-04 -2.18688429e-04] [ 5.65202114e-04 -3.11675137e-04 -2.18688343e-04] [-2.43708097e-04 1.08205959e-04 -5.18882975e-04] [ 2.43708099e-04 -1.08205972e-04 -5.18882977e-04] [ 5.22451598e-04 -4.86531292e-04 3.19966266e-05] [-5.22451600e-04 4.86531281e-04 3.19966289e-05] [ 6.71317049e-04 2.06324757e-04 -1.34622090e-05] [-6.71317028e-04 -2.06324729e-04 -1.34622112e-05] [ 1.01206518e-03 8.21920472e-05 2.00570513e-04] [-1.01206520e-03 -8.21920268e-05 2.00570514e-04] [-3.86975001e-04 2.79790038e-04 4.19796533e-04] [ 3.86975009e-04 -2.79790061e-04 4.19796527e-04] [ 4.59755153e-04 -1.59492356e-04 -3.74360811e-05] [-4.59755160e-04 1.59492335e-04 -3.74360766e-05] [ 5.24623889e-04 -2.49895718e-04 1.84773242e-04] [-5.24623867e-04 2.49895747e-04 1.84773242e-04] [-1.02656052e-03 -4.10478137e-04 6.81167548e-04] [ 1.02656048e-03 4.10478177e-04 6.81167536e-04] [-7.03771577e-04 3.18888565e-04 -7.67572384e-04] [ 7.03771566e-04 -3.18888563e-04 -7.67572379e-04] [ 5.74432518e-04 -4.77429797e-04 2.63384094e-04] [-5.74432506e-04 4.77429797e-04 2.63384091e-04] [-1.25557728e-04 6.11179678e-05 2.28489965e-04] [ 1.25557723e-04 -6.11179592e-05 2.28489978e-04] [ 7.26436491e-04 4.55829105e-04 1.10054117e-04] [-7.26436487e-04 -4.55829098e-04 1.10054103e-04] [-7.56571397e-04 -1.70132191e-04 -1.36290369e-04] [ 7.56571392e-04 1.70132193e-04 -1.36290382e-04] [-3.55250554e-04 -2.85054933e-05 1.31258000e-04] [ 3.55250560e-04 2.85054966e-05 1.31258014e-04] [-2.36514575e-04 6.11892180e-05 3.99354617e-04] [ 2.36514576e-04 -6.11892122e-05 3.99354621e-04] [-8.77582879e-04 6.97853532e-04 2.23795984e-04] [ 8.77582880e-04 -6.97853528e-04 2.23795970e-04] [-4.40299718e-05 5.49503910e-05 4.89180738e-04] [ 4.40299717e-05 -5.49503868e-05 4.89180726e-04] [-3.68485836e-04 6.36772434e-04 -1.25655862e-03] [ 3.68485834e-04 -6.36772403e-04 -1.25655858e-03] [-3.48461982e-04 5.10728047e-04 7.39495629e-05] [ 3.48461994e-04 -5.10728231e-04 7.39495822e-05] [ 1.00946917e-03 -5.74449216e-04 1.38740532e-04] [-1.00946917e-03 5.74449215e-04 1.38740508e-04] [ 2.07294085e-04 3.83196335e-04 -4.58025168e-04] [-2.07294084e-04 -3.83196330e-04 -4.58025179e-04] [-5.90736737e-04 2.92393197e-06 6.58189641e-05] [ 5.90736734e-04 -2.92434420e-06 6.58189743e-05] [ 3.62059792e-04 1.75244124e-04 -8.72805732e-05] [-3.62059788e-04 -1.75244155e-04 -8.72804790e-05] [-1.28318618e-04 -5.07443152e-04 -5.63280153e-04] [ 1.28318618e-04 5.07443121e-04 -5.63280243e-04] [ 2.53153400e-04 -1.84854886e-04 -2.32057271e-05] [-2.53153435e-04 1.84854817e-04 -2.32056471e-05] [ 2.21690508e-04 -2.83043009e-04 -7.22780572e-04] [-2.21690479e-04 2.83042943e-04 -7.22780661e-04]] Final stress: [ 3.76837462e-06 7.73343761e-06 -2.42338631e-05 1.48288280e-14 -4.32148953e-15 1.85510720e-05] Minimization converged after 19 steps. Minimization converged after 115 steps. Minimization converged after 10 steps. Minimization converged after 13 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 115 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.41557957e-04 3.70640037e-04 2.92559324e-05] [-1.41557960e-04 -3.70639976e-04 2.92559226e-05] [-5.69903355e-05 -1.74076192e-04 -1.37051930e-04] [ 5.69903357e-05 1.74076182e-04 -1.37051924e-04] [-2.22207086e-04 3.47185381e-04 3.71821511e-05] [ 2.22207085e-04 -3.47185386e-04 3.71821462e-05] [ 1.07953841e-04 3.17607601e-04 -4.08774221e-04] [-1.07953840e-04 -3.17607578e-04 -4.08774197e-04] [-1.38391085e-04 6.37106713e-05 1.45954818e-04] [ 1.38391086e-04 -6.37106745e-05 1.45954813e-04] [ 1.81155247e-05 -1.84298831e-04 3.07670832e-04] [-1.81155263e-05 1.84298823e-04 3.07670828e-04] [ 2.92422204e-04 -5.68993824e-05 1.49883545e-04] [-2.92422206e-04 5.68993871e-05 1.49883536e-04] [ 7.96433755e-04 3.42504771e-04 1.14776175e-04] [-7.96433755e-04 -3.42504791e-04 1.14776182e-04] [-3.40016679e-04 -1.28712798e-04 2.23827358e-04] [ 3.40016677e-04 1.28712792e-04 2.23827356e-04] [-8.24885023e-05 7.13768450e-05 1.80757108e-04] [ 8.24885012e-05 -7.13768449e-05 1.80757095e-04] [-4.03567180e-05 -2.36904891e-05 5.31736418e-05] [ 4.03567173e-05 2.36904843e-05 5.31736407e-05] [ 3.70283474e-04 2.64131981e-04 3.47884452e-05] [-3.70283474e-04 -2.64131914e-04 3.47884315e-05] [ 1.37625102e-04 2.04040270e-04 -3.34140992e-04] [-1.37625102e-04 -2.04040265e-04 -3.34140986e-04] [-3.88189136e-04 -2.43763167e-04 -1.13273946e-04] [ 3.88189133e-04 2.43763139e-04 -1.13273940e-04] [-3.68503679e-05 2.56400917e-04 -5.74268387e-04] [ 3.68503660e-05 -2.56400913e-04 -5.74268388e-04] [-4.29538224e-04 -2.61618097e-04 1.37048046e-04] [ 4.29538223e-04 2.61618099e-04 1.37048048e-04] [-1.54052212e-04 2.25214440e-06 6.72187009e-05] [ 1.54052213e-04 -2.25215669e-06 6.72187089e-05] [ 1.58442967e-05 2.16251854e-04 -3.33213963e-05] [-1.58442970e-05 -2.16251858e-04 -3.33213920e-05] [ 1.51261847e-04 -6.72638900e-05 -3.31670227e-04] [-1.51261847e-04 6.72638873e-05 -3.31670233e-04] [-7.58499763e-06 1.77972951e-04 8.48378745e-07] [ 7.58499706e-06 -1.77972943e-04 8.48381080e-07] [-7.93066673e-05 -3.58965444e-04 -4.15838694e-04] [ 7.93066711e-05 3.58965454e-04 -4.15838701e-04] [ 4.84925627e-05 6.69765757e-04 1.77805199e-04] [-4.84925624e-05 -6.69765758e-04 1.77805197e-04] [-7.54964773e-05 2.08366654e-05 6.17009221e-05] [ 7.54964790e-05 -2.08366675e-05 6.17009233e-05] [ 3.82966965e-04 2.69450081e-04 3.86039944e-04] [-3.82966967e-04 -2.69450064e-04 3.86039932e-04] [-2.36367209e-04 1.79612849e-05 -1.73526936e-04] [ 2.36367209e-04 -1.79612698e-05 -1.73526921e-04] [-1.21969630e-04 -1.97087825e-04 5.57197312e-05] [ 1.21969627e-04 1.97087818e-04 5.57197392e-05] [ 2.42896938e-04 -2.30425430e-04 3.52693190e-04] [-2.42896938e-04 2.30425424e-04 3.52693185e-04] [-8.87767153e-05 1.32053030e-04 4.88577873e-05] [ 8.87767338e-05 -1.32053004e-04 4.88577797e-05] [-3.10183448e-04 -7.62753657e-05 1.02343938e-04] [ 3.10183440e-04 7.62753858e-05 1.02343942e-04] [-2.17673921e-04 -4.30379246e-06 -8.74344866e-05] [ 2.17673921e-04 4.30379070e-06 -8.74344879e-05] [ 1.09947744e-04 4.05584264e-04 -2.81340769e-04] [-1.09947743e-04 -4.05584265e-04 -2.81340767e-04] [ 7.43365465e-04 5.10621919e-05 -2.37320239e-04] [-7.43365458e-04 -5.10621815e-05 -2.37320236e-04] [-3.89915130e-04 -6.25161724e-05 -1.14456544e-04] [ 3.89915126e-04 6.25161817e-05 -1.14456548e-04] [-4.99159160e-04 -6.44444523e-05 -6.25464468e-05] [ 4.99159159e-04 6.44444548e-05 -6.25464405e-05] [ 7.43547911e-04 4.29488287e-04 2.05308465e-04] [-7.43547904e-04 -4.29488286e-04 2.05308455e-04] [-1.83194569e-05 1.83741458e-04 -4.74176266e-04] [ 1.83194510e-05 -1.83741448e-04 -4.74176269e-04] [ 6.83490858e-05 3.66239273e-04 1.29364382e-04] [-6.83490736e-05 -3.66239258e-04 1.29364389e-04] [ 2.06441059e-04 1.59735141e-04 3.06551946e-05] [-2.06441054e-04 -1.59735142e-04 3.06552091e-05] [ 3.23006949e-04 -6.32636749e-06 1.80304183e-04] [-3.23006956e-04 6.32636965e-06 1.80304172e-04] [-5.21847619e-04 -1.32077990e-04 -2.54568715e-05] [ 5.21847613e-04 1.32077982e-04 -2.54568787e-05] [-4.17635964e-04 -1.13396779e-04 -1.36243136e-04] [ 4.17635966e-04 1.13396776e-04 -1.36243137e-04] [ 1.84921353e-04 -1.59679989e-04 -2.66922703e-04] [-1.84921353e-04 1.59679996e-04 -2.66922707e-04] [-2.90618400e-04 -1.23336393e-04 3.28935150e-04] [ 2.90618396e-04 1.23336370e-04 3.28935131e-04] [-2.72410291e-04 -4.58224330e-04 -1.37886006e-04] [ 2.72410291e-04 4.58224280e-04 -1.37886003e-04] [ 5.65041634e-04 8.78321370e-05 -4.37450395e-05] [-5.65041635e-04 -8.78321386e-05 -4.37450409e-05] [-1.78337959e-04 -8.04742623e-05 1.52955688e-04] [ 1.78337958e-04 8.04742672e-05 1.52955685e-04] [-4.65836108e-04 -4.14121522e-04 9.84367225e-06] [ 4.65836104e-04 4.14121471e-04 9.84367605e-06] [ 1.72839758e-04 -4.26784906e-04 2.12909899e-04] [-1.72839749e-04 4.26784892e-04 2.12909897e-04] [-4.47082106e-04 6.96916865e-05 1.35925544e-05] [ 4.47082099e-04 -6.96917004e-05 1.35925595e-05] [-3.44422346e-04 -1.93248690e-04 4.76351553e-04] [ 3.44422338e-04 1.93248670e-04 4.76351554e-04] [-1.87122579e-04 -2.31097799e-04 -1.83713311e-05] [ 1.87122588e-04 2.31097783e-04 -1.83713343e-05]] Final stress: [ 4.53099536e-06 -1.34380599e-06 2.37871785e-05 -2.61846890e-15 -6.45355184e-16 1.48247653e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-9.06797058e-05 1.41427052e-04 5.36137180e-04] [ 9.06797098e-05 -1.41426984e-04 5.36137165e-04] [-4.01906593e-04 4.57194489e-04 -7.99102946e-04] [ 4.01906591e-04 -4.57194500e-04 -7.99102939e-04] [ 1.79420829e-04 -8.73796453e-04 6.21286728e-04] [-1.79420829e-04 8.73796448e-04 6.21286721e-04] [-6.59529639e-04 8.74329337e-04 -4.75755506e-04] [ 6.59529650e-04 -8.74329366e-04 -4.75755541e-04] [ 2.36150928e-05 7.15377382e-04 3.03119904e-04] [-2.36150950e-05 -7.15377384e-04 3.03119905e-04] [-4.11260667e-04 3.96485528e-04 -3.63697322e-04] [ 4.11260668e-04 -3.96485530e-04 -3.63697330e-04] [ 1.77281998e-04 5.47692078e-04 2.42972135e-04] [-1.77281998e-04 -5.47692073e-04 2.42972134e-04] [-1.33419356e-03 -1.24467783e-03 5.11334063e-04] [ 1.33419355e-03 1.24467781e-03 5.11334042e-04] [ 8.28005140e-04 -4.26995955e-04 2.97665473e-04] [-8.28005144e-04 4.26995961e-04 2.97665479e-04] [ 6.20405185e-04 -8.44910637e-05 -5.09040387e-05] [-6.20405184e-04 8.44910700e-05 -5.09040322e-05] [ 7.42935353e-04 3.24898662e-04 1.25540338e-04] [-7.42935355e-04 -3.24898658e-04 1.25540333e-04] [-5.85338979e-04 4.14474690e-04 -3.32056478e-04] [ 5.85338978e-04 -4.14474625e-04 -3.32056496e-04] [ 9.16275954e-04 3.17405942e-05 -8.87828037e-04] [-9.16275941e-04 -3.17406070e-05 -8.87828049e-04] [-1.51843163e-04 1.65564797e-03 -1.06057551e-03] [ 1.51843164e-04 -1.65564797e-03 -1.06057551e-03] [ 2.11486920e-04 -1.08293841e-03 1.42185333e-03] [-2.11486912e-04 1.08293841e-03 1.42185333e-03] [-2.83266132e-04 1.03531475e-03 -4.73657568e-04] [ 2.83266141e-04 -1.03531474e-03 -4.73657563e-04] [ 7.89865912e-04 -6.12262759e-04 1.14882098e-03] [-7.89865920e-04 6.12262751e-04 1.14882099e-03] [-1.07177900e-04 -2.89131770e-04 3.79825740e-04] [ 1.07177897e-04 2.89131770e-04 3.79825742e-04] [-1.28834353e-03 -3.40612284e-04 -5.40829575e-05] [ 1.28834353e-03 3.40612281e-04 -5.40829544e-05] [-4.88842879e-04 -1.78799498e-04 -2.27051077e-04] [ 4.88842846e-04 1.78799517e-04 -2.27051057e-04] [ 4.78507416e-04 -4.54498741e-04 -6.31708006e-04] [-4.78507418e-04 4.54498746e-04 -6.31708005e-04] [ 4.56696729e-05 -7.01044923e-04 -1.46691155e-05] [-4.56696755e-05 7.01044922e-04 -1.46691135e-05] [-8.02155613e-04 -2.11642104e-04 -1.00962520e-03] [ 8.02155613e-04 2.11642099e-04 -1.00962520e-03] [ 4.44729218e-04 -1.85655810e-04 -1.05927108e-03] [-4.44729218e-04 1.85655823e-04 -1.05927110e-03] [-3.06712769e-04 -3.73589885e-04 1.04829053e-03] [ 3.06712778e-04 3.73589898e-04 1.04829055e-03] [-2.57585490e-04 -1.08489117e-04 2.93491164e-04] [ 2.57585481e-04 1.08489113e-04 2.93491163e-04] [-7.53042407e-04 3.48035575e-05 -1.92278556e-04] [ 7.53042407e-04 -3.48035537e-05 -1.92278549e-04] [-4.55170612e-04 6.42912230e-06 3.30152044e-04] [ 4.55170610e-04 -6.42913267e-06 3.30152049e-04] [-6.21139181e-04 -8.49244432e-04 -3.28661041e-04] [ 6.21139183e-04 8.49244421e-04 -3.28661047e-04] [ 3.39255457e-04 -4.45705805e-04 4.67490028e-04] [-3.39255453e-04 4.45705801e-04 4.67490029e-04] [-5.98880470e-04 -9.21346365e-04 1.17374653e-03] [ 5.98880468e-04 9.21346361e-04 1.17374653e-03] [ 2.11770694e-03 -5.52437763e-04 -4.99814599e-04] [-2.11770694e-03 5.52437765e-04 -4.99814601e-04] [-2.07666653e-04 2.05176727e-04 1.46238925e-03] [ 2.07666632e-04 -2.05176710e-04 1.46238924e-03] [-5.56860891e-04 5.79185038e-04 -1.32850159e-04] [ 5.56860892e-04 -5.79185036e-04 -1.32850162e-04] [-6.74286191e-04 -1.37719218e-03 1.03565057e-04] [ 6.74286189e-04 1.37719218e-03 1.03565060e-04] [ 1.46413281e-05 -1.43701132e-03 9.76399152e-04] [-1.46413209e-05 1.43701131e-03 9.76399157e-04] [-7.15426606e-04 -1.69122893e-03 -1.83433435e-03] [ 7.15426615e-04 1.69122894e-03 -1.83433435e-03] [-2.59344169e-04 -1.28544455e-03 -1.18675747e-03] [ 2.59344170e-04 1.28544456e-03 -1.18675748e-03] [-1.64925952e-03 4.82484392e-04 -1.23243066e-03] [ 1.64925953e-03 -4.82484394e-04 -1.23243065e-03] [ 1.62123357e-03 -1.23648065e-04 -2.68392434e-05] [-1.62123358e-03 1.23648064e-04 -2.68392396e-05] [ 1.28987950e-04 -4.46823611e-04 7.20960718e-05] [-1.28987945e-04 4.46823615e-04 7.20960697e-05] [-2.75222487e-04 2.46642837e-04 2.19649745e-04] [ 2.75222490e-04 -2.46642834e-04 2.19649747e-04] [ 3.09109827e-04 -5.04004846e-04 -4.33936998e-04] [-3.09109827e-04 5.04004865e-04 -4.33936984e-04] [-9.65334995e-04 7.20746130e-04 1.72609859e-04] [ 9.65335004e-04 -7.20746182e-04 1.72609864e-04] [ 5.22136585e-04 -4.15137157e-05 1.52753095e-04] [-5.22136579e-04 4.15137194e-05 1.52753091e-04] [ 6.25967171e-04 3.47612294e-04 4.65567162e-04] [-6.25967169e-04 -3.47612288e-04 4.65567162e-04] [-1.23199017e-03 -1.60503436e-03 2.03957180e-05] [ 1.23199020e-03 1.60503430e-03 2.03957217e-05] [-4.10740341e-04 4.67311332e-06 2.27244539e-04] [ 4.10740332e-04 -4.67311648e-06 2.27244572e-04] [ 1.05448083e-03 2.86071053e-04 -2.84977100e-04] [-1.05448083e-03 -2.86071064e-04 -2.84977119e-04] [ 1.34680908e-04 4.85229951e-04 3.72518433e-04] [-1.34680916e-04 -4.85229953e-04 3.72518444e-04] [ 8.72747123e-04 -1.94657506e-04 4.45950786e-04] [-8.72747129e-04 1.94657502e-04 4.45950762e-04]] Final stress: [-5.62960381e-06 -1.57525691e-06 -4.52341455e-05 7.26396325e-15 7.41454887e-15 -5.03983356e-05] Minimization converged after 117 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 17 steps. Minimization converged after 13 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 141 steps. Minimization converged after 139 steps. Minimization converged after 139 steps. Minimization converged after 141 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.70417083e-03 -3.67657683e-05 -2.63085242e-04] [ 1.31960364e-03 -3.98412999e-05 -2.93166027e-04] [ 1.12782027e-03 2.83205697e-05 1.80154081e-04] [ 2.83079337e-04 -1.04458048e-05 8.41666109e-05] [ 1.09857684e-03 -4.99278967e-04 -1.59992984e-04] [ 1.20034730e-03 4.00399292e-04 -1.42812047e-04] [-6.00101235e-04 6.57405385e-04 -3.32537453e-04] [-2.99141426e-04 -7.92388226e-04 -4.46864918e-04] [ 1.75238519e-03 -2.28535412e-04 -4.96308159e-04] [-1.86048002e-04 2.11038567e-04 -4.69739801e-04] [-1.73374530e-05 1.56307386e-04 -2.18654443e-04] [-1.75340134e-03 -2.25034582e-04 -2.70730357e-04] [ 3.92069015e-05 -2.57892647e-04 -1.01215043e-03] [ 1.76361564e-03 2.34869956e-04 -1.00022788e-03] [-1.93772933e-03 -6.63103623e-04 -9.89343422e-04] [ 2.05256410e-03 6.90925938e-04 -9.84419379e-04] [ 2.98587851e-04 1.28707231e-04 -2.27392964e-04] [-7.82303188e-04 -5.66362056e-05 -1.66531506e-04] [ 7.90061567e-04 6.61344054e-05 6.19131284e-04] [-7.52815178e-04 -6.43429871e-05 6.26019351e-04] [-2.06052412e-04 -1.04257160e-05 1.15615036e-04] [-7.99418631e-04 -2.48712405e-05 1.83267680e-04] [-1.42869598e-03 -9.95073211e-04 2.76126355e-04] [-1.70854278e-04 9.70527236e-04 2.85265406e-04] [ 1.95862256e-04 -8.70034730e-04 1.61098646e-04] [ 7.04185248e-04 6.61211537e-04 8.65714292e-06] [ 1.31615973e-04 9.89359787e-04 1.10930166e-03] [ 1.97078600e-04 -9.55823789e-04 1.12194461e-03] [ 1.22086817e-03 -1.58812687e-04 1.22203402e-03] [-2.43370306e-04 2.65386200e-04 1.22375107e-03] [ 2.83849614e-03 2.23800937e-04 -5.32205466e-04] [ 1.59344470e-03 -1.74759102e-04 -5.89492068e-04] [-2.66480432e-05 2.32423830e-04 -4.66571309e-06] [ 4.55830429e-04 -1.62811376e-04 -1.68037284e-05] [-7.39275547e-04 8.79025597e-05 -1.67975461e-04] [ 1.01153291e-03 2.44952012e-04 3.81505096e-04] [ 5.11728767e-04 5.45897921e-04 -1.67664836e-05] [-6.50441873e-04 -7.79746220e-04 5.75218269e-04] [ 4.69563263e-04 6.78502454e-04 6.99470013e-05] [-5.32571399e-04 9.25322020e-05 -5.35066660e-04] [-3.40703539e-04 5.44697728e-04 8.01801480e-04] [ 2.53046149e-04 -1.33196687e-03 2.19159232e-04] [-1.08815646e-03 -8.83897631e-04 7.48977350e-04] [-1.61878490e-03 2.30273754e-03 -1.52697424e-03] [-9.18016167e-04 -1.41860690e-03 9.83028317e-04] [-1.66744944e-03 -1.82576941e-04 -1.00551078e-03] [-4.25928868e-04 -2.89907056e-05 -1.09766566e-03] [-8.57248425e-04 -9.92220951e-05 -8.39505730e-04] [-7.42943919e-04 1.33538401e-04 8.89446147e-04] [-4.86734415e-04 -1.07621501e-04 9.95017998e-04] [ 1.02605854e-03 1.12504519e-03 -7.46836534e-05] [-9.97651079e-04 -4.49392573e-05 4.96214237e-04] [-7.78982560e-04 -5.02049480e-04 -5.47232101e-04] [ 1.07384047e-03 -4.87761101e-04 3.69464552e-05] [ 1.74149885e-03 1.08216635e-03 5.67752920e-04] [-1.71823707e-03 3.60503936e-05 -1.08730848e-03] [ 4.91953818e-04 -8.94700161e-04 8.69158114e-04] [-5.16635387e-04 -1.11510796e-04 -8.27851281e-04] [ 1.54258807e-03 7.86077029e-04 7.36408749e-04] [-1.05169215e-03 1.20180175e-03 -7.00326880e-04] [-5.43786173e-04 -2.22422519e-03 1.16269581e-03] [ 1.00588381e-03 1.91559636e-04 -1.89280310e-04] [-7.48003122e-04 1.83154889e-03 1.45662968e-04] [ 7.11329383e-04 1.07601946e-04 -9.57829851e-04] [ 5.58421456e-04 -1.57416238e-05 1.26502901e-03] [-5.60654944e-04 -1.93347525e-03 2.42513121e-04] [ 8.75938114e-04 7.10263995e-04 1.15392207e-03] [-1.10476172e-03 -1.06396682e-03 5.24193267e-04] [-1.77611442e-03 4.85984155e-04 -6.51591551e-04] [ 1.47025674e-03 -1.13460239e-04 -1.31276522e-03] [ 9.83609313e-04 5.81081112e-04 1.22970877e-03] [-1.07374690e-03 -5.11270329e-04 -4.89901068e-04] [ 4.85667457e-04 1.24499995e-04 1.10343470e-03] [-5.14293223e-04 -3.63889839e-05 -5.82659983e-04] [ 9.44244726e-04 1.42467889e-05 3.59891473e-04] [ 5.82288511e-04 -6.20561880e-04 -7.78970035e-04] [ 6.52966432e-05 9.73820534e-04 -8.47087189e-05] [ 1.57085190e-03 -3.92632733e-04 -1.31096003e-03] [ 3.53933546e-04 3.06175987e-04 4.36961783e-04] [-1.52248920e-03 -2.37680077e-04 3.68219439e-04] [ 2.33507504e-03 7.86264732e-05 2.08374307e-04] [-2.34032767e-03 -9.08277283e-05 2.21113695e-04] [-4.50358440e-04 -3.88994090e-06 -6.98932709e-05] [-6.48742079e-04 -4.10011654e-05 -8.91949751e-05] [ 2.18934961e-03 -5.95085186e-04 -1.18297593e-04] [-5.33675909e-04 6.11286672e-04 -1.64445904e-04] [-2.16108970e-03 4.01997887e-04 -1.80059826e-04] [ 6.78362641e-04 -1.02202035e-04 -2.64553100e-04] [-3.05085076e-03 -2.79052574e-04 -8.94879611e-05] [ 1.27651366e-03 2.30763114e-04 -4.68563861e-05] [-5.35243649e-04 3.31449336e-04 -9.91572866e-05] [ 2.08906355e-04 -3.29646552e-04 -1.25325827e-04] [ 1.28122406e-03 6.40222399e-04 2.95109621e-04] [ 1.94235486e-05 -5.14504675e-04 2.63203617e-04] [-7.10114437e-04 2.19485960e-03 -6.40367912e-04] [ 7.37849036e-04 1.84859972e-05 4.39868766e-04] [ 9.81476032e-04 -4.02257148e-04 4.13805470e-04] [-1.04883521e-03 -1.90797046e-03 1.52814209e-03] [-1.12937438e-03 9.24525026e-04 -1.42905148e-03] [-1.18985289e-03 -7.71989324e-04 2.70252520e-04] [-7.38951312e-04 -2.41153879e-05 -1.15310051e-03] [-1.48847723e-03 -2.25306995e-04 6.53233395e-04]] Final stress: [-4.97513290e-06 7.79737807e-06 -4.50507351e-05 -1.92782197e-07 -1.54566966e-05 -2.17898977e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.35209763e-04 -9.08987239e-06 -6.45898289e-06] [ 1.41959391e-04 9.98258811e-06 -5.49163179e-06] [ 1.55042861e-05 5.40486711e-05 -1.12245309e-05] [ 1.32324678e-04 -5.45295947e-05 -9.11044321e-06] [ 1.89776299e-04 -9.25281755e-05 3.94084955e-05] [ 1.75284344e-04 9.50668738e-05 3.93478481e-05] [-6.28144685e-05 1.90615874e-05 2.27587658e-05] [-1.43945096e-04 -1.67765926e-05 2.44556701e-05] [-5.91771707e-06 -8.33848064e-05 -9.20548730e-05] [ 2.56468527e-04 8.41470561e-05 -9.24012270e-05] [-2.96682386e-04 6.01836477e-05 -3.64308607e-05] [-1.98480576e-06 -5.84004704e-05 -3.53636392e-05] [ 2.85062079e-04 -3.92966658e-06 3.07408432e-07] [-3.90562168e-05 5.07744275e-06 1.54568688e-06] [ 3.82051318e-04 1.09246563e-04 -4.64803644e-07] [-2.54733581e-04 -1.09649963e-04 -4.46397796e-07] [-1.86704306e-04 -1.10865747e-05 2.67991723e-05] [ 9.27720775e-05 9.92758837e-06 2.59092071e-05] [-6.76191156e-05 -2.80650289e-05 3.55834720e-05] [ 1.17292554e-04 2.82285948e-05 3.57473639e-05] [-1.33388518e-04 3.09186933e-05 3.03058777e-05] [-1.05526116e-04 -2.96670707e-05 2.90927445e-05] [ 1.12393038e-04 4.71051142e-05 3.17735865e-05] [-1.14898115e-04 -4.77554664e-05 3.15505715e-05] [ 3.41020832e-05 1.62087467e-05 -8.25782500e-05] [-1.34608786e-04 -1.39519626e-05 -8.25324771e-05] [-2.06623135e-05 -1.45930799e-04 -3.36344398e-05] [-8.08930711e-05 1.46130481e-04 -3.54455668e-05] [-7.99170125e-05 -3.79527760e-05 2.09336909e-04] [ 1.31579044e-04 3.54237149e-05 2.09672846e-04] [ 1.31646648e-04 3.54159347e-05 -9.26931835e-05] [ 4.45515660e-04 -3.64945330e-05 -9.10454875e-05] [ 3.45307727e-05 -2.87006352e-05 1.82721137e-05] [ 4.90035401e-05 2.74201222e-05 1.82860171e-05] [ 1.03824926e-04 -3.34960351e-05 1.87486710e-05] [-4.90267404e-05 7.72689860e-05 9.40037060e-05] [-1.19865028e-04 -3.06634362e-05 3.72811690e-06] [ 1.84665196e-04 -1.54804491e-05 7.87686650e-05] [ 5.53287874e-05 -1.34890471e-04 2.11995753e-04] [ 1.60170729e-04 1.35217246e-04 -5.29200891e-05] [ 1.96307118e-04 -2.72140783e-05 1.23733201e-04] [ 2.01190392e-05 2.65922689e-05 -1.41538440e-04] [-1.06626201e-04 2.54688446e-04 1.40812901e-04] [-2.23637657e-04 4.42383878e-05 -1.83597831e-04] [-1.61378286e-04 8.15631892e-05 7.95607918e-05] [-1.71857129e-04 -3.75723700e-04 -2.52153785e-04] [ 7.75808817e-05 -2.87038727e-06 1.80891835e-04] [-1.15932002e-04 1.87497802e-05 2.44723274e-04] [-6.28035270e-05 -3.45363220e-05 -1.99240792e-04] [ 2.40297985e-05 2.03098947e-05 -1.32522652e-04] [-1.31218810e-04 6.41921990e-05 -9.47574521e-05] [ 1.71758462e-04 1.37369713e-04 -4.45758335e-05] [ 1.65381108e-04 -1.42390199e-04 -2.42696456e-05] [-1.31234380e-04 -6.12879444e-05 2.59194085e-05] [ 6.91258041e-05 1.41702530e-04 1.36457127e-04] [ 1.29086501e-04 2.70094863e-04 -2.44719295e-04] [ 7.30980035e-05 -5.25581164e-05 4.73757798e-05] [ 1.28156910e-04 -3.65469943e-04 -3.34195621e-04] [-1.66542171e-04 3.73254718e-04 1.76257745e-04] [ 1.25640014e-04 3.74048158e-05 -3.46205658e-05] [ 1.74415442e-04 -1.66014332e-04 1.16139769e-04] [-2.15032682e-04 -2.44004219e-04 -9.69092668e-05] [ 1.62775106e-04 7.86468292e-05 8.72846076e-05] [-2.20100452e-04 2.24069543e-04 -1.17066460e-04] [-1.65880758e-04 -3.15351077e-04 1.82976200e-05] [ 1.06652037e-04 1.30534025e-05 -1.88347127e-04] [-1.97436929e-04 -1.05616482e-04 -2.29703470e-05] [ 2.62234564e-04 -5.66915317e-06 -1.44208491e-04] [ 2.76286795e-04 8.55591983e-06 1.90744567e-04] [-2.10584640e-04 1.01661595e-04 7.23676675e-05] [-6.68456800e-05 9.17174489e-05 1.74567181e-04] [-9.77243654e-05 2.64291819e-06 -1.52692256e-04] [-7.79839851e-05 -1.94569582e-04 2.55148096e-04] [-8.79054913e-05 9.51074947e-05 -7.30308335e-05] [ 6.76186540e-05 -1.64052307e-04 -5.12439191e-05] [ 1.83672890e-04 -3.93871682e-05 -1.43200033e-04] [ 1.82129761e-04 -9.73568441e-06 4.40891681e-05] [ 6.69953844e-05 2.14150463e-04 -4.43100001e-05] [-2.74630428e-04 -3.25451846e-06 1.55999265e-05] [ 1.06832369e-04 2.86166332e-06 1.84955825e-05] [-3.78040508e-04 1.52976982e-05 1.07339740e-05] [ 3.06015791e-04 -1.47385810e-05 1.08283983e-05] [-6.64385224e-05 7.66747869e-05 -5.04784360e-05] [-7.94738286e-05 -7.57191130e-05 -5.01089166e-05] [-3.19585574e-04 3.31719965e-05 -5.22236562e-05] [ 3.08559922e-04 -3.20039793e-05 -4.99528089e-05] [-6.82882860e-05 -3.25033096e-05 -2.58098719e-06] [-1.23027446e-04 2.65176851e-05 -6.39769607e-07] [ 2.30854005e-04 -3.10070156e-05 8.81606367e-06] [-4.72756331e-04 3.24475983e-05 7.46509067e-06] [ 2.89230065e-05 -2.28408879e-05 4.07480928e-05] [-5.78452910e-05 2.27032451e-05 4.18240636e-05] [-2.03868618e-04 2.22417076e-05 1.15538214e-05] [-2.61540866e-05 -2.43364525e-05 1.20755783e-05] [ 1.87231977e-04 4.36936559e-05 4.20628432e-05] [-9.53014140e-05 1.85970316e-04 1.29031781e-04] [-8.59894265e-05 -3.18977988e-04 -1.11883821e-04] [ 1.80543472e-04 9.20779724e-05 -2.62448630e-05] [-1.55041517e-04 -1.81837139e-04 -1.03455237e-04] [-1.52036705e-04 3.21761311e-05 2.49672991e-04] [-1.96400599e-04 1.18148253e-04 -1.84851784e-04] [-1.14643436e-04 3.62652795e-05 1.62210194e-04]] Final stress: [-1.15456049e-06 -1.17947216e-06 -8.88544089e-06 2.95582012e-09 8.00608847e-07 3.87175899e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.08778962e-04 -2.65031653e-05 4.08431166e-06] [-8.41673823e-05 2.70506314e-05 5.10581180e-06] [ 5.96281941e-06 8.29868511e-05 -3.13317778e-05] [-9.66025818e-05 -8.35428784e-05 -2.93300230e-05] [-1.72692532e-04 -9.45068288e-05 6.01385443e-05] [-1.63444865e-04 9.70675485e-05 6.00901656e-05] [ 6.76918739e-05 1.28530869e-05 2.47017818e-05] [ 1.41447167e-04 -1.08948523e-05 2.61033723e-05] [ 3.44427426e-06 -1.02021273e-04 -8.77094110e-05] [-2.45239120e-04 1.02832146e-04 -8.80310165e-05] [ 2.87175672e-04 6.41220032e-05 -3.85669395e-05] [-9.66965889e-06 -6.22075549e-05 -3.75636569e-05] [-2.95926333e-04 1.00562502e-05 4.43599766e-05] [ 3.45806266e-05 -8.92898152e-06 4.62149819e-05] [-4.06204061e-04 1.86060007e-04 4.40441941e-05] [ 2.34079423e-04 -1.86574153e-04 4.43515342e-05] [ 2.19255038e-04 -2.48544647e-05 4.76893093e-05] [-1.26368709e-04 2.38268099e-05 4.68671961e-05] [ 2.95672380e-05 -4.16279431e-05 1.74232325e-05] [-1.06517390e-04 4.19694075e-05 1.76220928e-05] [ 1.19419034e-04 4.01521535e-05 2.51190677e-05] [ 1.42779852e-04 -3.88330632e-05 2.41473760e-05] [-1.67355446e-04 8.26403087e-05 1.66762671e-05] [ 4.09366976e-05 -8.37467589e-05 1.64600642e-05] [ 3.10375428e-05 3.85274016e-05 -9.17058764e-05] [ 2.36982957e-04 -3.72347789e-05 -9.30396336e-05] [ 4.94010268e-05 -2.37408206e-04 -1.04597739e-04] [ 1.20820850e-04 2.38187155e-04 -1.07167698e-04] [ 7.71210983e-05 -4.45392405e-05 2.09923181e-04] [-9.95434855e-05 4.21277501e-05 2.10248986e-04] [-1.04045832e-04 4.26833968e-05 -9.53619561e-05] [-4.74683493e-04 -4.38439399e-05 -9.35364119e-05] [-1.98992300e-05 -5.09730499e-05 4.17273818e-05] [-7.70286810e-05 4.98658097e-05 4.17335311e-05] [-2.05406011e-04 -3.76038169e-05 8.07862843e-05] [ 1.10119054e-04 -4.72386748e-05 2.65541288e-05] [ 2.16702986e-05 7.01116023e-05 6.78940486e-05] [-1.06969493e-04 1.24838272e-05 1.39081907e-05] [-4.90776403e-05 4.13410671e-05 -1.58325525e-04] [-2.44585513e-04 2.60391900e-06 1.33679862e-04] [-2.02290089e-04 1.18826447e-04 -4.19444540e-05] [-9.03503071e-05 -1.63032950e-04 2.49867609e-04] [ 1.42159863e-04 -3.61144545e-04 -2.52055348e-04] [ 1.53369796e-04 4.21756214e-05 6.83123186e-05] [ 1.92522131e-04 7.42433094e-05 -1.83212104e-04] [ 9.98899940e-05 2.49468548e-04 1.29966038e-04] [-6.73276660e-05 3.72630064e-06 -1.44390317e-04] [ 5.37850458e-05 -3.09475198e-05 -2.17243002e-04] [ 1.42946277e-04 2.00070002e-05 2.66105626e-04] [-1.56828095e-04 8.59915477e-06 1.95913805e-04] [ 1.17837852e-04 -1.03654572e-04 -2.12193386e-06] [-1.57540653e-04 -1.57884004e-04 2.78142962e-06] [-1.79273705e-04 1.82648091e-04 -7.94660575e-05] [ 1.33137324e-04 7.67997159e-05 -7.44397813e-05] [-2.60136240e-04 -4.90689299e-04 -3.91818341e-04] [ 7.39159148e-06 -2.98632162e-05 4.09598669e-05] [-1.80419532e-04 3.50663726e-04 -2.78245837e-04] [-6.81353422e-05 1.62588997e-04 1.53620022e-04] [ 2.33041574e-04 -2.51940248e-04 -9.44563896e-05] [-1.33501917e-04 -1.81202563e-04 1.18726769e-04] [-1.02167186e-04 7.08424181e-05 -3.02845752e-05] [ 2.01829670e-04 3.62839549e-04 1.80464236e-04] [-1.13789172e-04 2.80335610e-05 -1.97648638e-04] [ 1.81916991e-04 -3.23637725e-04 -1.97899484e-05] [ 2.68657701e-04 2.05558802e-04 -1.20355175e-04] [-2.02742516e-04 9.03509331e-05 5.50543062e-05] [ 2.22576615e-04 6.81293127e-05 3.75659254e-05] [-3.56291504e-04 5.63613060e-05 1.78668433e-04] [-2.98791326e-04 -2.66358223e-05 -1.03522385e-04] [ 1.65456118e-04 -9.91214078e-05 4.12132722e-05] [ 4.14054481e-05 1.09100095e-04 -7.48846172e-05] [ 1.82006821e-04 -2.16932421e-04 2.83993001e-04] [ 1.24751207e-04 -2.17568751e-05 -1.88257349e-04] [ 9.75857614e-05 1.24014195e-04 1.69450861e-04] [-5.80343340e-05 2.55614400e-04 -2.57757029e-05] [-1.77427414e-04 2.62673584e-06 1.93811037e-05] [-1.43360746e-04 -8.04141552e-05 -1.24416131e-04] [-9.41959515e-05 -1.76779073e-04 -7.53959196e-05] [ 3.18805101e-04 -1.12120991e-05 -3.03921583e-06] [-1.14343610e-04 1.13895547e-05 3.40918248e-07] [ 3.73425027e-04 1.86041141e-05 1.88025628e-06] [-2.79576966e-04 -1.79181523e-05 1.95979146e-06] [ 5.02149693e-05 9.82701133e-05 -5.49470200e-05] [ 7.78719677e-05 -9.74137034e-05 -5.46229269e-05] [ 4.20646580e-04 6.24337154e-05 -4.94492809e-05] [-2.99415511e-04 -6.08020051e-05 -4.67652665e-05] [ 1.37783933e-04 -6.01422599e-05 1.06534774e-05] [ 3.00888928e-05 5.45754820e-05 1.24918714e-05] [-2.54791257e-04 -3.43605407e-05 1.81884942e-05] [ 4.60927013e-04 3.58512311e-05 1.68657268e-05] [-2.74107738e-05 -4.61160983e-05 5.87434679e-05] [ 3.46476140e-05 4.60447748e-05 5.99324753e-05] [ 2.57725161e-04 3.47541511e-05 -7.10818309e-07] [ 1.24280578e-04 -3.65659253e-05 -1.64578433e-07] [-2.08127695e-04 1.36925466e-04 -5.19192127e-05] [ 8.54306864e-05 -2.87685717e-04 -9.52789067e-05] [ 7.79595176e-05 1.27169323e-04 8.86054588e-05] [-1.97923343e-04 2.64660302e-05 4.38291075e-05] [ 1.08001887e-04 3.18368201e-05 1.99172085e-04] [ 1.95748437e-04 2.27125400e-04 -1.91770964e-04] [ 1.31091394e-04 -3.81476594e-06 3.10329268e-04] [ 1.67990191e-04 -2.49462239e-04 -8.80320332e-05]] Final stress: [-1.18537962e-06 -1.26404518e-06 -8.67575147e-06 2.47393827e-09 -8.23317052e-07 -3.86849429e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-7.22358188e-05 -1.42802002e-05 8.48944199e-06] [-9.41448274e-05 1.36758197e-05 7.46798201e-06] [-1.01056623e-04 8.02706571e-05 -2.88003502e-05] [ 3.64991331e-06 -7.97334283e-05 -3.08014728e-05] [-1.65372825e-04 -1.03693371e-04 6.50802776e-05] [-1.82700489e-04 1.01139106e-04 6.51475539e-05] [ 1.55476976e-04 -1.11343204e-05 4.69788815e-05] [ 5.79903131e-05 9.18013341e-06 4.54853794e-05] [-2.34799171e-04 -9.97467712e-05 -8.98742212e-05] [-5.11127195e-07 9.88898079e-05 -8.94870443e-05] [-5.56269339e-06 6.92837388e-05 -3.67181567e-05] [ 2.91368345e-04 -7.12202532e-05 -3.77303322e-05] [ 4.63704602e-05 1.05647400e-05 6.56499284e-05] [-2.79082711e-04 -1.16560392e-05 6.36674337e-05] [ 2.24135301e-04 1.97288671e-04 6.85660682e-05] [-3.96880618e-04 -1.96739423e-04 6.81825336e-05] [-1.18496895e-04 -2.27512996e-05 4.87994752e-05] [ 2.13790033e-04 2.37795671e-05 4.96598811e-05] [-1.03436992e-04 -4.44456219e-05 8.58839992e-06] [ 3.97103688e-05 4.40822425e-05 8.37933517e-06] [ 1.31394152e-04 4.03167517e-05 2.59855591e-05] [ 1.31012570e-04 -4.15454787e-05 2.68429607e-05] [ 6.51448599e-05 1.13229152e-04 2.04020182e-05] [-1.64727144e-04 -1.11906166e-04 2.06085719e-05] [ 2.04063175e-04 5.44336245e-05 -1.09464075e-04] [ 1.94336360e-05 -5.55407705e-05 -1.07794270e-04] [ 1.25459354e-04 -2.62080134e-04 -1.31789156e-04] [ 4.27799260e-05 2.61140459e-04 -1.29024930e-04] [-9.89333965e-05 -3.55139959e-05 2.13691578e-04] [ 9.44035979e-05 3.78939537e-05 2.13389712e-04] [-4.20680609e-04 3.82050098e-05 -9.42865550e-05] [-6.99554876e-05 -3.69577481e-05 -9.61514362e-05] [-6.59702774e-05 -5.65231385e-05 3.54675334e-05] [-1.75275832e-05 5.76286943e-05 3.54827639e-05] [ 1.74213180e-05 -6.15660740e-05 8.29097929e-05] [-9.79655935e-05 -3.20463204e-06 2.43135480e-05] [-2.06703811e-04 2.45044295e-05 8.17626669e-05] [ 1.16265841e-04 4.24432206e-05 2.28090330e-05] [-1.98809860e-04 -1.09524831e-04 -6.87431159e-05] [-9.96761432e-05 1.51933026e-04 2.43603556e-04] [-6.28845649e-05 -3.67566780e-05 -1.54143175e-04] [-2.36512039e-04 -5.23712736e-06 1.58326192e-04] [ 1.89243174e-04 -6.84459881e-05 -1.80593580e-04] [ 9.17226994e-05 -2.56802942e-04 1.32235095e-04] [ 1.31333901e-04 3.72360017e-04 -2.52739764e-04] [ 1.52685798e-04 -5.17768717e-05 6.72353453e-05] [ 1.33288222e-04 -2.05939831e-05 2.71868461e-04] [-1.68588144e-04 -4.63351707e-06 1.98604937e-04] [-8.89354998e-05 -2.13137903e-05 -1.35604982e-04] [ 5.41333333e-05 4.51916863e-05 -2.11485314e-04] [-1.76083057e-04 -1.68066811e-04 -7.19703610e-05] [ 1.36072110e-04 -6.41630940e-05 -8.47331943e-05] [ 1.14715895e-04 9.74684934e-05 -4.02192449e-06] [-1.48253270e-04 1.36776856e-04 -1.69261891e-05] [-2.15114770e-04 -3.59698128e-04 -2.82084599e-04] [-5.32089409e-05 -1.31561244e-04 1.35366308e-04] [-2.90025354e-04 4.96476763e-04 -3.87231883e-04] [ 1.71300393e-05 2.17802196e-06 3.11825403e-05] [-1.07346156e-04 -6.48981298e-05 -3.22694126e-05] [ 1.95215606e-04 -3.66580671e-04 1.73510341e-04] [ 2.24801180e-04 2.52006621e-04 -9.40542195e-05] [-1.37137695e-04 1.78807983e-04 1.14229588e-04] [ 2.68689246e-04 -1.85087816e-04 -1.59911736e-04] [-1.82770228e-04 -1.03557401e-04 3.20267972e-05] [-9.07858872e-05 -2.70450221e-05 -1.94391772e-04] [ 1.79007232e-04 3.15287120e-04 1.04395815e-07] [-2.67059389e-04 1.66307205e-05 -1.01409977e-04] [ 1.55379269e-04 1.07640127e-04 3.39519687e-05] [ 2.20755753e-04 -6.72993870e-05 5.18870515e-05] [-3.32701364e-04 -5.57224726e-05 1.83400351e-04] [ 9.33969471e-05 1.82465018e-05 -1.81925061e-04] [ 1.30474507e-04 -1.39891716e-04 1.67893903e-04] [ 4.96077815e-05 -9.67566238e-05 -7.49545506e-05] [ 1.75299609e-04 2.24167397e-04 2.76112450e-04] [-1.50506726e-04 7.99650310e-05 -1.16700880e-04] [-9.06189776e-05 1.66619715e-04 -6.53131038e-05] [-5.07213681e-05 -2.54681592e-04 -2.32814890e-05] [-1.88242341e-04 7.03380904e-06 2.42828985e-05] [-1.22551618e-04 -1.79231833e-05 2.50129711e-07] [ 2.97223573e-04 1.75869021e-05 -3.28277308e-06] [-2.62380699e-04 1.76798895e-05 1.59868240e-06] [ 3.59534951e-04 -1.83435536e-05 1.57364654e-06] [ 7.74034355e-05 1.04210705e-04 -6.41366800e-05] [ 4.79390961e-05 -1.04989741e-04 -6.44259959e-05] [-2.88745555e-04 7.98198187e-05 -5.93142876e-05] [ 4.04479447e-04 -8.14764460e-05 -6.19538871e-05] [ 1.57452858e-05 -6.65388241e-05 1.11357516e-05] [ 1.40517164e-04 7.22072440e-05 9.31747818e-06] [ 4.39378381e-04 -3.37903533e-05 1.37799180e-05] [-2.32777199e-04 3.22888330e-05 1.50670104e-05] [ 4.34840764e-05 -5.36193079e-05 6.64255034e-05] [-3.04827851e-05 5.36797442e-05 6.51979927e-05] [ 1.28696526e-04 1.59077268e-05 -2.95436633e-07] [ 2.69726941e-04 -1.43355906e-05 -8.41067662e-07] [ 6.41235266e-05 -1.20897679e-04 8.05608979e-05] [-1.96513249e-04 -3.59490018e-05 2.91880264e-05] [-2.07574066e-04 -1.32973103e-04 -5.57313935e-05] [ 7.24845148e-05 2.86864932e-04 -1.05760169e-04] [ 1.06815789e-04 -2.69727226e-05 3.09471437e-04] [ 1.50847773e-04 2.48747589e-04 -7.22919785e-05] [ 7.42136574e-05 -2.07561347e-06 2.07620862e-04] [ 1.88315060e-04 -2.25513233e-04 -1.66371872e-04]] Final stress: [-1.14397660e-06 -1.34329717e-06 -8.63617070e-06 -2.37203931e-09 -8.16903337e-07 3.89884653e-06] Minimization converged after 118 steps. Minimization converged after 115 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 17 steps. Minimization converged after 16 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 116 steps. Minimization converged after 119 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 1 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 0 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 1 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90412 0.54231 0.43125 -0. -0. -0.0275 ] [ 0.54231 0.91053 0.49799 0. 0. -6.97171] [ 0.43125 0.49799 0.77681 0. 0. 175.33909] [ -0. 0. 0. 0.24759 -0. -1.10689] [ -0. 0. 0. -0. 0.20614 0. ] [ -0.0275 -6.97171 175.33909 -1.10689 0. -77.65192]] 95%% Error estimate [ASE units]: [[ 0.00001 0.00001 0. 0. 0.00001 0.24333] [ 0.00001 0.00001 0. 0. 0.00001 391.99452] [ 0. 0. 0.00001 0. 0. 1551.83531] [ 0. 0. 0. 0. 0.00002 148.82276] [ 0.00001 0.00001 0. 0.00002 0. 0.00031] [ 0.24333 391.99452 1551.83531 148.82276 0.00031 799.27092]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 775.917653 is too big compared to maximum elastic constant component 175.339090 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 175.339090 WARNING: Maximum deviation from material symmetry according to space group 31 is too big compared to maximum elastic constant component 175.339090 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 52 steps. Minimization converged after 64 steps. Minimization converged after 51 steps. Minimization converged after 55 steps. Minimization converged after 62 steps. Minimization converged after 51 steps. Minimization converged after 51 steps. Minimization converged after 55 steps. Minimization converged after 65 steps. Minimization converged after 63 steps. Minimization converged after 71 steps. Minimization converged after 71 steps. Minimization converged after 89 steps. Minimization converged after 88 steps. Minimization converged after 98 steps. Minimization converged after 97 steps. Minimization converged after 84 steps. Minimization converged after 82 steps. Minimization converged after 117 steps. Minimization converged after 117 steps. Minimization converged after 92 steps. Minimization converged after 91 steps. Minimization converged after 57 steps. Minimization converged after 54 steps. Minimization converged after 70 steps. Minimization converged after 58 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 82 steps. Minimization converged after 82 steps. Minimization converged after 70 steps. Minimization converged after 70 steps. Minimization converged after 93 steps. Minimization converged after 93 steps. Minimization converged after 94 steps. Minimization converged after 94 steps. Minimization converged after 143 steps. Minimization converged after 144 steps. Minimization converged after 119 steps. Minimization converged after 121 steps. Minimization converged after 62 steps. Minimization converged after 80 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-1.10189635e-13 1.55520941e-02 -2.65994452e-03] [-2.67553627e-14 2.57391113e-02 -3.99123473e-03] [-1.23075161e-13 -1.67057905e-03 -4.82237610e-03] [-2.43985046e-14 -2.58334949e-03 -1.08821605e-04] [ 2.79776202e-14 -1.66987622e-03 6.76145356e-03] [ 5.61026919e-14 -5.04053180e-03 -6.61955764e-03] [ 1.22402088e-13 5.61001762e-03 -8.60913623e-03] [ 9.25528283e-14 -5.54863281e-03 -9.93032872e-03] [ 1.24206201e-14 -1.03074280e-02 -8.21629662e-04] [-9.93451711e-14 5.67294422e-03 -2.00483867e-03] [-3.73867604e-14 -7.38114970e-04 4.03335488e-03] [ 1.07309994e-14 2.10241736e-03 4.24782671e-04] [ 1.27023392e-13 -6.42988314e-04 1.19349845e-03] [-1.40000181e-13 -3.81359968e-03 -7.94226039e-04] [ 6.62594979e-14 7.24839757e-04 -8.12806645e-03] [ 2.96195976e-15 -2.23999842e-02 -3.79864450e-03] [-1.78579374e-13 -3.35271474e-03 2.92014438e-03] [ 6.35335556e-14 2.17662808e-02 -1.51894423e-02] [ 3.49720253e-14 -4.10468820e-04 5.36364028e-03] [ 7.25322580e-14 8.66385889e-03 4.52218217e-03] [ 1.48908663e-14 -4.55251954e-04 -7.51902776e-05] [-1.18044642e-13 -4.94732701e-03 -1.27991862e-03] [ 3.01321468e-14 4.34257345e-02 4.17508785e-03] [ 2.63481592e-13 2.06797867e-02 -4.21025380e-03] [ 2.66286992e-13 -3.15183062e-03 7.68638478e-03] [ 2.07476180e-14 1.34191282e-03 5.66193141e-03] [ 3.90104615e-14 -2.87170175e-02 3.02589586e-03] [-1.58092289e-13 8.38333618e-03 1.63160038e-03] [-1.25401425e-13 2.39039133e-03 -6.22537750e-03] [ 6.70230586e-14 -2.82382949e-03 2.85387936e-03] [-6.66133815e-15 5.25535790e-04 5.73129883e-03] [ 2.55666912e-13 2.57890523e-03 2.49835137e-03] [-8.83737528e-14 -6.75349926e-03 -5.77156574e-03] [ 4.75348927e-14 -5.34076261e-03 2.27284198e-03] [ 2.38231639e-03 -4.09477337e-03 -1.74544006e-03] [-7.42002385e-04 -1.63454152e-03 8.90020085e-04] [ 7.42002385e-04 -1.63454152e-03 8.90020085e-04] [-2.38231639e-03 -4.09477337e-03 -1.74544006e-03] [-7.56308971e-03 4.63458805e-03 -1.61603583e-03] [ 3.17511834e-03 -5.62592141e-04 1.51892421e-03] [-3.17511834e-03 -5.62592141e-04 1.51892421e-03] [ 7.56308971e-03 4.63458805e-03 -1.61603583e-03] [-5.62007409e-04 4.85128050e-03 -2.09891971e-03] [ 2.98519756e-04 -4.43518173e-04 -3.32520011e-03] [-2.98519756e-04 -4.43518173e-04 -3.32520011e-03] [ 5.62007409e-04 4.85128050e-03 -2.09891971e-03] [ 2.61008774e-03 4.01241538e-03 5.57023821e-03] [-6.80786881e-03 6.88136681e-03 -2.65334336e-03] [ 6.80786881e-03 6.88136681e-03 -2.65334336e-03] [-2.61008774e-03 4.01241538e-03 5.57023821e-03] [ 5.15467213e-05 -4.65832852e-05 -8.22390766e-04] [-2.95135737e-03 3.99532736e-05 -1.54144491e-04] [ 2.95135737e-03 3.99532735e-05 -1.54144491e-04] [-5.15467214e-05 -4.65832852e-05 -8.22390765e-04] [ 3.41091370e-03 -3.14328937e-03 -7.78343630e-04] [ 5.34148447e-03 1.35089569e-02 -9.49180984e-03] [-5.34148447e-03 1.35089569e-02 -9.49180984e-03] [-3.41091370e-03 -3.14328937e-03 -7.78343630e-04] [-1.66027694e-03 -2.08036295e-03 2.10449967e-03] [-1.64911113e-03 -1.03303666e-02 4.77900305e-03] [ 1.64911113e-03 -1.03303666e-02 4.77900305e-03] [ 1.66027694e-03 -2.08036295e-03 2.10449967e-03] [-1.10997164e-03 4.36767124e-03 -4.36042914e-03] [ 6.02934634e-03 1.43798150e-03 -1.74004100e-03] [-6.02934635e-03 1.43798150e-03 -1.74004100e-03] [ 1.10997164e-03 4.36767124e-03 -4.36042914e-03] [ 4.25838103e-03 -1.89059001e-03 -1.85157744e-03] [-4.54527781e-03 1.95423643e-03 1.86831164e-03] [ 4.54527781e-03 1.95423643e-03 1.86831164e-03] [-4.25838103e-03 -1.89059001e-03 -1.85157744e-03] [ 1.66348556e-03 6.47216364e-03 2.50999527e-03] [-2.94985711e-03 4.80282713e-03 1.17451455e-03] [ 2.94985711e-03 4.80282713e-03 1.17451455e-03] [-1.66348556e-03 6.47216364e-03 2.50999527e-03] [ 3.65844915e-03 3.72943816e-03 6.46770195e-04] [-3.29263944e-03 -2.57907675e-03 5.53377494e-03] [ 3.29263944e-03 -2.57907675e-03 5.53377494e-03] [-3.65844915e-03 3.72943816e-03 6.46770195e-04] [-6.10622664e-16 -5.05100674e-04 -3.41202073e-03] [ 2.20596084e-13 -1.30466184e-03 9.65489607e-04] [ 1.89293026e-14 -1.95369052e-03 2.34176282e-03] [ 1.80508921e-13 -2.06087124e-03 -2.42892969e-03] [ 8.63753513e-14 1.83021257e-03 3.05610317e-03] [-2.20201461e-14 -5.59635697e-03 -1.13858805e-03] [-4.46727318e-13 -3.52497821e-04 5.33934216e-03] [ 5.39021952e-14 -9.68596960e-04 -1.85914674e-04] [ 4.95194163e-13 -2.09029838e-02 -1.97847222e-03] [ 2.57427326e-13 -1.30677167e-02 1.37829383e-03] [ 3.91908728e-14 1.85659827e-03 3.37101028e-03] [ 7.69172662e-14 -4.36257357e-04 -8.40463627e-04] [-1.14241949e-13 3.82869985e-03 2.13142981e-03] [ 1.01998271e-13 8.61779637e-03 5.65508449e-04] [ 2.60725252e-13 -2.08504962e-02 -3.67708124e-03] [-7.03258896e-14 -2.14418518e-02 4.43042874e-03] [ 6.42070490e-03 -7.56913683e-03 6.46083988e-03] [-1.51702636e-04 -3.29747748e-03 8.15047966e-03] [ 1.51702636e-04 -3.29747748e-03 8.15047966e-03] [-6.42070490e-03 -7.56913683e-03 6.46083988e-03] [-6.37609059e-03 -8.97241316e-03 -4.74795646e-03] [-1.47053342e-03 -7.88960070e-04 1.36142358e-03] [ 1.47053342e-03 -7.88960069e-04 1.36142358e-03] [ 6.37609059e-03 -8.97241316e-03 -4.74795646e-03]] Final stress: [ 4.19623088e-03 4.55649541e-03 7.44721214e-03 4.67582430e-03 1.63308845e-16 -2.84015382e-16] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 1.02431952e-13 -2.57374769e-02 -3.99117617e-03] [ 1.61474133e-13 -1.55499955e-02 -2.65997415e-03] [ 6.37268016e-14 2.58060505e-03 -1.08135259e-04] [ 6.02171499e-14 1.67072229e-03 -4.82269054e-03] [-3.03784775e-14 5.04096323e-03 -6.61987847e-03] [-3.76330911e-14 1.67010851e-03 6.76128216e-03] [-5.22359933e-14 5.54571905e-03 -9.92574593e-03] [-4.63401468e-14 -5.60734771e-03 -8.60718924e-03] [ 4.34721703e-14 -5.67262575e-03 -2.00445174e-03] [ 9.81043846e-15 1.03055000e-02 -8.20952066e-04] [-8.49320614e-15 -2.10338710e-03 4.25293582e-04] [ 6.34856748e-14 7.37109734e-04 4.03306064e-03] [-8.57092175e-14 3.81406367e-03 -7.94165521e-04] [ 3.10957044e-14 6.44961462e-04 1.19163681e-03] [ 1.08191234e-13 2.23977731e-02 -3.79834039e-03] [-1.24676074e-13 -7.28353178e-04 -8.12933054e-03] [ 1.66533454e-15 -2.17659385e-02 -1.51891407e-02] [ 2.26525782e-14 3.35257837e-03 2.91981980e-03] [ 6.41153797e-15 -8.66437803e-03 4.52244316e-03] [ 1.33990041e-14 4.09552982e-04 5.36376893e-03] [ 8.98170427e-14 4.94644463e-03 -1.27940515e-03] [-5.71947647e-14 4.56029474e-04 -7.58524773e-05] [-8.63198402e-14 -2.06777971e-02 -4.20945727e-03] [ 3.18304411e-14 -4.34231383e-02 4.17471238e-03] [-5.99520433e-15 -1.33978032e-03 5.65718320e-03] [-4.14859716e-13 3.15154297e-03 7.68543749e-03] [ 1.15726873e-13 -8.38233704e-03 1.63107808e-03] [ 7.17845922e-14 2.87168187e-02 3.02855817e-03] [-8.97042857e-14 2.82475740e-03 2.85312735e-03] [ 3.72295258e-14 -2.38990348e-03 -6.22567939e-03] [-1.25760513e-13 -2.58011934e-03 2.49730864e-03] [ 4.82489307e-15 -5.25136389e-04 5.73120459e-03] [-5.19029264e-14 5.34057612e-03 2.27198614e-03] [ 4.19091845e-14 6.75206430e-03 -5.77134613e-03] [ 7.42545698e-04 1.63434511e-03 8.89120929e-04] [-2.38298117e-03 4.09521769e-03 -1.74543640e-03] [ 2.38298117e-03 4.09521769e-03 -1.74543640e-03] [-7.42545698e-04 1.63434511e-03 8.89120929e-04] [-3.17557193e-03 5.62818456e-04 1.51905268e-03] [ 7.56301213e-03 -4.63375736e-03 -1.61594992e-03] [-7.56301213e-03 -4.63375736e-03 -1.61594992e-03] [ 3.17557193e-03 5.62818456e-04 1.51905268e-03] [-2.98369673e-04 4.43167854e-04 -3.32505512e-03] [ 5.62105142e-04 -4.85149567e-03 -2.09869004e-03] [-5.62105142e-04 -4.85149567e-03 -2.09869004e-03] [ 2.98369673e-04 4.43167854e-04 -3.32505512e-03] [ 6.80829778e-03 -6.88100163e-03 -2.65308174e-03] [-2.61036841e-03 -4.01221528e-03 5.56992569e-03] [ 2.61036841e-03 -4.01221528e-03 5.56992569e-03] [-6.80829778e-03 -6.88100163e-03 -2.65308174e-03] [ 2.95288423e-03 -3.91082364e-05 -1.52893411e-04] [-5.14230435e-05 4.68654971e-05 -8.22190538e-04] [ 5.14230436e-05 4.68654971e-05 -8.22190538e-04] [-2.95288423e-03 -3.91082366e-05 -1.52893411e-04] [-5.33956674e-03 -1.35085437e-02 -9.49040015e-03] [-3.41132677e-03 3.14319319e-03 -7.78509653e-04] [ 3.41132677e-03 3.14319319e-03 -7.78509653e-04] [ 5.33956674e-03 -1.35085437e-02 -9.49040015e-03] [ 1.65000853e-03 1.03308368e-02 4.77837776e-03] [ 1.66085138e-03 2.08023166e-03 2.10410421e-03] [-1.66085138e-03 2.08023166e-03 2.10410421e-03] [-1.65000853e-03 1.03308368e-02 4.77837776e-03] [-6.02994407e-03 -1.43763944e-03 -1.73969992e-03] [ 1.11036342e-03 -4.36770483e-03 -4.36024960e-03] [-1.11036342e-03 -4.36770483e-03 -4.36024960e-03] [ 6.02994408e-03 -1.43763944e-03 -1.73969992e-03] [ 4.54346610e-03 -1.95414643e-03 1.86779308e-03] [-4.25834482e-03 1.89028364e-03 -1.85211048e-03] [ 4.25834482e-03 1.89028363e-03 -1.85211048e-03] [-4.54346610e-03 -1.95414643e-03 1.86779308e-03] [ 2.95049371e-03 -4.80122636e-03 1.17420051e-03] [-1.66390538e-03 -6.47127965e-03 2.51059167e-03] [ 1.66390538e-03 -6.47127965e-03 2.51059167e-03] [-2.95049370e-03 -4.80122636e-03 1.17420052e-03] [ 3.29240458e-03 2.57903228e-03 5.53426503e-03] [-3.65719195e-03 -3.72865180e-03 6.47802503e-04] [ 3.65719195e-03 -3.72865180e-03 6.47802503e-04] [-3.29240458e-03 2.57903228e-03 5.53426503e-03] [-2.58348898e-13 1.30235537e-03 9.68925543e-04] [-1.65261210e-14 5.05901505e-04 -3.41211195e-03] [-8.94839758e-14 2.06200689e-03 -2.42875690e-03] [ 5.57552763e-14 1.95302335e-03 2.34271432e-03] [-1.31172850e-13 5.59392458e-03 -1.13924146e-03] [-4.17274722e-14 -1.82852912e-03 3.05595119e-03] [ 2.84025787e-13 9.69191429e-04 -1.88228943e-04] [ 2.78277401e-13 3.51467903e-04 5.33893312e-03] [-4.07751090e-13 1.30675153e-02 1.37809248e-03] [-9.87342313e-14 2.09032248e-02 -1.97838038e-03] [-6.10622664e-14 4.34931765e-04 -8.41078489e-04] [-7.48248577e-14 -1.85556124e-03 3.36983618e-03] [-2.63677968e-14 -8.61643708e-03 5.66427709e-04] [ 9.59171978e-14 -3.82903593e-03 2.13010876e-03] [ 8.15976789e-14 2.14394608e-02 4.43035194e-03] [ 1.79240981e-15 2.08475854e-02 -3.67676145e-03] [ 1.50884370e-04 3.29808932e-03 8.14959592e-03] [-6.41968166e-03 7.56808592e-03 6.45962580e-03] [ 6.41968166e-03 7.56808592e-03 6.45962580e-03] [-1.50884370e-04 3.29808932e-03 8.14959592e-03] [ 1.46884798e-03 7.87381083e-04 1.36239657e-03] [ 6.37578146e-03 8.97162088e-03 -4.74847121e-03] [-6.37578146e-03 8.97162088e-03 -4.74847121e-03] [-1.46884798e-03 7.87381083e-04 1.36239657e-03]] Final stress: [ 4.19623251e-03 4.55649049e-03 7.44723206e-03 -4.67583021e-03 1.68042435e-16 -1.63308845e-16] Minimization converged after 82 steps. Minimization converged after 90 steps. Minimization converged after 86 steps. Minimization converged after 86 steps. Minimization converged after 122 steps. Minimization converged after 122 steps. Minimization converged after 100 steps. Minimization converged after 100 steps. Minimization converged after 135 steps. Minimization converged after 135 steps. Minimization converged after 82 steps. Minimization converged after 81 steps. Minimization converged after 154 steps. Minimization converged after 153 steps. Minimization converged after 154 steps. Minimization converged after 154 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.04484936e-06 -1.22702637e-05 -4.29507333e-06] [ 1.53097098e-07 -3.49576445e-06 3.25874085e-06] [-1.32110203e-07 -1.87849611e-06 -5.20803896e-06] [-1.87433938e-06 -3.10462682e-06 -4.15945400e-06] [-1.40655362e-06 -3.52440885e-07 -5.15349340e-07] [-2.88250716e-06 5.36817028e-06 1.34640752e-06] [-7.16664485e-07 4.67567632e-06 -6.59469809e-07] [-8.91496366e-07 1.53334782e-06 4.23249801e-07] [ 1.83507811e-06 3.93899123e-06 -6.05588506e-06] [-1.29062870e-06 7.36258149e-06 -1.99100085e-07] [ 3.00781508e-06 3.87965173e-06 -8.09146424e-07] [-1.08038425e-06 -4.15465462e-06 -2.11298278e-06] [ 5.84981422e-06 -2.08453336e-06 -5.70342165e-06] [-1.02013899e-06 4.83348600e-06 1.48955486e-06] [ 1.47643967e-06 4.35356094e-06 -2.46448105e-06] [ 2.11913593e-06 4.57020927e-06 -5.53496606e-06] [ 3.97880307e-06 1.91624329e-06 -8.76778337e-07] [-2.75175907e-06 1.78075408e-06 8.34401836e-08] [-3.39621114e-07 2.04462939e-06 -2.66316568e-06] [-4.64935252e-06 -5.15443513e-06 1.86552556e-07] [ 9.17576609e-07 -2.54343893e-06 5.59999437e-07] [-3.40147886e-06 3.17341108e-06 -2.68532723e-06] [-4.90211308e-07 2.45290643e-06 5.78274241e-06] [-5.65622733e-06 2.09444063e-07 -1.64337703e-06] [ 5.97833945e-08 -1.95151968e-06 2.06747819e-06] [ 4.62999675e-06 -2.96353083e-06 -1.47638522e-06] [ 3.97573055e-06 3.60212985e-06 5.75752285e-06] [ 8.46631194e-07 -2.69304473e-06 -5.32049401e-06] [ 8.32619295e-07 9.59932116e-07 1.78088278e-06] [-1.91377286e-06 4.44157329e-06 5.90731957e-06] [ 1.48384985e-06 1.56436116e-06 4.08475216e-06] [ 2.41750113e-06 -7.86911444e-07 4.81959622e-06] [ 3.54604717e-06 3.05310098e-06 1.93988458e-06] [ 5.43091727e-06 2.00224537e-06 6.50475812e-06] [ 1.05839454e-06 1.51459164e-06 -1.65053473e-06] [ 6.16880000e-06 -1.57723628e-06 -2.08971472e-06] [-1.12977994e-06 2.57283345e-06 -1.14444610e-06] [-9.50852150e-06 -8.69596181e-07 3.44792106e-06] [ 6.74613758e-06 -4.17100684e-06 -3.67827422e-06] [ 4.27408441e-06 2.63363444e-06 -2.15726906e-06] [ 7.52834243e-06 -1.95741835e-06 1.05042403e-06] [-3.18024828e-06 -1.36764667e-06 6.93160989e-07] [ 1.14378540e-06 -5.00778567e-06 1.76086023e-07] [ 3.46249327e-07 2.39172330e-06 -2.47736678e-06] [ 7.79252418e-07 -1.16257015e-05 3.38566849e-06] [ 2.13424622e-06 1.32094543e-06 -3.26758534e-06] [-4.84089262e-08 -4.08806363e-06 8.00028566e-06] [-2.86507134e-06 -3.08537827e-06 2.42862041e-06] [ 3.28128659e-06 -1.74229087e-06 -2.41860643e-07] [-1.11689685e-06 2.50754636e-06 5.08650186e-06] [-4.18585746e-07 -5.05075120e-06 2.11486294e-06] [ 4.84609038e-07 8.13958044e-06 -1.55520134e-06] [-1.87845645e-06 -3.94100186e-06 -3.71208063e-06] [-6.77675478e-06 1.72367184e-06 -2.65423449e-06] [-4.36833552e-06 1.54273548e-06 5.93528062e-07] [-2.83056428e-06 -1.11032211e-06 2.93733180e-06] [-3.57286511e-06 -3.07243130e-06 -7.15593466e-06] [-3.95932716e-06 5.00816550e-06 6.30194325e-07] [ 3.53158481e-06 -7.48676016e-07 -4.51504569e-06] [-1.22253507e-06 1.37250965e-06 -5.83088055e-06] [-3.98077396e-06 2.16178244e-06 -2.24345189e-06] [ 3.05870972e-06 1.35103076e-07 -2.01836137e-06] [-5.83836024e-06 4.32990268e-06 4.63281236e-06] [-1.87208729e-06 -5.34828229e-06 2.70039084e-06] [ 3.51436780e-06 2.92848859e-06 5.80708961e-06] [-5.98068283e-06 5.37377241e-06 -7.49019429e-07] [ 1.23431517e-06 3.36733002e-06 2.07876930e-06] [ 8.14582051e-07 2.23865156e-06 6.53370775e-08] [-7.61988249e-08 2.99778434e-06 4.42435238e-06] [-2.50159315e-06 -3.68340495e-06 -4.36449612e-06] [ 1.64765643e-06 -4.52348324e-06 -1.74589190e-06] [-4.97898836e-06 2.97046531e-06 2.78136573e-06] [-2.89452358e-06 -1.90545933e-06 7.15403642e-07] [ 3.52356735e-06 -2.34629886e-06 4.04741933e-06] [ 2.71973499e-06 -2.20877127e-06 1.02053306e-06] [-2.70262908e-06 -1.75924296e-06 5.48541293e-07] [ 1.06711974e-06 -8.19943729e-08 1.26200709e-06] [ 1.05810860e-06 -2.12148593e-06 3.51111639e-06] [-7.02676664e-07 -3.79675009e-07 -3.16368526e-06] [ 2.55170476e-06 1.66202685e-06 3.80471372e-06] [-2.08179898e-06 1.83649037e-06 2.69239716e-06] [-8.38499670e-06 -6.43148636e-06 1.06243563e-06] [ 4.63059918e-06 -2.52598090e-06 1.21676919e-06] [-5.41455502e-06 -2.69998384e-06 -2.89572990e-06] [ 2.95145495e-06 1.39328841e-06 6.39405987e-08] [ 2.99721196e-06 7.07545477e-07 2.78557378e-06] [ 6.74883813e-07 4.96489637e-06 -3.47866495e-07] [ 6.71962792e-07 -6.84285338e-07 -2.80195934e-07] [ 5.98339284e-06 -1.28308096e-06 2.00306604e-06] [ 3.86239355e-06 -3.47730788e-06 -2.56335096e-07] [-3.54207328e-06 -3.61020245e-07 -2.55157467e-06] [ 7.19388161e-07 -4.62796530e-06 1.56311051e-06] [ 1.45636342e-06 -2.45215788e-06 1.29821734e-06] [-3.37777843e-06 2.85929836e-06 5.62087087e-06] [-3.60389431e-06 4.83002213e-07 -2.59622220e-06] [-8.48942285e-07 1.87406956e-07 -2.48735921e-06] [ 4.15649134e-06 2.52589063e-06 3.45609255e-06] [-2.67230659e-06 4.76387449e-07 -4.47826315e-06] [ 1.83214895e-06 -7.85434998e-07 -7.52088928e-06] [ 2.08830950e-06 2.90372835e-06 -1.85173800e-06] [-7.99258881e-07 -2.06535878e-06 -6.75787969e-06] [ 1.33079001e-06 -3.46457538e-07 5.12249139e-06]] Final stress: [-3.40261941e-03 9.69952800e-04 1.68493568e-03 4.98269127e-03 3.30685655e-06 3.27092679e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-6.67844585e-06 3.46716922e-06 -4.47441469e-06] [ 1.10351608e-06 -4.18641043e-06 -2.92164200e-06] [ 7.34930596e-07 -4.12375056e-06 2.37251855e-06] [-3.58754952e-07 -2.16416316e-06 1.13801265e-06] [ 5.46203608e-06 -2.32584439e-06 -4.04233711e-07] [ 3.36853567e-06 3.04943373e-06 4.54554033e-06] [ 3.09305511e-06 9.36960836e-06 -4.28014962e-06] [-3.57269829e-06 -2.48322551e-06 3.57761417e-06] [-2.92529015e-06 2.34497536e-06 -2.01584774e-06] [-2.46856088e-06 -8.51191926e-06 5.69101293e-06] [-5.29931939e-06 1.01076879e-06 5.30296047e-06] [ 1.43077615e-06 -3.54304650e-06 1.67262134e-06] [-5.69913932e-06 -2.77709495e-06 6.81389404e-06] [-6.66427070e-06 -4.54809711e-06 -6.31891879e-06] [ 5.15169601e-07 -6.21747384e-06 9.82482089e-07] [-3.00298915e-07 9.93525301e-06 -6.44035721e-06] [-1.86068236e-06 -3.66962448e-06 -1.99564925e-06] [ 4.87926294e-06 -7.31281387e-06 1.93484693e-06] [-6.14754717e-08 4.96802367e-07 -2.01505381e-06] [ 6.89356954e-06 -5.21508577e-06 1.04848015e-06] [-2.36821336e-06 -3.54815974e-06 4.62246218e-07] [ 4.89008858e-06 2.52538202e-07 -5.81254287e-06] [ 2.06041184e-06 1.69733537e-05 8.01473904e-06] [-3.46767263e-06 3.08096946e-06 2.60197412e-06] [-3.49925386e-06 -1.81316682e-06 -1.21629138e-06] [ 1.82278643e-06 2.26912741e-06 4.35848735e-06] [ 5.99360814e-08 3.69729250e-06 -1.46311340e-05] [-3.14032921e-06 -5.03522878e-06 4.37030448e-06] [ 6.18746217e-06 2.30747194e-06 -5.69869456e-07] [ 3.08916354e-06 4.78979935e-06 5.74401163e-06] [-3.79833690e-06 2.11953434e-06 3.93203906e-06] [-8.15420045e-07 8.42231822e-07 6.66034418e-06] [-1.98860485e-07 -3.74865702e-06 3.22326353e-06] [-4.74611124e-06 -7.42798159e-08 7.99261903e-06] [ 9.28518058e-06 8.48364059e-07 4.06247963e-06] [ 2.07846727e-06 5.58929326e-06 -2.19545811e-06] [-7.06701868e-06 -7.06024138e-06 3.12368180e-06] [-2.94384399e-06 -2.41378464e-06 -3.27842804e-06] [-8.53306685e-06 4.70793349e-06 -2.40890131e-07] [-2.48439918e-06 6.48714622e-07 1.38581325e-06] [-1.31238700e-06 6.00033194e-06 -2.55529650e-06] [ 3.28039810e-06 1.82922353e-06 -1.62725716e-06] [-7.93322743e-06 -1.34863811e-07 -4.91658496e-06] [ 3.24981508e-06 9.35228013e-06 -5.17216875e-06] [-1.21315322e-06 -7.89954818e-07 -3.20071231e-06] [-1.64088335e-06 -6.04731986e-06 7.47333471e-07] [-6.82880373e-07 5.53004477e-06 6.17180697e-06] [ 3.64072275e-07 1.50482495e-07 -1.70802181e-06] [ 3.44305857e-06 -2.32824968e-06 9.26603243e-06] [ 8.92556216e-06 6.26122005e-06 -1.31805836e-06] [ 5.69557816e-06 -1.08646545e-05 -8.41145180e-06] [ 3.99060826e-06 9.21496411e-07 -4.84788794e-06] [-9.71931623e-08 5.69437392e-06 5.42183189e-07] [ 4.67544970e-06 -6.59951829e-06 6.87321594e-07] [ 7.17016740e-06 -3.52546117e-07 3.40738014e-06] [ 9.20610771e-06 5.69679984e-06 -4.80931606e-06] [-2.89549334e-06 -6.92612693e-06 1.59423767e-06] [ 4.76599226e-07 7.67857769e-06 2.03236748e-06] [ 9.65349054e-07 -1.73271739e-07 -1.50255205e-06] [ 7.78213156e-06 -7.08237337e-07 -4.63123428e-06] [-1.06372250e-06 3.46978573e-06 -1.21104843e-05] [ 5.34667794e-06 -1.83822763e-07 -4.85747198e-06] [-3.25390241e-06 -8.29677008e-07 -3.14376603e-06] [-7.14930396e-06 -3.56212169e-06 -1.83721615e-06] [-4.19569626e-06 -6.34252684e-06 -3.34637089e-06] [ 6.41260011e-06 -1.54522613e-06 1.34507462e-05] [ 1.26638460e-06 -3.48692025e-06 -6.68218583e-06] [-1.35799604e-06 6.00463824e-06 4.77372342e-06] [-1.39032172e-06 3.36274658e-06 4.82119940e-06] [ 3.98074637e-06 2.28438491e-06 -3.60558921e-06] [-1.19006189e-06 -1.15978415e-05 5.61860796e-06] [ 3.63161825e-06 2.35060036e-06 1.74717502e-06] [ 3.38766261e-06 9.06247391e-06 3.35168307e-06] [-1.08567039e-05 -8.32067701e-07 -2.88697849e-07] [-8.40947855e-06 -2.67531916e-06 4.53915719e-06] [ 3.53038825e-06 3.86201861e-06 -4.84209001e-06] [-5.78695529e-06 5.98675206e-06 8.00207789e-06] [-9.90858788e-07 -1.44256238e-06 1.99346266e-06] [-4.79122733e-06 1.22078857e-06 3.11906313e-06] [-5.84133230e-06 -1.00064968e-06 -4.44506678e-07] [-6.51038258e-06 1.51566425e-06 1.11828475e-06] [ 1.14252715e-05 -2.43806223e-06 -3.46069948e-06] [-9.58338683e-07 2.09069335e-06 5.13225268e-06] [ 2.18650747e-06 -1.71962668e-06 -5.14520464e-07] [-1.19445100e-07 5.26880174e-06 -3.49944582e-06] [-6.47335468e-06 4.80981958e-06 -1.54466015e-06] [-1.53921619e-06 -3.23886686e-06 -7.29185928e-06] [-3.07783892e-06 -2.20373837e-06 -1.31821748e-06] [-5.57718229e-06 4.73172892e-06 -4.19170190e-06] [ 3.74934638e-06 -2.59852028e-06 -1.34240270e-07] [ 8.28287880e-07 5.01589531e-06 6.69650961e-06] [ 2.70861291e-06 -6.65923462e-06 2.11695806e-06] [ 4.15320297e-06 -1.20936424e-05 3.91170121e-06] [ 6.08068601e-06 -1.15666106e-06 2.97215422e-06] [ 5.01393346e-06 -2.26707346e-06 -9.03149221e-07] [-5.63201091e-06 4.51190685e-06 -2.12204003e-06] [-4.61022368e-06 -7.41252195e-06 -7.97088194e-07] [ 1.99059715e-06 -3.85022376e-07 -4.13827632e-07] [-1.33976958e-06 -8.67799314e-06 9.99072263e-07] [ 5.83251441e-06 -2.13589719e-06 -9.47778432e-06] [-4.61831967e-07 8.04798108e-06 -2.32405322e-07] [-4.00447713e-07 1.67026097e-06 -9.25303734e-06]] Final stress: [-3.40269656e-03 9.69978962e-04 1.68495132e-03 4.98270567e-03 -3.34307963e-06 -3.27094657e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.32922026e-05 2.43517125e-06 1.42362667e-06] [ 6.92318345e-06 -3.91537090e-06 4.76430781e-06] [ 2.08363137e-06 5.45891261e-06 7.84208332e-06] [ 1.36050352e-05 -8.08933946e-06 3.02439520e-06] [ 9.99406253e-06 -9.07465673e-07 5.89034639e-06] [ 5.39477107e-06 -3.39383053e-07 -2.65001180e-06] [ 1.19320944e-05 3.15390589e-06 2.28050526e-06] [-5.86741326e-06 5.53786844e-07 9.75782092e-07] [-2.53191860e-06 1.10138544e-05 1.18268571e-06] [ 1.53234515e-06 3.84424363e-07 5.30576781e-06] [-3.79101822e-06 8.32972864e-06 4.93321494e-06] [-7.63447735e-06 1.41449720e-06 2.49610397e-06] [ 3.23464746e-06 -5.28802495e-06 -5.01324536e-06] [-2.71490178e-06 7.84898056e-06 -4.97035170e-06] [ 4.05644182e-07 6.89133272e-06 -1.54266274e-06] [-9.47030332e-06 2.47486849e-06 4.43434846e-07] [-5.75678138e-06 4.56176070e-06 5.81503950e-06] [ 3.45995392e-06 2.20147869e-06 -7.30582835e-06] [ 3.19393374e-06 1.12367429e-05 1.48035079e-07] [ 3.33847657e-06 -9.12936074e-06 1.04206325e-06] [-5.16997869e-07 1.23742277e-05 2.59849997e-06] [ 3.19313994e-06 -1.19188781e-05 -3.64067660e-06] [ 2.52264225e-06 -1.28999795e-05 9.65796947e-06] [ 1.62363275e-05 -1.16848575e-05 -4.12696692e-06] [ 3.23863744e-06 -1.77639362e-05 6.31945359e-06] [-1.70339927e-06 -2.75950206e-06 -4.74699000e-06] [-1.29744147e-05 -1.12797887e-05 1.63818432e-05] [ 2.73134679e-06 6.65848867e-06 -2.49929564e-07] [-1.20104304e-05 -6.79544617e-06 8.64729921e-06] [ 1.47084931e-06 1.55060885e-05 -9.59088163e-06] [-3.43470038e-06 -4.27026972e-06 -2.39837537e-06] [ 9.21609356e-06 -1.63853768e-06 8.38268450e-06] [-2.12264499e-06 9.33938282e-06 -3.61044826e-06] [ 1.35575891e-05 -4.65796517e-06 7.44416863e-06] [ 1.65912113e-06 9.48880079e-06 -1.29083557e-06] [-5.47233371e-07 -8.01232330e-06 1.34070857e-06] [ 5.08596516e-07 -5.68489020e-06 -8.52092253e-06] [-1.16529942e-05 3.21856072e-06 -3.51688878e-06] [ 8.12160120e-06 -9.39088661e-06 1.04471119e-06] [-4.55997248e-06 -5.53412707e-06 4.81912259e-06] [-6.86891735e-06 -2.00267628e-07 -3.33664548e-06] [ 1.58557814e-06 -1.21732594e-05 1.07442751e-05] [ 4.59518893e-07 -4.84932472e-07 5.05763319e-07] [-7.70118897e-06 3.07444805e-06 8.50539758e-07] [-1.15231151e-06 -1.70101042e-06 2.37219738e-07] [-1.01846333e-05 -5.20525679e-06 -9.63866982e-06] [-9.82014143e-06 -4.67854180e-06 -5.32551798e-06] [ 5.03201820e-06 -6.02035691e-06 3.61570948e-07] [-1.94204447e-06 5.60254072e-06 9.85650519e-07] [-9.49508905e-06 -3.26496166e-06 3.27019310e-06] [ 9.55755803e-06 1.56917789e-06 -1.52184593e-06] [-9.86244246e-06 3.20709387e-06 9.09277513e-07] [ 2.57810014e-06 8.29822673e-06 -5.49259245e-07] [ 6.17660594e-06 1.58326431e-06 -2.61239773e-06] [-2.38275299e-06 -1.85268381e-06 8.68122911e-07] [-1.74270417e-06 -8.28280794e-06 3.26040646e-06] [-2.67434089e-06 2.16778772e-06 -2.22513304e-06] [ 5.07649840e-06 -1.62227816e-06 1.34154473e-05] [-7.78513094e-07 8.57432314e-06 -5.65921723e-06] [ 5.85312925e-06 -6.43405730e-06 -1.66898093e-06] [ 8.68162720e-07 -3.37984026e-06 4.44095280e-06] [ 3.84764820e-06 -4.45030889e-06 -4.10391134e-06] [-2.03728222e-05 3.26386492e-06 2.32264210e-06] [ 9.00985456e-06 1.41944706e-05 -1.60754241e-06] [-7.48833574e-07 -2.78257441e-06 -6.51882535e-06] [-1.18990508e-06 1.05312233e-05 -1.24861499e-05] [ 1.06823047e-07 6.13234286e-07 2.72965429e-06] [-1.43820849e-06 3.09700561e-06 -4.67504569e-06] [ 1.21255296e-06 -1.27403568e-06 6.95583894e-07] [-1.41995114e-06 5.83857618e-06 -3.76400317e-06] [ 1.68540130e-05 -1.50955970e-05 -6.66052118e-06] [-5.60813712e-06 -4.31801441e-06 6.48248100e-07] [-8.06511617e-06 1.28195652e-05 7.53648127e-06] [ 9.21379093e-06 -3.86320022e-06 1.25814230e-06] [ 6.58534917e-06 -1.11619416e-05 6.34460204e-06] [-1.18728109e-05 -4.24320134e-06 -9.23405445e-06] [-8.56666493e-06 1.60211670e-06 -8.07430222e-06] [ 1.29344320e-05 -3.61716211e-06 -2.18338000e-06] [-1.62624317e-06 4.25993716e-06 -8.91831614e-06] [-9.95697841e-06 1.19868958e-05 1.18890147e-05] [ 6.50535523e-06 -6.50014915e-06 -6.87013048e-06] [-1.92740179e-06 -3.75121538e-06 -1.55327450e-06] [-1.04562593e-05 -7.08077543e-06 3.35439789e-06] [ 5.79895394e-06 -1.39530358e-06 -1.30304219e-05] [-1.40586679e-05 -9.83569089e-07 -2.78667033e-06] [ 7.76159301e-07 -8.08580799e-07 -5.79009506e-06] [ 3.96867446e-06 6.93067808e-06 -4.41775412e-06] [-1.81931422e-06 -5.44431620e-06 -7.28041017e-07] [ 7.42304768e-06 -2.92751966e-06 4.89822098e-06] [-6.66590285e-06 5.93777682e-06 -1.29027428e-06] [ 8.37712951e-06 4.48848086e-06 -4.46294543e-06] [-6.48117825e-06 -9.15875865e-06 -1.44436897e-06] [ 3.18060440e-06 2.22570020e-05 1.06819303e-05] [ 7.38277066e-06 4.04089118e-06 -4.36042393e-06] [-3.38298732e-06 4.69762210e-06 -3.63803685e-06] [ 9.20916129e-06 6.83832505e-06 -8.00300865e-06] [-3.47500116e-06 -1.07878896e-05 1.23701109e-05] [ 1.92650659e-07 1.32508164e-06 5.29149157e-06] [ 1.16947470e-05 1.35653181e-06 4.34244695e-06] [ 1.17207669e-06 -3.15784160e-06 -5.91264658e-06] [-4.47860658e-06 9.96258157e-06 -3.30507579e-06] [-1.38881393e-06 5.39882423e-06 3.11566286e-06]] Final stress: [-3.40273011e-03 9.70065261e-04 1.68485169e-03 -4.98271805e-03 -3.31395016e-06 3.27092731e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-3.71648671e-07 -1.13815271e-07 -1.54887602e-06] [ 7.30623659e-06 -8.08673249e-06 4.45540954e-07] [-1.10090251e-06 -2.19594344e-06 -1.29854010e-06] [-4.37361926e-07 3.09748501e-06 -1.16687233e-06] [-3.97066058e-06 5.79106764e-07 5.66507874e-06] [-3.05781684e-06 -1.77960968e-06 -5.85606634e-06] [-8.24707186e-07 -8.65308317e-06 5.05308394e-06] [ 5.71657671e-06 -8.80605757e-06 -8.54547355e-06] [ 1.09255336e-06 2.68505083e-07 3.61624974e-06] [ 8.04235650e-07 -9.79450494e-06 2.16712860e-06] [-2.06892837e-06 4.91252392e-06 3.79490506e-06] [ 2.08264160e-06 -2.20373900e-06 1.57631974e-06] [-1.62771716e-07 3.15854629e-06 -4.06196504e-06] [ 7.06635420e-06 -2.57354488e-08 1.66929010e-06] [-3.57227879e-06 -7.51729618e-06 -1.00620772e-06] [-1.70257924e-06 3.52396460e-06 -2.85520697e-06] [-3.53638009e-06 4.29591407e-06 5.71776103e-06] [ 3.59308048e-07 2.28485353e-06 3.49031601e-06] [ 5.38689712e-07 6.28881782e-06 -3.19498763e-06] [-2.12592381e-07 2.55166982e-06 1.42702321e-06] [-4.73736631e-06 1.95187205e-06 -4.34251062e-06] [-1.06990465e-06 7.88204952e-06 -1.32178542e-06] [-1.26693259e-06 -3.13119422e-06 -4.17593069e-06] [ 4.82128843e-06 7.00078399e-06 3.13765362e-06] [ 7.00273384e-07 -4.56177960e-06 -4.60405645e-07] [ 9.06728936e-06 -8.90599297e-07 -1.72171740e-07] [ 1.72274854e-06 4.35907151e-06 2.00192106e-06] [-1.66830265e-06 -1.84406586e-06 -2.21610131e-06] [ 2.23528226e-06 -3.15215817e-06 5.84848895e-06] [-3.66429251e-06 -9.93830185e-07 -2.04163796e-06] [ 2.65306922e-06 1.38983817e-06 5.70935821e-06] [ 1.79290957e-06 -2.47934901e-06 3.57753037e-06] [ 4.61140390e-06 2.17652178e-06 7.22289534e-06] [-3.54419167e-07 -2.63450819e-06 -2.07881965e-06] [-7.93425591e-06 -1.09043792e-06 4.00696584e-08] [-8.90378807e-06 -2.63265634e-06 5.75967055e-06] [ 2.07332974e-06 1.40269081e-06 -1.96795830e-06] [ 2.56963200e-06 1.57933897e-06 -1.32276389e-06] [ 7.16010129e-06 2.20750009e-06 -2.20703934e-07] [-7.40047261e-06 2.04653619e-06 3.92335136e-06] [ 1.04585687e-06 5.34095300e-06 1.26717391e-06] [-3.77198612e-06 -7.10488959e-06 -5.04690010e-06] [ 2.64049127e-06 -2.70207704e-06 -2.78504978e-06] [ 1.50464335e-06 -1.60659977e-06 -5.85236949e-06] [ 8.31803182e-07 1.53949973e-06 2.84659417e-07] [-5.72679682e-06 3.70150930e-07 2.36941554e-06] [ 6.20793305e-06 4.33791187e-06 -2.70357792e-06] [ 3.00566579e-06 -4.75172817e-06 -1.28607076e-06] [ 2.84500205e-06 3.39063813e-07 2.37698037e-06] [ 3.20422629e-06 8.09750990e-08 7.95530435e-06] [-8.65284683e-06 3.29810958e-08 -2.20175303e-06] [ 2.97269647e-06 7.23898925e-06 -8.47972454e-06] [-6.06920198e-06 3.60390272e-06 -4.91074775e-07] [ 2.68529366e-06 -7.09044874e-06 1.78604115e-06] [-2.60539042e-06 -6.24943925e-06 -9.43130256e-06] [-1.48941235e-06 -4.05821540e-06 -2.84418054e-06] [ 1.10711474e-06 -7.13926597e-06 4.39949888e-07] [ 2.11775165e-06 -5.92204055e-07 -5.19841629e-07] [-2.29919725e-06 -4.22343833e-07 -2.98311804e-06] [ 1.43637195e-06 1.99274810e-07 -1.66900789e-06] [ 1.27904692e-06 4.44060760e-07 -4.64356212e-07] [-7.81983594e-06 -1.62616011e-06 -5.12916866e-06] [ 2.89876901e-06 -3.18087498e-06 9.64489134e-06] [ 4.15302879e-06 5.58223561e-07 6.50038669e-06] [ 3.78482079e-06 -5.45420211e-06 5.31725784e-06] [-3.62776622e-06 8.92015802e-06 -2.62063488e-06] [-3.97432113e-06 -5.21654640e-06 3.03056063e-06] [ 8.43061483e-07 1.63828204e-06 -3.47296863e-06] [-2.17659613e-06 -2.68609756e-06 -3.84729516e-06] [ 2.12112892e-06 -6.61591021e-06 9.76399560e-07] [ 6.38228740e-06 -4.90693439e-06 1.56592922e-07] [ 1.73934431e-06 2.07227418e-06 5.26128396e-06] [ 5.54050383e-06 5.53658260e-06 4.23926042e-06] [ 3.11305958e-06 -1.89319581e-06 6.05547650e-06] [-1.85739549e-06 -2.40853180e-06 -3.32984148e-06] [ 7.89879447e-06 6.82486782e-06 2.59012170e-06] [ 2.88343137e-06 1.34452038e-06 -5.08707670e-07] [ 3.23250295e-06 -5.35616581e-06 3.70289794e-06] [-1.43640423e-06 2.24181969e-06 -5.41871518e-06] [ 2.93170072e-07 -3.08817193e-06 -9.29711451e-07] [-7.55851271e-06 4.80539124e-06 -1.13985370e-06] [ 3.38868896e-06 -3.43319031e-06 1.55631431e-06] [-4.41021390e-06 -8.73305583e-08 -3.16999497e-06] [-2.14454508e-06 2.92445399e-06 4.45920254e-06] [ 3.09901754e-06 4.30547340e-06 -1.27479329e-06] [-2.46079483e-06 3.53270561e-06 5.85308950e-06] [ 2.20974882e-06 3.89233028e-06 1.21127853e-06] [-1.18905209e-05 2.10593737e-06 -4.90355767e-06] [-1.95305494e-06 -2.04989812e-07 -3.56517180e-06] [ 6.29743442e-06 4.43728403e-06 -5.04523161e-06] [ 3.16750819e-06 -1.25598856e-07 2.46236933e-06] [-2.58104645e-06 3.08533096e-07 1.85898840e-06] [-8.48223544e-06 -2.32290165e-06 2.48747912e-06] [-1.73722087e-06 -3.06759862e-06 5.77177948e-06] [ 5.44846211e-06 2.77672464e-06 -3.31401893e-06] [-1.11191526e-05 6.28775032e-06 -1.55896436e-06] [-9.17288152e-07 7.93221822e-07 -8.41962789e-06] [ 3.72964657e-06 8.19920550e-06 -3.20207260e-06] [-4.53746985e-06 1.00816953e-06 -4.24597475e-06] [-7.96770081e-07 3.52848414e-06 5.81200119e-06] [ 1.09499563e-06 1.64991097e-06 -5.47949312e-06] [-4.62886579e-07 -1.98948591e-07 -8.16828579e-08]] Final stress: [-3.40264248e-03 9.69944933e-04 1.68494800e-03 -4.98269366e-03 3.34197794e-06 -3.27088782e-03] Minimization converged after 90 steps. Minimization converged after 91 steps. Minimization converged after 168 steps. Minimization converged after 168 steps. Minimization converged after 167 steps. Minimization converged after 167 steps. Minimization converged after 102 steps. Minimization converged after 103 steps. Minimization converged after 50 steps. Minimization converged after 65 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 63 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 58 steps. Minimization converged after 69 steps. Minimization converged after 70 steps. Minimization converged after 70 steps. Minimization converged after 69 steps. Minimization converged after 96 steps. Minimization converged after 95 steps. Minimization converged after 72 steps. Minimization converged after 75 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 125 steps. Minimization converged after 124 steps. Minimization converged after 67 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 67 steps. Minimization converged after 57 steps. Minimization converged after 49 steps. Minimization converged after 85 steps. Minimization converged after 84 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 83 steps. Minimization converged after 76 steps. Minimization converged after 91 steps. Minimization converged after 89 steps. Minimization converged after 105 steps. Minimization converged after 105 steps. Minimization converged after 122 steps. Minimization converged after 121 steps. Minimization converged after 58 steps. Minimization converged after 71 steps. Minimization converged after 74 steps. Minimization converged after 73 steps. Minimization converged after 75 steps. Minimization converged after 75 steps. Minimization converged after 78 steps. Minimization converged after 78 steps. Minimization converged after 94 steps. Minimization converged after 92 steps. Minimization converged after 119 steps. Minimization converged after 117 steps. Minimization converged after 114 steps. Minimization converged after 114 steps. Minimization converged after 77 steps. Minimization converged after 78 steps. Minimization converged after 166 steps. Minimization converged after 167 steps. Minimization converged after 165 steps. Minimization converged after 167 steps. Minimization converged after 134 steps. Minimization converged after 135 steps. Minimization converged after 135 steps. Minimization converged after 136 steps. Minimization converged after 78 steps. Minimization converged after 81 steps. Minimization converged after 160 steps. Minimization converged after 155 steps. Minimization converged after 160 steps. Minimization converged after 159 steps. Minimization converged after 97 steps. Minimization converged after 98 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 44 steps. Minimization converged after 54 steps. Minimization converged after 52 steps. Minimization converged after 46 steps. Minimization converged after 51 steps. Minimization converged after 48 steps. Minimization converged after 48 steps. Minimization converged after 51 steps. Minimization converged after 69 steps. Minimization converged after 68 steps. Minimization converged after 70 steps. Minimization converged after 72 steps. Minimization converged after 84 steps. Minimization converged after 85 steps. Minimization converged after 63 steps. Minimization converged after 65 steps. Minimization converged after 114 steps. Minimization converged after 113 steps. Minimization converged after 119 steps. Minimization converged after 121 steps. Minimization converged after 58 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 47 steps. Minimization converged after 70 steps. Minimization converged after 69 steps. Minimization converged after 67 steps. Minimization converged after 66 steps. Minimization converged after 65 steps. Minimization converged after 64 steps. Minimization converged after 80 steps. Minimization converged after 81 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 118 steps. Minimization converged after 119 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 64 steps. Minimization converged after 67 steps. Minimization converged after 66 steps. Minimization converged after 65 steps. Minimization converged after 82 steps. Minimization converged after 78 steps. Minimization converged after 116 steps. Minimization converged after 110 steps. Minimization converged after 117 steps. Minimization converged after 117 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 173 steps. Minimization converged after 173 steps. Minimization converged after 174 steps. Minimization converged after 175 steps. Minimization converged after 144 steps. Minimization converged after 145 steps. Minimization converged after 144 steps. Minimization converged after 145 steps. Minimization converged after 72 steps. Minimization converged after 71 steps. Minimization converged after 154 steps. Minimization converged after 153 steps. Minimization converged after 155 steps. Minimization converged after 153 steps. Minimization converged after 117 steps. Minimization converged after 120 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 33 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 42 steps. Minimization converged after 49 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 51 steps. Minimization converged after 68 steps. Minimization converged after 68 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 79 steps. Minimization converged after 78 steps. Minimization converged after 62 steps. Minimization converged after 60 steps. Minimization converged after 110 steps. Minimization converged after 110 steps. Minimization converged after 117 steps. Minimization converged after 117 steps. Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 48 steps. Minimization converged after 50 steps. Minimization converged after 55 steps. Minimization converged after 53 steps. Minimization converged after 66 steps. Minimization converged after 67 steps. Minimization converged after 61 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 62 steps. Minimization converged after 78 steps. Minimization converged after 73 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 109 steps. Minimization converged after 113 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 65 steps. Minimization converged after 68 steps. Minimization converged after 71 steps. Minimization converged after 75 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 116 steps. Minimization converged after 114 steps. Minimization converged after 63 steps. Minimization converged after 64 steps. Minimization converged after 170 steps. Minimization converged after 169 steps. Minimization converged after 169 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 4.86042958e-03 2.57655720e-03 -9.51921648e-03] [-9.37860443e-03 4.53399905e-03 7.64545923e-03] [ 3.35436086e-04 4.29017555e-03 2.46090955e-03] [ 2.44556279e-03 -2.98183443e-03 -5.00550989e-03] [-5.87016727e-03 1.59128052e-03 1.99017273e-03] [-3.23925125e-03 7.38793941e-03 -2.83094982e-03] [ 4.81522203e-03 1.53435228e-03 -1.39143086e-03] [ 3.14279188e-03 -6.78192562e-04 5.10653202e-03] [ 3.95225321e-03 3.54984700e-03 -2.17599267e-03] [ 9.32874218e-04 2.47656615e-03 5.29437775e-03] [-1.99012873e-03 2.59666156e-03 -2.08792669e-03] [ 5.11583321e-04 -9.28581827e-05 3.59632615e-03] [-1.45037310e-03 4.05459429e-03 5.17887294e-03] [ 2.17231954e-03 4.34438460e-03 1.46313237e-03] [ 1.06397545e-02 3.57336369e-04 7.20546195e-03] [-6.47753923e-04 9.57428506e-03 -3.61793298e-03] [-4.06735475e-03 -6.10854223e-03 -1.16598841e-02] [-3.97070758e-03 1.51428714e-03 5.79446695e-03] [ 4.99279605e-03 -8.20404437e-03 4.70664145e-04] [-3.31624370e-04 -7.55408640e-03 -5.02927123e-03] [ 3.46586226e-03 -6.81244437e-03 -5.07902609e-03] [ 4.82034744e-03 -3.03364029e-03 2.35556206e-03] [-4.22045770e-03 2.59878959e-03 -4.20824457e-03] [-7.00519864e-03 2.31957001e-04 6.00151464e-03] [-8.75303106e-04 -1.54126709e-02 3.51966989e-03] [-4.13122770e-03 -5.99775508e-03 -1.29643644e-03] [ 3.67748508e-03 3.74913757e-03 -1.22633094e-02] [ 2.25977314e-03 -1.84108646e-03 4.11422293e-03] [ 8.14476119e-04 3.35468033e-03 -2.61076226e-03] [ 5.15902566e-03 -3.42568549e-03 5.28876047e-03] [-1.54378830e-03 4.13003633e-04 5.92541508e-03] [ 1.53904824e-03 5.81779249e-03 -5.76902060e-03] [-2.62254127e-04 -9.04893555e-03 1.92007880e-03] [ 2.50951942e-03 -7.93899889e-03 9.18376818e-04] [-1.34466572e-02 2.81384354e-03 -5.02802189e-03] [ 1.11899874e-02 6.65799048e-03 5.57236052e-03] [-1.79149497e-02 3.63414082e-03 -4.46821215e-03] [-7.59023233e-03 2.10220211e-03 3.56315657e-03] [ 1.27567030e-03 4.18855311e-03 9.60764075e-04] [ 1.03297464e-02 -3.49037632e-03 -3.72050400e-03] [ 7.82614328e-03 -2.45054942e-03 8.00128384e-03] [ 6.12747237e-04 -3.56678309e-03 1.26283282e-03] [-1.14931458e-02 -9.31519075e-04 -3.44687860e-03] [ 5.94914649e-03 -2.30708646e-03 7.94671220e-03] [ 7.67506859e-03 -3.74940772e-03 7.86045950e-04] [ 8.53705470e-04 -1.37020362e-02 5.37166058e-03] [ 2.44256042e-03 2.67533211e-03 -5.41079576e-05] [ 4.69096742e-03 7.24572672e-03 1.36610639e-03] [-3.73687026e-03 -1.25869194e-02 5.05554573e-05] [-6.56295197e-03 -5.02512939e-03 -2.88323660e-03] [-9.59412635e-03 1.12317289e-02 -2.21259571e-03] [ 7.63905249e-03 1.01592728e-02 5.51081694e-03] [-9.04446665e-04 5.03772428e-03 -6.28212400e-03] [ 1.76586621e-03 3.97179556e-03 1.78617597e-03] [-6.44096558e-03 3.38380926e-03 6.57181464e-03] [ 8.89070236e-03 1.48669710e-02 -6.63434839e-03] [-1.04281767e-03 -4.55640113e-03 -1.14787092e-03] [-9.19422851e-04 -3.89270462e-03 -6.58801802e-03] [-5.94492733e-03 2.69470626e-03 -1.80491636e-03] [-2.85712471e-03 -4.30260952e-03 -6.48613830e-03] [-1.22716953e-02 -1.18070634e-02 -6.79294178e-03] [-8.63276140e-03 9.27040221e-04 1.33997366e-03] [ 3.64582189e-03 -9.94054455e-03 4.24802518e-03] [ 5.71811775e-03 3.62499038e-04 -7.18949020e-03] [-2.49627658e-04 1.26441262e-03 -3.58031856e-03] [-1.23657263e-03 4.43697131e-04 6.61705098e-03] [-5.01364048e-03 1.15156080e-03 -8.56439571e-04] [-5.62661547e-04 2.57034560e-03 -2.91749692e-04] [-2.37792376e-03 -3.13510605e-03 4.13615271e-03] [-2.85434330e-03 -8.21033455e-03 -4.65585284e-03] [ 7.13611944e-03 9.17266937e-03 -3.75462404e-03] [ 3.10771962e-03 6.21546191e-03 -6.09053434e-03] [ 4.13578997e-03 9.26779732e-03 4.49141530e-03] [ 1.86005100e-02 2.60660813e-02 -7.77766498e-04] [-8.11446305e-03 3.08440474e-03 1.77558520e-03] [-9.24369226e-03 1.14614796e-02 9.03350748e-03] [-4.40995929e-03 -3.45528836e-03 -2.61733373e-03] [-4.48971340e-03 -8.27031237e-04 -3.63587529e-03] [ 2.04950113e-03 2.63367466e-03 1.58168870e-02] [ 1.25348752e-02 6.01507759e-03 -4.71438754e-03] [ 1.09230692e-03 -1.71662768e-03 -1.38378291e-03] [-4.74959549e-03 -5.43400958e-03 1.87378492e-03] [-1.15185712e-03 -6.26796025e-03 -1.75392706e-03] [ 2.90418280e-03 -5.53281781e-03 -2.12317963e-03] [ 8.51815528e-04 -1.42937468e-03 -1.23956422e-02] [ 1.87553950e-03 -5.69567302e-03 4.36006152e-04] [-9.34329607e-03 2.37387740e-03 -2.52993456e-03] [-8.16569735e-04 5.49790056e-03 3.61673404e-04] [-7.08479185e-03 -5.56541759e-03 -4.13025295e-03] [-1.02072044e-03 -2.96091208e-03 7.73025705e-04] [ 6.87081595e-03 3.86790345e-03 6.29593730e-03] [ 5.98395426e-03 4.71718816e-03 -1.77562126e-03] [ 7.26164317e-03 7.02469661e-03 4.87922045e-03] [-1.96967519e-03 -3.55510975e-03 -1.25300207e-03] [ 1.85295328e-03 5.60509417e-04 -1.06672411e-03] [-2.96359010e-03 3.83316390e-03 2.59055133e-03] [-3.86565282e-03 -1.71133722e-02 -3.21454729e-03] [ 6.97741219e-03 -6.89643338e-03 8.91957879e-04] [-8.70104837e-04 -7.17764343e-03 1.42667515e-03] [-9.57170715e-04 -3.15606712e-03 -2.73289421e-04] [ 6.76266589e-04 8.46303321e-05 3.59036358e-03] [ 4.21964201e-03 -6.23841123e-03 6.58104865e-03]] Final stress: [-2.10807744e-04 5.11009909e-05 5.94650335e-05 -1.26674681e-03 -9.25814311e-04 -1.33877082e-04] Minimization converged after 140 steps. Minimization converged after 142 steps. Minimization converged after 143 steps. Minimization converged after 148 steps. Minimization converged after 63 steps. Minimization converged after 66 steps. Minimization converged after 152 steps. Minimization converged after 152 steps. Minimization converged after 155 steps. Minimization converged after 153 steps. Minimization converged after 106 steps. Minimization converged after 113 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 35 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 35 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 113 steps. Minimization converged after 113 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 110 steps. Minimization converged after 110 steps. Minimization converged after 113 steps. Minimization converged after 113 steps. Minimization converged after 46 steps. Minimization converged after 50 steps. Minimization converged after 54 steps. Minimization converged after 55 steps. Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 68 steps. Minimization converged after 66 steps. Minimization converged after 115 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 116 steps. Minimization converged after 56 steps. Minimization converged after 57 steps. Minimization converged after 171 steps. Minimization converged after 171 steps. Minimization converged after 169 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 5.13055402e-03 7.69038426e-04 3.34740397e-03] [ 1.38715433e-03 -5.33499150e-03 -2.32538530e-03] [-3.54368822e-03 3.49806060e-03 -6.41155930e-03] [-1.55877545e-03 3.01251209e-03 5.56425121e-03] [ 2.56943892e-03 -2.47864494e-03 -4.58981751e-03] [ 4.04197310e-03 -1.31213886e-03 5.32042168e-03] [ 4.81134280e-03 2.02534095e-03 -1.02005838e-02] [ 1.02431479e-03 -5.74965780e-03 2.60804217e-03] [-9.07014071e-04 -3.12689838e-04 -2.19218502e-03] [ 2.10463864e-03 -2.78223671e-03 4.79020727e-03] [-6.21842135e-03 4.98052818e-04 -9.79328764e-04] [-2.25529386e-03 -9.95220968e-04 -1.37080776e-03] [-3.16868514e-03 -6.61226096e-05 -3.30681935e-03] [-3.83133404e-03 -2.64953112e-03 9.07629655e-04] [ 2.20880759e-03 -2.08353375e-04 1.53738910e-03] [-2.24197882e-03 -1.81890029e-03 5.05175969e-03] [-1.47190125e-04 -5.10251925e-03 -4.80803363e-03] [ 5.49016849e-04 -2.54485038e-03 -1.39774081e-04] [ 8.30332621e-04 4.80253263e-03 -1.02802940e-03] [ 1.97581028e-03 6.97843637e-03 2.70761272e-03] [ 4.91385748e-03 -6.73520409e-04 6.22841423e-04] [ 2.83976168e-03 3.89772651e-03 -5.95783562e-03] [-4.81185580e-03 -7.66746060e-03 -5.08568671e-03] [-6.80417206e-03 1.77254950e-03 2.80389236e-03] [ 3.31314834e-03 -8.28641956e-03 5.72779070e-03] [-1.92877129e-03 3.10059681e-03 2.12260638e-03] [ 2.76590786e-03 2.04241925e-03 5.20405589e-05] [-1.12662881e-03 1.11803718e-03 -5.74893397e-03] [ 6.24440155e-03 1.72524981e-03 -1.07621896e-03] [ 6.98959362e-03 -2.21551208e-03 1.16607178e-03] [ 2.05256975e-04 5.09083703e-04 3.34609841e-04] [ 1.21029946e-03 4.35524617e-03 -1.16993547e-03] [ 1.48702407e-04 4.14831392e-03 -1.47531737e-03] [-3.19844886e-05 6.89094886e-03 3.18103721e-03] [-2.93206283e-03 -3.54956369e-04 -5.78098449e-03] [ 7.14000810e-03 4.86569374e-03 3.78688431e-03] [-1.15300541e-02 4.64118558e-03 -5.24100448e-03] [-6.47226713e-03 3.77996147e-03 4.34344370e-03] [-5.07115041e-04 8.22481317e-03 4.35649312e-03] [ 2.47589814e-03 6.38005666e-03 -3.93713105e-03] [ 2.91468825e-03 1.05974040e-03 -1.65626528e-03] [-2.85941937e-03 -1.78574200e-03 5.65152156e-03] [-4.49753529e-03 -1.19791058e-03 -3.79266420e-03] [ 2.14287288e-03 -2.72089515e-03 7.45074956e-03] [-1.53927585e-03 6.78863980e-04 1.65149088e-03] [-7.50488245e-03 -2.68118047e-03 1.22887380e-04] [-2.70807941e-03 -5.99551047e-03 4.05753734e-03] [-3.55962767e-03 -6.23985007e-03 -2.50011051e-03] [ 5.52578802e-03 1.28851400e-03 2.62562210e-04] [-6.45999993e-04 -1.39997219e-04 -1.26876646e-03] [-6.95593309e-03 9.37992782e-04 -8.96681552e-04] [ 4.75206802e-03 -1.56668891e-03 4.45796751e-03] [ 1.58560608e-03 -6.81051193e-03 1.67181516e-03] [ 3.38362600e-04 -6.73288833e-03 -2.43649401e-03] [-2.64430698e-03 -5.52868042e-03 -4.81077271e-03] [ 3.54962119e-03 -1.80760826e-04 6.23445640e-03] [-1.99749876e-03 -6.97406164e-03 2.03700063e-03] [ 6.07275285e-04 2.87532495e-03 -1.48939912e-03] [-8.35535606e-03 -1.26835075e-05 -1.98152026e-03] [-6.12763758e-03 6.81488328e-04 -1.14109916e-03] [ 4.98940702e-03 -1.33454588e-03 -5.16035586e-03] [ 1.41324642e-03 2.02281279e-03 3.96754252e-03] [-4.05031531e-03 4.18255417e-03 -7.37707953e-03] [-6.54018163e-03 5.13434816e-03 4.34552406e-03] [-3.15010114e-03 -8.58228136e-03 1.81156124e-03] [-2.79294433e-03 -5.55594188e-03 -3.66550675e-03] [ 1.64992018e-03 -2.80324637e-03 2.38011001e-03] [ 4.76959572e-04 -4.03757329e-03 -1.97515928e-03] [ 2.47418450e-03 3.41056117e-03 -3.87540510e-03] [-9.08039332e-04 1.17085117e-03 8.79284335e-03] [ 7.34548104e-04 1.14808248e-03 -1.00822340e-02] [ 7.38338556e-03 -2.44132733e-03 6.32025080e-03] [-2.56170424e-03 1.95290762e-03 4.98376381e-03] [ 3.99813133e-04 2.57559592e-03 -1.90218680e-03] [ 8.86294818e-03 -2.99500452e-03 -7.22888597e-03] [ 6.76647022e-03 -4.10929547e-04 6.65106178e-03] [ 6.25470497e-03 -1.08445479e-04 -4.23885184e-03] [ 4.03965847e-03 1.17476993e-03 -1.36168344e-03] [-3.48146250e-03 5.03566394e-06 -3.62783402e-03] [ 1.56629957e-03 -3.80706459e-03 4.16629078e-03] [ 2.39180636e-05 1.06879353e-03 -2.91391425e-04] [ 2.11818654e-03 -1.35578797e-03 1.55044589e-03] [ 4.73258132e-03 9.58068720e-03 -2.88732390e-03] [ 2.13835720e-03 8.68057375e-03 -1.56789162e-04] [ 4.68047912e-04 6.35099998e-04 -1.60306455e-03] [ 2.28534984e-03 4.44927681e-03 3.41009018e-03] [ 3.33764091e-03 -5.58370139e-03 -8.34233498e-04] [ 6.34142459e-03 6.38623974e-03 -7.98388391e-04] [ 2.50724321e-04 -6.78322070e-03 -2.15377262e-03] [-6.76739700e-04 -3.99557632e-03 2.75195516e-03] [ 1.87924539e-03 -3.91388388e-03 4.84046251e-04] [ 1.11886543e-03 -4.87905992e-03 -5.04437128e-05] [ 1.66562909e-03 1.09247931e-02 2.10394601e-03] [-1.33198394e-04 -6.06351113e-03 -1.41564064e-04] [ 3.91146795e-03 1.82296244e-03 -3.95717862e-03] [-6.85248384e-04 2.47797530e-03 6.87234352e-03] [-2.06631992e-04 1.09394456e-03 6.80656097e-03] [ 2.79877228e-03 4.53454029e-03 -4.01022239e-03] [-8.65966618e-03 2.73901773e-03 3.92655329e-03] [-1.01258510e-02 2.84024018e-03 -1.61040125e-03] [-7.45256755e-03 -2.28934395e-03 7.65587518e-04] [-5.54076192e-03 -5.07910700e-04 -2.23179313e-03]] Final stress: [-1.07157981e-04 4.14860414e-05 1.80296221e-05 -7.97364959e-04 -5.74333347e-04 3.22769482e-05] Minimization converged after 134 steps. Minimization converged after 136 steps. Minimization converged after 138 steps. Minimization converged after 140 steps. Minimization converged after 62 steps. Minimization converged after 64 steps. Minimization converged after 147 steps. Minimization converged after 148 steps. Minimization converged after 146 steps. Minimization converged after 146 steps. Minimization converged after 108 steps. Minimization converged after 110 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 31 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 32 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 55 steps. Minimization converged after 56 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 115 steps. Minimization converged after 114 steps. Minimization converged after 116 steps. Minimization converged after 115 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 46 steps. Minimization converged after 43 steps. Minimization converged after 46 steps. Minimization converged after 59 steps. Minimization converged after 58 steps. Minimization converged after 59 steps. Minimization converged after 58 steps. Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 59 steps. Minimization converged after 58 steps. Minimization converged after 112 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 9.05487471e-03 3.29399605e-03 -2.58635237e-03] [-9.05487471e-03 -3.29399603e-03 -2.58635238e-03] [ 8.17773622e-03 8.02093891e-03 -2.80435411e-03] [-8.17773622e-03 -8.02093891e-03 -2.80435411e-03] [ 2.71335463e-03 -8.09519780e-03 -7.15606589e-03] [-2.71335463e-03 8.09519780e-03 -7.15606589e-03] [-1.34826529e-02 -1.18140615e-02 1.17117905e-04] [ 1.34826529e-02 1.18140615e-02 1.17117898e-04] [ 1.66566471e-03 7.85391401e-03 -5.19832542e-03] [-1.66566471e-03 -7.85391401e-03 -5.19832542e-03] [ 1.08042407e-03 2.30689252e-03 6.66805427e-03] [-1.08042407e-03 -2.30689252e-03 6.66805427e-03] [-1.05876742e-02 1.82333234e-03 -9.61819191e-03] [ 1.05876742e-02 -1.82333234e-03 -9.61819191e-03] [-1.67251543e-02 -1.58739632e-02 -1.04700745e-02] [ 1.67251543e-02 1.58739632e-02 -1.04700745e-02] [ 2.15496594e-03 1.10909037e-02 -1.27796372e-02] [-2.15496594e-03 -1.10909037e-02 -1.27796372e-02] [ 4.31827733e-03 -1.08651464e-03 5.82933071e-03] [-4.31827733e-03 1.08651464e-03 5.82933071e-03] [ 1.36012160e-02 -8.39380021e-03 -3.20016947e-04] [-1.36012160e-02 8.39380021e-03 -3.20016946e-04] [-1.03894514e-02 6.03126041e-03 6.61832741e-03] [ 1.03894514e-02 -6.03126037e-03 6.61832740e-03] [ 8.08325507e-04 -2.67961795e-03 4.00638974e-03] [-8.08325507e-04 2.67961794e-03 4.00638973e-03] [-3.48327095e-03 1.45966159e-02 1.59697097e-02] [ 3.48327095e-03 -1.45966159e-02 1.59697097e-02] [ 8.13266976e-03 6.82318775e-03 -7.39952038e-03] [-8.13266976e-03 -6.82318775e-03 -7.39952038e-03] [-6.44484603e-04 5.30790521e-03 3.55962695e-03] [ 6.44484603e-04 -5.30790521e-03 3.55962695e-03] [-1.10543458e-02 -9.70770653e-03 -1.81979552e-03] [ 1.10543458e-02 9.70770653e-03 -1.81979551e-03] [-1.82002420e-02 1.95795461e-03 1.77843866e-03] [ 1.82002420e-02 -1.95795461e-03 1.77843866e-03] [-1.97569805e-03 1.01834764e-02 3.95934008e-03] [ 1.97569805e-03 -1.01834764e-02 3.95934008e-03] [ 2.55588786e-03 2.65896557e-03 1.32522012e-02] [-2.55588786e-03 -2.65896557e-03 1.32522012e-02] [-1.83501663e-03 -5.51600027e-03 -8.18519900e-03] [ 1.83501663e-03 5.51600028e-03 -8.18519900e-03] [-6.18046024e-03 -7.49033666e-03 -1.95962182e-03] [ 6.18046024e-03 7.49033666e-03 -1.95962182e-03] [-2.66945617e-03 -5.28270797e-03 1.15450629e-02] [ 2.66945617e-03 5.28270797e-03 1.15450629e-02] [-2.65109005e-03 1.11382826e-02 8.91870880e-03] [ 2.65109005e-03 -1.11382826e-02 8.91870880e-03] [-1.42986775e-03 -1.56142215e-03 -1.10512609e-02] [ 1.42986776e-03 1.56142215e-03 -1.10512609e-02] [-7.92382079e-04 -6.69075236e-03 -4.47813560e-03] [ 7.92382079e-04 6.69075236e-03 -4.47813560e-03] [-8.90740194e-03 -3.18884906e-03 -1.41974161e-03] [ 8.90740194e-03 3.18884906e-03 -1.41974161e-03] [-2.33500771e-03 -7.10231377e-03 4.42667372e-03] [ 2.33500771e-03 7.10231377e-03 4.42667372e-03] [-5.18780959e-03 -3.98414752e-03 -2.23821168e-03] [ 5.18780959e-03 3.98414752e-03 -2.23821168e-03] [ 1.00967568e-02 8.51511744e-03 -5.78065299e-03] [-1.00967568e-02 -8.51511744e-03 -5.78065299e-03] [-7.22566714e-03 -5.62623252e-03 -5.74482448e-04] [ 7.22566714e-03 5.62623252e-03 -5.74482449e-04] [ 3.82154666e-03 -5.30764073e-04 6.89982154e-03] [-3.82154666e-03 5.30764077e-04 6.89982154e-03] [-5.17966688e-03 1.32368148e-02 -1.78124565e-02] [ 5.17966687e-03 -1.32368148e-02 -1.78124565e-02] [-1.16632595e-02 -4.13043874e-03 4.68806190e-03] [ 1.16632595e-02 4.13043874e-03 4.68806190e-03] [-4.59862988e-03 4.02002654e-03 -1.03488870e-02] [ 4.59862988e-03 -4.02002654e-03 -1.03488870e-02] [ 3.86278663e-03 1.31782221e-02 3.31284948e-03] [-3.86278663e-03 -1.31782221e-02 3.31284948e-03] [-1.70647010e-02 4.31117091e-03 5.60132153e-03] [ 1.70647010e-02 -4.31117091e-03 5.60132153e-03] [ 3.47482346e-03 -5.24620744e-03 4.65916775e-03] [-3.47482347e-03 5.24620744e-03 4.65916775e-03] [-1.04685448e-02 8.47226556e-03 1.38737388e-02] [ 1.04685448e-02 -8.47226556e-03 1.38737388e-02] [ 7.15089702e-03 -2.46215389e-03 5.35066260e-03] [-7.15089702e-03 2.46215390e-03 5.35066261e-03] [ 6.89358519e-03 -1.54820910e-02 4.38419922e-05] [-6.89358519e-03 1.54820910e-02 4.38419913e-05] [ 2.68320169e-04 -7.18417834e-03 -4.06373770e-03] [-2.68320170e-04 7.18417834e-03 -4.06373770e-03] [ 1.47422016e-03 1.05138420e-03 -2.75854915e-03] [-1.47422016e-03 -1.05138420e-03 -2.75854914e-03] [-2.29234220e-03 5.31551588e-04 -4.83688632e-03] [ 2.29234220e-03 -5.31551603e-04 -4.83688632e-03] [-3.68688953e-04 1.22501183e-02 -4.11293122e-03] [ 3.68688953e-04 -1.22501183e-02 -4.11293123e-03] [-1.28679511e-02 -3.58236051e-03 6.34623780e-03] [ 1.28679511e-02 3.58236051e-03 6.34623780e-03] [-4.43787609e-03 -3.31868984e-03 3.69271090e-03] [ 4.43787608e-03 3.31868981e-03 3.69271091e-03] [ 3.77185125e-04 -2.74762751e-03 -4.29942146e-03] [-3.77185125e-04 2.74762751e-03 -4.29942146e-03] [-4.16140663e-03 5.66950503e-03 8.23787264e-03] [ 4.16140663e-03 -5.66950503e-03 8.23787263e-03] [-1.11701786e-02 -4.89614074e-03 -2.75559693e-03] [ 1.11701786e-02 4.89614073e-03 -2.75559692e-03] [ 1.06067346e-02 -4.41930830e-03 -2.52716243e-03] [-1.06067346e-02 4.41930830e-03 -2.52716244e-03]] Final stress: [-6.21654333e-04 -7.38668688e-04 -2.86665626e-04 6.69902793e-16 -5.28744704e-16 -2.13376396e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-9.62671682e-03 4.52560998e-03 -2.82587324e-03] [ 9.62671682e-03 -4.52560993e-03 -2.82587325e-03] [-8.64461979e-03 7.99367267e-03 -3.14549482e-03] [ 8.64461979e-03 -7.99367268e-03 -3.14549482e-03] [-2.72628109e-03 -8.60745219e-03 -7.36592757e-03] [ 2.72628109e-03 8.60745219e-03 -7.36592757e-03] [ 1.42434259e-02 -1.23824117e-02 6.51182812e-04] [-1.42434259e-02 1.23824117e-02 6.51182799e-04] [-2.01010782e-03 8.52489455e-03 -5.49893490e-03] [ 2.01010782e-03 -8.52489455e-03 -5.49893490e-03] [-9.25404208e-04 2.48091340e-03 6.92071817e-03] [ 9.25404208e-04 -2.48091340e-03 6.92071817e-03] [ 1.10154847e-02 1.89649828e-03 -9.96001136e-03] [-1.10154847e-02 -1.89649828e-03 -9.96001136e-03] [ 1.77416090e-02 -1.74654339e-02 -1.03317052e-02] [-1.77416090e-02 1.74654339e-02 -1.03317052e-02] [-2.24242555e-03 1.14717872e-02 -1.33301291e-02] [ 2.24242555e-03 -1.14717872e-02 -1.33301291e-02] [-4.52195429e-03 -1.03217886e-03 6.02612254e-03] [ 4.52195429e-03 1.03217886e-03 6.02612254e-03] [-1.40655174e-02 -8.99517757e-03 -5.30555788e-04] [ 1.40655174e-02 8.99517757e-03 -5.30555787e-04] [ 1.08014186e-02 7.09282035e-03 7.35267714e-03] [-1.08014186e-02 -7.09282032e-03 7.35267713e-03] [-7.66216857e-04 -3.07739220e-03 4.27256164e-03] [ 7.66216857e-04 3.07739219e-03 4.27256163e-03] [ 3.17654133e-03 1.56035829e-02 1.62119439e-02] [-3.17654133e-03 -1.56035829e-02 1.62119439e-02] [-8.33965031e-03 7.36743358e-03 -7.56286428e-03] [ 8.33965031e-03 -7.36743357e-03 -7.56286428e-03] [ 8.32609316e-04 5.34307171e-03 3.57623412e-03] [-8.32609315e-04 -5.34307171e-03 3.57623412e-03] [ 1.15841072e-02 -1.01935784e-02 -2.21415329e-03] [-1.15841072e-02 1.01935784e-02 -2.21415329e-03] [-2.59428606e-03 -1.05128905e-02 4.30947542e-03] [ 2.59428606e-03 1.05128905e-02 4.30947542e-03] [-1.94482546e-02 -1.71944031e-03 1.63040950e-03] [ 1.94482546e-02 1.71944031e-03 1.63040950e-03] [-1.76548437e-03 6.22337014e-03 -8.87589302e-03] [ 1.76548437e-03 -6.22337014e-03 -8.87589301e-03] [ 2.64682368e-03 -3.06119649e-03 1.35001200e-02] [-2.64682368e-03 3.06119650e-03 1.35001200e-02] [-2.68643820e-03 5.38237771e-03 1.22666851e-02] [ 2.68643820e-03 -5.38237771e-03 1.22666851e-02] [-6.59249961e-03 7.97716204e-03 -1.66640093e-03] [ 6.59249961e-03 -7.97716204e-03 -1.66640093e-03] [-1.23803896e-03 1.91421954e-03 -1.17036896e-02] [ 1.23803896e-03 -1.91421953e-03 -1.17036896e-02] [-2.48378946e-03 -1.17763400e-02 1.01522352e-02] [ 2.48378946e-03 1.17763400e-02 1.01522353e-02] [-9.54558829e-03 3.35020673e-03 -1.29371244e-03] [ 9.54558829e-03 -3.35020673e-03 -1.29371244e-03] [-1.29594799e-03 7.14049261e-03 -4.68965115e-03] [ 1.29594799e-03 -7.14049261e-03 -4.68965115e-03] [-6.05888200e-03 4.17084355e-03 -2.41789074e-03] [ 6.05888200e-03 -4.17084355e-03 -2.41789074e-03] [-2.60008793e-03 7.37632300e-03 4.72514957e-03] [ 2.60008793e-03 -7.37632300e-03 4.72514957e-03] [-7.36661068e-03 6.00871743e-03 -6.67576666e-04] [ 7.36661068e-03 -6.00871743e-03 -6.67576665e-04] [ 1.06790818e-02 -8.83049418e-03 -6.12540746e-03] [-1.06790818e-02 8.83049417e-03 -6.12540746e-03] [-5.36005343e-03 -1.36431139e-02 -1.86976398e-02] [ 5.36005343e-03 1.36431140e-02 -1.86976398e-02] [ 4.13962729e-03 7.85021081e-04 7.02545586e-03] [-4.13962730e-03 -7.85021073e-04 7.02545586e-03] [-5.21011616e-03 -3.92437697e-03 -1.08105106e-02] [ 5.21011616e-03 3.92437697e-03 -1.08105106e-02] [-1.18608006e-02 4.53683650e-03 4.89499383e-03] [ 1.18608006e-02 -4.53683650e-03 4.89499383e-03] [-1.80547932e-02 -4.39025345e-03 5.83513276e-03] [ 1.80547932e-02 4.39025345e-03 5.83513276e-03] [ 3.76749018e-03 -1.36295518e-02 3.51285951e-03] [-3.76749018e-03 1.36295518e-02 3.51285950e-03] [-1.08716156e-02 -8.55096838e-03 1.45845174e-02] [ 1.08716156e-02 8.55096838e-03 1.45845174e-02] [ 3.30500688e-03 5.89110600e-03 4.72993979e-03] [-3.30500688e-03 -5.89110599e-03 4.72993979e-03] [-7.44211419e-03 -2.59745417e-03 5.83638531e-03] [ 7.44211419e-03 2.59745417e-03 5.83638531e-03] [-7.30668141e-03 -1.60077274e-02 4.22257389e-05] [ 7.30668141e-03 1.60077274e-02 4.22257365e-05] [-8.73895584e-05 -7.54046261e-03 -4.58624446e-03] [ 8.73895587e-05 7.54046261e-03 -4.58624446e-03] [-8.91207898e-04 1.28083340e-03 -3.31273347e-03] [ 8.91207897e-04 -1.28083339e-03 -3.31273346e-03] [ 2.91343292e-03 -2.27440777e-04 -5.30376272e-03] [-2.91343292e-03 2.27440740e-04 -5.30376272e-03] [ 4.02843896e-04 1.26019503e-02 -4.32425609e-03] [-4.02843896e-04 -1.26019503e-02 -4.32425609e-03] [ 1.30695227e-02 -3.42146034e-03 7.01058093e-03] [-1.30695227e-02 3.42146034e-03 7.01058092e-03] [ 4.40310230e-03 -4.48138135e-03 4.00481928e-03] [-4.40310230e-03 4.48138132e-03 4.00481928e-03] [-4.30993619e-03 -5.75683194e-03 8.37038296e-03] [ 4.30993619e-03 5.75683193e-03 8.37038297e-03] [ 4.15526583e-04 2.99421353e-03 -4.70031100e-03] [-4.15526585e-04 -2.99421354e-03 -4.70031101e-03] [ 1.11320360e-02 4.46463512e-03 -2.43552752e-03] [-1.11320360e-02 -4.46463513e-03 -2.43552751e-03] [-1.17210403e-02 5.34521998e-03 -3.06595122e-03] [ 1.17210403e-02 -5.34521999e-03 -3.06595123e-03]] Final stress: [-6.29386478e-04 -7.32851245e-04 -2.76922066e-04 -6.26837613e-16 -9.16331320e-16 2.29186187e-04] Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 52 steps. Minimization converged after 58 steps. Minimization converged after 61 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 114 steps. Minimization converged after 107 steps. Minimization converged after 114 steps. Minimization converged after 114 steps. Minimization converged after 54 steps. Minimization converged after 51 steps. Minimization converged after 181 steps. Minimization converged after 179 steps. Minimization converged after 181 steps. Minimization converged after 178 steps. Minimization converged after 134 steps. Minimization converged after 136 steps. Minimization converged after 137 steps. Minimization converged after 131 steps. Minimization converged after 60 steps. Minimization converged after 62 steps. Minimization converged after 147 steps. Minimization converged after 129 steps. Minimization converged after 145 steps. Minimization converged after 145 steps. Minimization converged after 109 steps. Minimization converged after 108 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 28 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 30 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. Minimization converged after 51 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 58 steps. Minimization converged after 61 steps. Minimization converged after 110 steps. Minimization converged after 112 steps. Minimization converged after 113 steps. Minimization converged after 112 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 47 steps. Minimization converged after 49 steps. Minimization converged after 44 steps. Minimization converged after 49 steps. Minimization converged after 53 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 56 steps. Minimization converged after 61 steps. Minimization converged after 59 steps. Minimization converged after 60 steps. Minimization converged after 114 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.55438461e-03 -2.06576036e-05 -1.75277627e-03] [-5.55438461e-03 2.06576227e-05 -1.75277627e-03] [ 6.01308741e-03 6.24886747e-03 -6.14971566e-04] [-6.01308741e-03 -6.24886748e-03 -6.14971561e-04] [ 2.82157159e-03 -4.71006200e-03 -5.21017495e-03] [-2.82157159e-03 4.71006200e-03 -5.21017495e-03] [-8.71386321e-03 -9.49596376e-03 1.28233298e-03] [ 8.71386321e-03 9.49596375e-03 1.28233297e-03] [ 1.02976655e-03 5.19938951e-03 -3.92597272e-03] [-1.02976655e-03 -5.19938951e-03 -3.92597272e-03] [ 1.08419691e-03 1.47722435e-03 5.11667375e-03] [-1.08419691e-03 -1.47722435e-03 5.11667375e-03] [-6.85148559e-03 1.00758436e-03 -6.11865017e-03] [ 6.85148559e-03 -1.00758436e-03 -6.11865016e-03] [-1.35083103e-02 -1.14721564e-02 -6.27007432e-03] [ 1.35083103e-02 1.14721564e-02 -6.27007432e-03] [ 1.21053888e-03 8.04799517e-03 -8.81072085e-03] [-1.21053888e-03 -8.04799517e-03 -8.81072084e-03] [ 2.84731446e-03 -2.09918741e-04 3.56676889e-03] [-2.84731447e-03 2.09918743e-04 3.56676889e-03] [ 9.55610611e-03 -6.21343693e-03 3.87977823e-04] [-9.55610611e-03 6.21343693e-03 3.87977824e-04] [-6.39818308e-03 3.19106546e-03 4.76871298e-03] [ 6.39818308e-03 -3.19106542e-03 4.76871297e-03] [ 1.86448181e-04 -7.35400221e-04 1.63992999e-03] [-1.86448181e-04 7.35400215e-04 1.63992998e-03] [-1.30448946e-03 1.08983993e-02 1.05970070e-02] [ 1.30448946e-03 -1.08983994e-02 1.05970070e-02] [ 6.24689456e-03 3.96261881e-03 -4.82270694e-03] [-6.24689456e-03 -3.96261881e-03 -4.82270694e-03] [-1.35856104e-04 3.85187432e-03 2.82739643e-03] [ 1.35856105e-04 -3.85187432e-03 2.82739643e-03] [-7.75122289e-03 -5.85259452e-03 -1.00565590e-03] [ 7.75122289e-03 5.85259452e-03 -1.00565590e-03] [-1.18686083e-02 2.57694443e-03 1.50465589e-03] [ 1.18686083e-02 -2.57694443e-03 1.50465589e-03] [-2.73653717e-04 6.88707375e-03 2.82827483e-03] [ 2.73653717e-04 -6.88707375e-03 2.82827483e-03] [ 1.73411504e-03 2.26325095e-03 8.92508973e-03] [-1.73411505e-03 -2.26325095e-03 8.92508974e-03] [-1.17365425e-03 -3.08229895e-03 -4.99102891e-03] [ 1.17365426e-03 3.08229896e-03 -4.99102891e-03] [-3.28229364e-03 -5.09952860e-03 -2.82042832e-03] [ 3.28229363e-03 5.09952860e-03 -2.82042832e-03] [-1.77876116e-03 -5.32598498e-03 7.48473881e-03] [ 1.77876116e-03 5.32598497e-03 7.48473881e-03] [-2.03567964e-03 6.75422302e-03 5.15152487e-03] [ 2.03567963e-03 -6.75422302e-03 5.15152487e-03] [-2.17694364e-03 -9.41143494e-04 -8.17984960e-03] [ 2.17694365e-03 9.41143502e-04 -8.17984960e-03] [-3.39696708e-04 -5.01655907e-03 -3.24438430e-03] [ 3.39696708e-04 5.01655906e-03 -3.24438430e-03] [-6.24296388e-03 -1.27583286e-03 -1.41831220e-03] [ 6.24296388e-03 1.27583286e-03 -1.41831220e-03] [-4.69445510e-04 -4.55638299e-03 3.08261053e-03] [ 4.69445511e-04 4.55638299e-03 3.08261052e-03] [-4.78454670e-03 -3.06603795e-03 -1.59137147e-03] [ 4.78454670e-03 3.06603795e-03 -1.59137147e-03] [ 7.22479535e-03 5.17178968e-03 -4.25678559e-03] [-7.22479535e-03 -5.17178968e-03 -4.25678559e-03] [-5.09765505e-03 -4.29533908e-03 1.44834643e-04] [ 5.09765504e-03 4.29533908e-03 1.44834642e-04] [ 2.33357590e-03 -4.94923659e-05 4.29387549e-03] [-2.33357590e-03 4.94923697e-05 4.29387549e-03] [-4.60797299e-03 1.06031878e-02 -1.10124725e-02] [ 4.60797298e-03 -1.06031878e-02 -1.10124725e-02] [-7.75203196e-03 -2.55297270e-03 3.69051038e-03] [ 7.75203196e-03 2.55297271e-03 3.69051038e-03] [-4.70859816e-03 2.91972972e-03 -7.26611074e-03] [ 4.70859816e-03 -2.91972972e-03 -7.26611074e-03] [ 1.80157307e-03 9.59738366e-03 2.30313059e-03] [-1.80157307e-03 -9.59738366e-03 2.30313059e-03] [-1.02390565e-02 4.20919998e-03 3.89192063e-03] [ 1.02390565e-02 -4.20919998e-03 3.89192062e-03] [ 1.90748934e-03 -3.75373923e-03 3.47566097e-03] [-1.90748934e-03 3.75373923e-03 3.47566097e-03] [-6.86577136e-03 6.03613797e-03 9.34190659e-03] [ 6.86577136e-03 -6.03613797e-03 9.34190659e-03] [ 5.96230628e-03 -1.77075110e-03 2.54110003e-03] [-5.96230628e-03 1.77075110e-03 2.54110003e-03] [ 4.91937405e-03 -1.13697323e-02 2.68899924e-04] [-4.91937405e-03 1.13697323e-02 2.68899922e-04] [ 7.45422516e-04 -4.80280292e-03 -3.02494754e-03] [-7.45422515e-04 4.80280292e-03 -3.02494754e-03] [ 1.24786907e-03 9.06411672e-04 -9.18387333e-04] [-1.24786907e-03 -9.06411674e-04 -9.18387333e-04] [-3.23190859e-03 5.25346818e-03 -2.67041067e-03] [ 3.23190859e-03 -5.25346820e-03 -2.67041066e-03] [-3.09396136e-04 9.43290689e-03 -2.88775528e-03] [ 3.09396136e-04 -9.43290689e-03 -2.88775529e-03] [-8.69911205e-03 -2.92747386e-03 4.33410061e-03] [ 8.69911204e-03 2.92747386e-03 4.33410061e-03] [-2.46199760e-03 -2.50618946e-03 2.02806987e-03] [ 2.46199760e-03 2.50618943e-03 2.02806987e-03] [-2.69414844e-04 -1.20402040e-03 -4.30088869e-03] [ 2.69414846e-04 1.20402040e-03 -4.30088868e-03] [-2.47798374e-03 4.81382640e-03 5.60001052e-03] [ 2.47798373e-03 -4.81382640e-03 5.60001051e-03] [-6.96819360e-03 -2.40820073e-03 -2.42651224e-03] [ 6.96819360e-03 2.40820073e-03 -2.42651223e-03] [ 6.82908343e-03 -2.89864775e-03 -1.53636565e-03] [-6.82908343e-03 2.89864774e-03 -1.53636566e-03]] Final stress: [-3.68423881e-04 -4.73086806e-04 -1.70840714e-04 -1.06548119e-15 1.34889201e-15 -1.32669505e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.68053499e-03 -6.29699110e-04 -1.42956322e-03] [ 4.68053499e-03 6.29699085e-04 -1.42956322e-03] [-5.20949325e-03 5.21069593e-03 -3.30306748e-04] [ 5.20949325e-03 -5.21069593e-03 -3.30306750e-04] [-2.39863878e-03 -3.90982811e-03 -4.38474098e-03] [ 2.39863878e-03 3.90982811e-03 -4.38474098e-03] [ 7.49939080e-03 -8.26649168e-03 1.22483032e-03] [-7.49939081e-03 8.26649168e-03 1.22483032e-03] [-8.39083912e-04 4.37625461e-03 -3.34772434e-03] [ 8.39083912e-04 -4.37625461e-03 -3.34772434e-03] [-1.10256239e-03 1.18554824e-03 4.40881275e-03] [ 1.10256239e-03 -1.18554824e-03 4.40881275e-03] [ 5.86611288e-03 9.67562636e-04 -5.17594597e-03] [-5.86611288e-03 -9.67562636e-04 -5.17594597e-03] [ 1.13641913e-02 -9.34521151e-03 -5.73391611e-03] [-1.13641913e-02 9.34521152e-03 -5.73391611e-03] [-9.55334348e-04 6.94156945e-03 -7.43249506e-03] [ 9.55334348e-04 -6.94156945e-03 -7.43249506e-03] [-2.38101509e-03 -3.46580224e-04 3.05755849e-03] [ 2.38101509e-03 3.46580222e-04 3.05755849e-03] [-8.28330574e-03 -5.21093821e-03 4.64187051e-04] [ 8.28330574e-03 5.21093821e-03 4.64187052e-04] [ 5.75314775e-03 2.91705452e-03 4.07351048e-03] [-5.75314775e-03 -2.91705452e-03 4.07351048e-03] [-2.46615255e-04 -8.12677192e-05 9.05087009e-04] [ 2.46615255e-04 8.12677149e-05 9.05087004e-04] [ 1.18734415e-03 8.96001046e-03 9.42319816e-03] [-1.18734415e-03 -8.96001046e-03 9.42319815e-03] [-5.35396023e-03 3.16977098e-03 -4.11519908e-03] [ 5.35396023e-03 -3.16977098e-03 -4.11519908e-03] [ 8.97278815e-05 3.48211240e-03 2.52192474e-03] [-8.97278818e-05 -3.48211240e-03 2.52192474e-03] [ 6.74894380e-03 -4.67562627e-03 -8.44504806e-04] [-6.74894380e-03 4.67562628e-03 -8.44504807e-04] [ 1.57526886e-04 -5.82375487e-03 2.42376364e-03] [-1.57526886e-04 5.82375487e-03 2.42376364e-03] [-9.51350692e-03 -2.21058590e-03 1.15833980e-03] [ 9.51350692e-03 2.21058590e-03 1.15833980e-03] [-8.90965985e-04 2.71517821e-03 -4.37033889e-03] [ 8.90965986e-04 -2.71517821e-03 -4.37033889e-03] [ 1.34703914e-03 -1.78659416e-03 7.64373763e-03] [-1.34703914e-03 1.78659416e-03 7.64373763e-03] [-1.43678556e-03 4.97764191e-03 6.13960428e-03] [ 1.43678556e-03 -4.97764191e-03 6.13960428e-03] [-2.66235584e-03 4.31334738e-03 -2.74721083e-03] [ 2.66235584e-03 -4.31334738e-03 -2.74721083e-03] [-1.89012731e-03 6.92722249e-04 -7.30942995e-03] [ 1.89012731e-03 -6.92722251e-04 -7.30942995e-03] [-1.78512192e-03 -5.77716343e-03 4.39565076e-03] [ 1.78512192e-03 5.77716342e-03 4.39565076e-03] [-5.02194025e-03 1.16619160e-03 -1.17707429e-03] [ 5.02194025e-03 -1.16619160e-03 -1.17707429e-03] [ 1.34348428e-04 4.30292024e-03 -2.80773702e-03] [-1.34348428e-04 -4.30292023e-03 -2.80773702e-03] [-4.03096702e-03 2.49716742e-03 -1.56952914e-03] [ 4.03096702e-03 -2.49716742e-03 -1.56952913e-03] [-2.69106696e-04 3.69738437e-03 2.56879621e-03] [ 2.69106698e-04 -3.69738437e-03 2.56879621e-03] [-4.36112041e-03 3.59896712e-03 1.34002512e-04] [ 4.36112041e-03 -3.59896712e-03 1.34002512e-04] [ 6.26197755e-03 -4.43233127e-03 -3.47607903e-03] [-6.26197755e-03 4.43233127e-03 -3.47607903e-03] [-3.97670444e-03 -9.00135461e-03 -9.50378363e-03] [ 3.97670444e-03 9.00135461e-03 -9.50378363e-03] [ 2.10701684e-03 3.09350504e-05 4.06344974e-03] [-2.10701684e-03 -3.09350537e-05 4.06344975e-03] [-3.92584865e-03 -2.42438155e-03 -6.25755394e-03] [ 3.92584865e-03 2.42438155e-03 -6.25755395e-03] [-6.75174270e-03 2.25962800e-03 3.09576170e-03] [ 6.75174270e-03 -2.25962800e-03 3.09576170e-03] [-9.05972428e-03 -3.53106327e-03 3.41301452e-03] [ 9.05972429e-03 3.53106327e-03 3.41301452e-03] [ 1.99459358e-03 -7.74276521e-03 1.96814685e-03] [-1.99459359e-03 7.74276521e-03 1.96814685e-03] [-5.87351192e-03 -5.17176689e-03 8.14612458e-03] [ 5.87351192e-03 5.17176689e-03 8.14612458e-03] [ 1.73729442e-03 3.19022924e-03 3.02372765e-03] [-1.73729442e-03 -3.19022924e-03 3.02372766e-03] [-4.86789473e-03 -1.59265277e-03 1.98799455e-03] [ 4.86789473e-03 1.59265277e-03 1.98799455e-03] [-3.98495892e-03 -9.79286113e-03 1.44033382e-04] [ 3.98495892e-03 9.79286113e-03 1.44033382e-04] [-5.85478387e-04 -4.01309391e-03 -2.55202217e-03] [ 5.85478388e-04 4.01309391e-03 -2.55202217e-03] [-1.13570819e-03 6.30315596e-04 -6.54192231e-04] [ 1.13570819e-03 -6.30315593e-04 -6.54192229e-04] [ 2.43046699e-03 5.33085828e-03 -2.00792461e-03] [-2.43046699e-03 -5.33085826e-03 -2.00792461e-03] [ 5.13002035e-05 8.12315011e-03 -2.33375776e-03] [-5.13002039e-05 -8.12315011e-03 -2.33375776e-03] [ 7.58898465e-03 -2.75128945e-03 3.79712499e-03] [-7.58898465e-03 2.75128945e-03 3.79712499e-03] [ 2.13045889e-03 -2.35486473e-03 1.64020334e-03] [-2.13045889e-03 2.35486473e-03 1.64020334e-03] [-2.11847311e-03 -4.01193592e-03 4.66817815e-03] [ 2.11847311e-03 4.01193592e-03 4.66817815e-03] [-4.68026973e-05 1.36416362e-03 -3.67452241e-03] [ 4.68026994e-05 -1.36416362e-03 -3.67452240e-03] [ 5.94211717e-03 2.51536255e-03 -1.21851022e-03] [-5.94211717e-03 -2.51536254e-03 -1.21851021e-03] [-5.97397471e-03 1.98905406e-03 -2.03670086e-03] [ 5.97397470e-03 -1.98905406e-03 -2.03670086e-03]] Final stress: [-3.53375211e-04 -4.89890806e-04 -1.90655323e-04 4.78330502e-18 1.31540888e-16 1.11270319e-04] Minimization converged after 44 steps. Minimization converged after 36 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 50 steps. Minimization converged after 53 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 109 steps. Minimization converged after 111 steps. Minimization converged after 120 steps. Minimization converged after 120 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 68 steps. Final forces: [[ 2.58311188e-04 9.00111682e-04 2.55997475e-06] [-1.99104798e-04 8.01141624e-05 1.68838403e-04] [-4.01072053e-04 1.60252059e-04 3.75550797e-04] [-6.33618657e-04 1.44667166e-04 -6.67269540e-04] [-1.78973562e-04 2.21736711e-04 -9.08744931e-04] [ 4.44540182e-04 2.89118901e-04 1.14845000e-03] [-3.89421406e-05 7.13648193e-04 -7.05778511e-04] [-5.65501555e-04 -3.92629765e-04 -4.65928332e-04] [-4.95896375e-04 6.51261506e-04 2.19509786e-04] [-6.23094005e-04 7.56314476e-04 6.58093333e-06] [-1.60931237e-03 -3.69233686e-04 1.17428068e-03] [-1.08099386e-03 -2.32851982e-04 -1.34377907e-03] [-6.13575774e-05 -1.48895530e-04 1.73301312e-04] [-1.07230494e-04 -2.56344555e-04 -6.77930815e-04] [ 6.41091341e-04 -9.53062261e-04 1.18996790e-03] [-6.96912036e-05 -8.31901065e-04 -1.89661320e-03] [ 1.99330026e-04 2.05988350e-04 -4.16822788e-05] [ 4.12296804e-05 3.62544322e-04 -1.58255093e-04] [-1.12494457e-04 3.93567205e-04 6.57019272e-04] [-6.85819528e-05 3.57722341e-04 -2.83940661e-04] [ 1.74170948e-03 -9.27709747e-04 4.65507097e-04] [ 2.16115896e-03 -1.02133361e-03 -7.71193635e-04] [ 5.76555839e-04 1.06977003e-03 8.35833121e-04] [-2.24162064e-04 -6.55308897e-05 -5.72218163e-04] [ 1.46163699e-03 -9.61737116e-04 8.92241117e-04] [ 9.69454266e-04 4.69451615e-04 1.23091720e-03] [ 5.20903290e-04 -7.90623237e-04 -1.05751763e-03] [-3.73320067e-04 -5.04580232e-04 1.88933238e-03] [ 1.37882286e-03 -4.45350033e-04 -7.31523299e-04] [ 1.59003427e-03 -3.22367209e-04 5.87017039e-04] [ 2.36569042e-04 1.35925364e-03 5.40333726e-04] [ 8.42130144e-04 1.40835724e-03 -3.43337636e-04] [ 5.60292949e-04 9.49613622e-04 -4.55498068e-04] [ 8.96456162e-04 1.06206741e-03 4.09659555e-04] [-5.35392984e-04 -8.48693915e-04 2.63915270e-04] [ 1.32897725e-04 -4.61059682e-04 -7.10027184e-04] [-9.71930241e-05 4.03092229e-04 -5.59576776e-04] [-3.18039394e-04 7.06549908e-04 8.31460592e-04] [ 5.23697987e-04 1.36147339e-03 1.47008020e-03] [ 1.07343560e-03 6.54141141e-04 -1.57432950e-03] [ 2.18072892e-04 -1.14523787e-03 -7.46183366e-04] [ 3.57710913e-04 -1.38059002e-03 6.12420262e-04] [ 9.87709088e-04 1.00397004e-04 -6.90652486e-05] [ 1.45545082e-03 -2.99924236e-05 8.58396222e-05] [-1.14380757e-04 5.84231853e-04 -8.43459077e-04] [-2.97470116e-04 2.74365816e-04 8.87415390e-04] [-6.39075199e-04 -8.81505178e-04 -2.37613884e-04] [-2.47527642e-04 -7.42908077e-04 3.87442639e-04] [-1.01456656e-03 -6.58572701e-05 7.22577237e-04] [-9.60177995e-04 5.39485405e-04 -2.51594980e-04] [-7.24570119e-04 3.21977690e-04 6.60392898e-04] [ 2.52493906e-04 -2.03496409e-04 -1.68754339e-04] [ 5.16708517e-04 -9.44815515e-04 -1.94139755e-04] [-3.64337279e-04 -1.30812219e-03 1.80027566e-04] [ 1.01203508e-03 2.45561685e-05 -1.80134126e-04] [ 7.57066890e-04 -3.66496090e-05 6.24326019e-04] [ 8.19800666e-05 -2.42412957e-04 5.65839159e-04] [-1.16742294e-03 5.59254106e-04 -5.14703348e-04] [-4.39374021e-04 -1.20194039e-03 5.76506413e-04] [ 4.24144558e-04 -8.58695870e-04 -6.69240050e-04] [ 1.18469955e-03 -3.00915532e-04 3.36395492e-04] [ 3.78714369e-04 4.44817523e-05 -1.12167095e-04] [ 6.55868376e-04 9.16509670e-04 3.14044400e-04] [ 8.38118442e-04 1.03565346e-03 -3.82721063e-04] [-1.86279616e-04 -1.94818363e-03 -2.32861446e-03] [ 2.20285299e-04 -1.66537230e-03 2.09475372e-03] [-1.17280482e-03 5.20211030e-04 -8.92038240e-04] [-1.23918556e-03 3.71502927e-04 4.98718454e-04] [-1.00161879e-03 -1.01508364e-04 -3.16876603e-04] [-1.50582708e-03 -2.09351041e-04 8.06134757e-04] [-2.66710379e-04 3.99900669e-05 -2.81507246e-04] [-1.68321000e-04 -2.31779045e-04 -6.86421387e-05] [ 1.22287817e-03 1.44135606e-03 -1.02792968e-03] [ 1.58527909e-04 4.27070811e-04 1.13028596e-03] [-8.57127462e-04 -5.19371462e-04 -7.98102219e-04] [-8.07953205e-04 -2.41372086e-04 1.16783328e-03] [-5.00458435e-05 -4.44448492e-05 -1.15211472e-03] [-5.47630887e-04 1.05909910e-04 3.36012922e-04] [-9.22068794e-04 -8.32788973e-04 -8.02735648e-04] [-4.61641203e-04 -1.64495334e-03 1.19339463e-04] [-3.42985194e-04 1.92267440e-05 3.56950253e-04] [-2.53812553e-04 1.25780238e-04 -3.48104177e-04] [ 5.46253778e-04 1.79919302e-03 -8.48506476e-04] [ 5.17897254e-04 1.59845201e-03 1.03038699e-03] [-1.55447906e-03 -9.24504515e-04 7.84397602e-04] [-1.14893414e-03 5.23794468e-06 3.75111581e-05] [-9.79178568e-04 5.31308818e-04 -4.15172965e-04] [-6.52947829e-04 1.55996280e-03 2.53383767e-04] [ 1.17027814e-03 -3.86586814e-04 -3.12727798e-04] [ 8.40070661e-04 -5.04256773e-04 1.61464759e-04] [ 7.62742601e-04 -7.40821197e-04 3.74837200e-04] [ 7.48653354e-04 -5.73421086e-04 -3.36512314e-04] [-1.96498201e-03 -6.92446339e-05 1.51894685e-04] [-1.64487977e-03 6.63824093e-04 -1.75704688e-04] [ 6.40423532e-04 -4.71431779e-04 -2.49032799e-04] [ 1.10484183e-04 -1.86969993e-04 8.30360436e-04] [-4.31674022e-04 5.39924916e-04 2.67052209e-04] [-2.54168003e-04 2.75485383e-04 1.88928496e-04] [ 1.66890254e-04 2.10299887e-04 -2.15335777e-03] [-3.51443103e-04 -5.83468530e-04 1.09587880e-03] [ 1.62834769e-04 8.03945716e-04 4.80296272e-05] [-1.09677232e-04 6.36461658e-04 -1.41713738e-03]] Final stress: [-6.01689656e-06 4.05084561e-07 -3.72651763e-06 2.96396122e-04 2.43454637e-04 2.30858785e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[-1.20587136e-04 1.17988862e-04 4.04988320e-05] [ 9.20667634e-06 1.53346870e-04 -4.23137120e-05] [ 2.21110281e-04 -1.83192131e-05 1.22967208e-05] [ 2.71723257e-04 -1.14286192e-04 -4.55715257e-05] [ 1.35138349e-04 5.02058481e-05 -1.70341616e-04] [-8.31927493e-05 6.76933967e-05 2.51228020e-04] [ 1.22318619e-05 -1.39978550e-04 7.74045915e-05] [ 1.53063069e-04 -9.20212061e-05 -2.66648855e-05] [ 3.47228101e-04 -3.71542511e-05 -3.28145899e-06] [ 3.42762314e-04 2.28234408e-05 -6.64364191e-07] [ 3.98150534e-04 1.67384731e-04 2.95341413e-04] [ 2.15211140e-04 1.39123701e-04 -3.42463521e-04] [-5.03681371e-05 -5.57003550e-05 5.62225573e-05] [-2.03990305e-05 -5.44636235e-05 5.98713337e-05] [-1.99600639e-04 -1.35426699e-04 2.64635605e-04] [ 9.55943490e-05 -2.64797955e-04 -1.42349563e-04] [-1.34897573e-04 5.23454723e-05 1.32737078e-04] [-1.00157744e-04 1.36319718e-04 -1.07354368e-04] [-6.60818202e-06 8.36872730e-06 1.42377127e-04] [-8.65543015e-06 1.30442614e-05 -2.04482388e-04] [-3.55242399e-04 -2.05146146e-04 6.37059930e-05] [-4.43011983e-04 -2.24324769e-04 -4.80078122e-05] [-6.50533630e-05 8.35814701e-05 4.98485620e-05] [ 2.08727457e-04 4.84370349e-05 -7.71168594e-05] [-3.49124820e-04 5.83463398e-05 -6.59997653e-05] [-1.60662071e-04 -9.94123047e-06 -3.60007603e-05] [ 2.73072425e-05 -1.56998950e-04 -2.23483429e-04] [ 3.03183854e-04 -2.90542829e-05 3.95475756e-05] [-2.29596277e-04 -9.15704140e-05 -2.77172985e-04] [-2.72784786e-04 -8.14303503e-05 2.83763546e-04] [-1.31042826e-04 2.59672770e-04 1.31153111e-04] [-2.88241389e-04 2.91552828e-04 -1.76934535e-04] [-4.45166973e-05 1.32431904e-04 8.27882003e-05] [-1.68804178e-04 1.79190511e-04 -6.92648765e-05] [ 1.31546129e-04 3.12926235e-04 3.25303560e-04] [ 4.91983087e-05 1.52942275e-04 -1.63381687e-04] [-1.17279387e-04 -1.84872816e-04 -1.57565082e-04] [ 1.16488004e-04 -2.63662079e-04 9.74199664e-05] [-9.37983820e-06 -4.82897252e-04 2.76602040e-04] [-2.21820246e-04 -2.33239222e-04 -1.21003198e-04] [-1.88100449e-04 2.03778408e-04 -5.05210260e-04] [-4.31936027e-07 4.47080839e-04 4.60378760e-04] [ 3.08729564e-05 3.35286401e-05 3.61976664e-04] [-7.24085274e-05 1.26196470e-04 -3.60593747e-04] [-3.57837725e-04 -9.68357292e-05 -3.38778987e-05] [-1.95335406e-04 -5.00651819e-05 5.33013984e-05] [ 1.91373307e-04 -1.27367803e-05 -5.67841794e-05] [ 1.35492137e-04 -1.02046433e-04 4.52302798e-05] [-5.70323152e-05 2.44513049e-05 1.49990120e-04] [ 9.18648499e-05 -7.98457965e-05 -1.12357261e-04] [ 1.37988416e-04 -3.25307202e-04 1.40563183e-04] [-1.47421299e-04 -1.88539834e-04 -2.43064815e-04] [-8.60264693e-05 5.18453029e-05 -8.04781119e-05] [ 3.06845062e-04 1.60551772e-04 1.62696383e-04] [ 2.29260014e-04 2.80470617e-04 -1.62936734e-05] [ 1.03582008e-04 1.60062483e-04 -8.11909157e-05] [-1.01813338e-04 -3.97119484e-05 -8.78157083e-05] [ 1.85047496e-04 -3.33121015e-04 7.57183949e-05] [-7.95916746e-05 -1.26888745e-04 -1.66721717e-05] [-3.38082453e-04 -2.36509355e-04 5.92199106e-05] [-1.61769538e-04 -1.81182271e-05 -2.27287903e-04] [ 1.51158853e-04 -1.73638178e-04 1.79792926e-04] [ 2.20568217e-05 -3.09915796e-04 3.92238990e-04] [ 4.32360719e-05 -3.72460928e-04 -4.17961257e-04] [-1.93967320e-04 1.98249308e-04 -1.36008508e-04] [-2.56841518e-04 1.47431140e-04 8.20847435e-05] [ 2.85600678e-04 -1.77316106e-04 2.30149156e-04] [ 1.61599010e-04 -5.57367176e-05 -1.15741890e-04] [ 1.50050937e-04 3.45022463e-05 8.98686894e-05] [ 2.08476759e-04 9.36664335e-05 -2.36646832e-04] [-1.74045537e-05 3.89614666e-05 1.06924207e-04] [-2.92635443e-05 8.79721995e-05 5.80228743e-05] [ 1.51776743e-04 1.42508838e-05 -1.22686544e-04] [ 2.87064903e-04 1.52224275e-04 -2.63785660e-05] [ 2.15709851e-04 2.42099943e-08 1.28604625e-04] [ 9.39134957e-05 -7.88528051e-05 -3.37499555e-04] [ 3.70829131e-04 1.88862747e-04 3.34197328e-04] [ 4.05882838e-04 1.42869714e-04 -1.60153544e-04] [ 1.74890303e-04 -1.73848763e-04 -9.23612746e-05] [-1.28779194e-04 -1.47176540e-04 7.84123831e-05] [ 4.33808271e-05 1.29777290e-05 1.34458872e-04] [-3.38014209e-05 4.05371781e-05 -1.12335246e-04] [-1.14722698e-04 5.48981541e-04 -2.51534840e-04] [-7.39624356e-05 4.38326462e-04 2.46546017e-04] [ 1.86778409e-04 -2.85348592e-05 1.38381770e-04] [ 6.41731338e-05 -5.59155606e-05 -1.10915158e-04] [ 1.60029163e-04 2.81696987e-04 5.21371845e-05] [ 9.98635970e-06 3.24423009e-04 -6.99438506e-05] [-2.10483969e-04 -2.25157257e-04 -7.06166863e-05] [-1.33571493e-04 -2.25775666e-04 3.71506956e-05] [-1.61666695e-04 -3.37553105e-04 2.12792270e-04] [-1.62380633e-04 -2.66512403e-04 -1.70734487e-04] [ 2.92039212e-04 3.15546749e-05 1.20589364e-05] [ 4.38028339e-04 3.24244407e-05 -1.21029081e-05] [-1.72102126e-04 2.28677509e-04 4.19531598e-07] [ 3.69634704e-05 9.96703244e-05 -1.29963676e-04] [-9.47471815e-05 -1.50134011e-05 8.60066028e-05] [-2.31634452e-04 -4.71571298e-05 -1.76587408e-05] [-3.01733314e-04 4.25044467e-05 -9.77758229e-05] [-2.49731194e-04 1.75517399e-04 6.61282395e-05] [-2.17277678e-04 -9.45720587e-05 5.63568600e-04] [-2.52873047e-04 -2.18494803e-05 -4.09701146e-04]] Final stress: [-3.00415703e-06 -2.26473153e-06 -3.15336393e-06 2.96135837e-04 -2.44423752e-04 -8.08964505e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[-3.02433814e-05 -1.36638533e-04 -2.23291255e-05] [ 9.42816335e-05 -1.17359823e-04 2.45357092e-05] [-2.67057318e-04 1.36260311e-04 -8.00013398e-05] [-2.06954695e-04 3.69835197e-05 5.03137525e-05] [ 9.67547587e-05 -6.72117309e-05 2.56170804e-04] [-1.15987126e-04 -4.92803815e-05 -1.72924260e-04] [-1.64968188e-04 8.50159801e-05 -4.84271895e-05] [-3.96174955e-05 1.24068920e-04 8.73354169e-05] [-3.06506492e-04 -5.40480570e-05 1.03029166e-05] [-3.10338241e-04 4.87869588e-06 -9.28033746e-06] [-2.32004166e-04 -9.84720880e-05 -3.38675052e-04] [-4.10464376e-04 -1.23773717e-04 2.85089410e-04] [ 1.11854409e-05 6.65177745e-05 5.14461313e-05] [ 3.84683531e-05 6.45027899e-05 6.16861182e-05] [-7.19159758e-05 2.59568444e-04 -1.55883113e-04] [ 2.17887471e-04 1.27239218e-04 2.89664004e-04] [ 1.11691545e-04 -1.44525855e-04 -8.07518116e-05] [ 1.41822317e-04 -6.08526041e-05 1.08465697e-04] [ 1.33968691e-05 -2.31910402e-05 -2.08769571e-04] [ 8.82081965e-06 -1.58785857e-05 1.46493130e-04] [ 4.42934906e-04 2.64840012e-04 -4.44170744e-05] [ 3.54081789e-04 2.52935955e-04 5.63195841e-05] [-1.70399311e-04 -9.29913465e-05 -8.94142019e-05] [ 9.31258499e-05 -9.38854384e-05 5.39146104e-05] [ 1.40482780e-04 2.14354425e-05 -3.68766067e-05] [ 3.35285348e-04 -4.04712477e-05 -5.54367172e-05] [-2.67484338e-04 4.03478798e-05 6.31505677e-05] [ 2.59360026e-07 1.64802880e-04 -2.59352895e-04] [ 2.61101907e-04 9.23121247e-05 2.68643596e-04] [ 2.28140172e-04 1.02134293e-04 -2.62500077e-04] [ 2.22561741e-04 -2.95520228e-04 -1.64324048e-04] [ 6.38235918e-05 -2.62893476e-04 1.18339367e-04] [ 1.86454427e-04 -1.68466069e-04 -5.50186955e-05] [ 5.84633214e-05 -1.21470003e-04 7.11878652e-05] [-4.73374681e-05 -1.38649781e-04 -1.45441135e-04] [-1.21928417e-04 -3.00764709e-04 3.03244487e-04] [-1.17236727e-04 2.39291118e-04 1.03731072e-04] [ 1.13202471e-04 1.62731607e-04 -1.63621621e-04] [ 2.20802645e-04 2.43955252e-04 -1.13074933e-04] [-1.00473631e-05 5.00664590e-04 2.79253123e-04] [-9.73471639e-06 -4.25859256e-04 4.60407152e-04] [ 1.93560601e-04 -1.86498113e-04 -5.13583216e-04] [ 7.45130802e-05 -1.32601443e-04 -3.39762528e-04] [-3.06196427e-05 -4.47686730e-05 3.45036185e-04] [ 2.06202007e-04 4.19175522e-05 3.92899096e-05] [ 3.65882861e-04 9.05765828e-05 -2.55640128e-05] [-1.42696813e-04 7.26093886e-05 6.60250135e-05] [-2.02602551e-04 -2.16199844e-05 -8.15172864e-05] [-7.84928662e-05 9.24488483e-05 -1.26098531e-04] [ 7.38442815e-05 -1.95294336e-05 1.64966869e-04] [ 1.27054512e-04 1.77657403e-04 -2.27184488e-04] [-1.46987503e-04 3.10500087e-04 1.27198477e-04] [-2.66902008e-04 -1.65878287e-04 1.65545743e-04] [ 1.24271010e-04 -6.48136356e-05 -8.54451127e-05] [-9.99745866e-05 -1.54208672e-04 -8.45404273e-05] [-2.27834608e-04 -2.96010418e-04 2.12946566e-06] [-1.94617681e-04 3.18939435e-04 3.80863816e-05] [ 9.51149230e-05 2.99847595e-05 -4.92782033e-05] [ 3.14044740e-04 2.05389268e-04 6.33160832e-05] [ 5.63359480e-05 9.82734260e-05 -2.07836950e-05] [-1.29944742e-04 1.98059443e-04 1.71647856e-04] [ 1.75840078e-04 4.49529467e-05 -2.21374492e-04] [-5.55764857e-05 3.89596895e-04 -4.38885931e-04] [-2.00847014e-05 3.30213147e-04 4.16525302e-04] [ 2.74848203e-04 -1.60318447e-04 1.04702848e-04] [ 2.00252604e-04 -2.03925022e-04 -1.59092953e-04] [-1.79289133e-04 3.09565281e-05 -1.10562148e-04] [-3.03430680e-04 1.50917765e-04 2.24523421e-04] [-2.25423831e-04 -9.28722670e-05 -2.39174385e-04] [-1.72951205e-04 -3.28417581e-05 1.07078039e-04] [ 4.35778958e-05 -1.00743971e-04 1.43501023e-05] [ 3.68092867e-05 -5.77380066e-05 1.45876148e-04] [-2.92850429e-04 -1.62048642e-04 -1.57198153e-05] [-1.61135838e-04 -3.72006523e-05 -1.39186917e-04] [-9.85220973e-05 7.47985620e-05 -3.17577792e-04] [-2.21398913e-04 -1.07157035e-06 9.72646844e-05] [-4.04505322e-04 -1.01733756e-04 -1.52053046e-04] [-3.77918160e-04 -1.41144108e-04 3.21943263e-04] [ 1.20230809e-04 1.80465397e-04 7.55708664e-05] [-1.79753922e-04 1.97517820e-04 -1.03099714e-04] [ 3.84377053e-05 -5.34726409e-05 -1.25441338e-04] [-4.26874852e-05 -3.06199546e-05 1.49209071e-04] [ 9.34091977e-05 -3.94987336e-04 2.46118470e-04] [ 1.41028112e-04 -5.08784899e-04 -2.59414236e-04] [-5.93821755e-05 4.72170371e-05 -8.52078053e-05] [-1.66892409e-04 3.51099659e-05 1.31721585e-04] [-1.36066555e-05 -3.32939702e-04 -3.28149009e-05] [-1.67940909e-04 -2.71946650e-04 1.65482354e-05] [ 1.29743440e-04 1.90018000e-04 3.24240517e-05] [ 2.12465176e-04 1.91698836e-04 -6.64030487e-05] [ 1.64448819e-04 2.44753261e-04 -1.41077122e-04] [ 1.58899581e-04 3.20850416e-04 1.90296343e-04] [-4.80622143e-04 -3.23586509e-05 -6.74886234e-06] [-3.12082736e-04 -6.43241475e-05 4.38487941e-06] [-2.96133497e-05 -1.06314680e-04 -1.23064293e-04] [ 1.77261053e-04 -2.33180347e-04 -1.14189207e-05] [ 2.48153840e-04 7.76586340e-05 -1.24272967e-05] [ 1.07922261e-04 4.19446371e-05 8.24912837e-05] [ 2.41819568e-04 -1.71271078e-04 5.70724534e-05] [ 2.84516759e-04 -5.20938518e-05 -9.00217631e-05] [ 2.43861821e-04 6.86092904e-06 -4.15852728e-04] [ 2.07187690e-04 7.96909906e-05 5.75859270e-04]] Final stress: [-3.04818874e-06 -2.24090852e-06 -3.14040775e-06 -2.96020318e-04 2.44548899e-04 -7.89714584e-06] Minimization converged after 182 steps. Minimization converged after 128 steps. Minimization converged after 136 steps. Minimization converged after 129 steps. Minimization converged after 134 steps. Minimization converged after 61 steps. Minimization converged after 63 steps. Minimization converged after 144 steps. Minimization converged after 141 steps. Minimization converged after 122 steps. Minimization converged after 141 steps. Minimization converged after 110 steps. Minimization converged after 109 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 29 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 27 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 49 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 57 steps. Minimization converged after 56 steps. Minimization converged after 113 steps. Minimization converged after 117 steps. Minimization converged after 112 steps. Minimization converged after 112 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 49 steps. Minimization converged after 57 steps. Minimization converged after 56 steps. Minimization converged after 55 steps. Minimization converged after 53 steps. Minimization converged after 114 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 2.63150437e-03 4.36212896e-04 -4.98817157e-04] [-2.63150437e-03 -4.36212895e-04 -4.98817157e-04] [ 3.47577565e-03 4.15887141e-03 -8.86290126e-05] [-3.47577565e-03 -4.15887141e-03 -8.86290115e-05] [ 1.72362424e-03 -2.59166249e-03 -2.96721392e-03] [-1.72362424e-03 2.59166249e-03 -2.96721392e-03] [-4.95077585e-03 -5.37450600e-03 -2.81517604e-04] [ 4.95077585e-03 5.37450600e-03 -2.81517604e-04] [ 5.44367158e-04 2.77000597e-03 -2.34441748e-03] [-5.44367157e-04 -2.77000597e-03 -2.34441748e-03] [ 6.62738782e-04 7.18584708e-04 3.37387573e-03] [-6.62738782e-04 -7.18584708e-04 3.37387573e-03] [-3.92840088e-03 2.22787179e-04 -3.48796635e-03] [ 3.92840088e-03 -2.22787178e-04 -3.48796635e-03] [-7.69454416e-03 -5.44293066e-03 -4.85969619e-03] [ 7.69454416e-03 5.44293066e-03 -4.85969620e-03] [ 8.19006150e-05 4.70593508e-03 -4.94349747e-03] [-8.19006150e-05 -4.70593508e-03 -4.94349747e-03] [ 1.81793389e-03 -1.48361675e-05 2.53913484e-03] [-1.81793389e-03 1.48361682e-05 2.53913484e-03] [ 6.19518155e-03 -3.52157222e-03 5.48246273e-04] [-6.19518155e-03 3.52157222e-03 5.48246273e-04] [-4.44819551e-03 9.38076218e-04 2.38417366e-03] [ 4.44819551e-03 -9.38076205e-04 2.38417366e-03] [ 5.20436558e-04 9.93645297e-04 -1.00547004e-04] [-5.20436558e-04 -9.93645301e-04 -1.00547011e-04] [-3.33836477e-04 5.23113038e-03 7.14827840e-03] [ 3.33836477e-04 -5.23113038e-03 7.14827840e-03] [ 3.80402240e-03 2.13111739e-03 -3.04843746e-03] [-3.80402240e-03 -2.13111739e-03 -3.04843746e-03] [ 6.33055669e-05 2.54689162e-03 1.87641819e-03] [-6.33055674e-05 -2.54689162e-03 1.87641819e-03] [-4.59547865e-03 -3.60210794e-03 -3.94711152e-04] [ 4.59547865e-03 3.60210794e-03 -3.94711151e-04] [-6.03424519e-03 1.57861863e-03 4.03091356e-04] [ 6.03424519e-03 -1.57861863e-03 4.03091356e-04] [ 3.52895386e-04 3.92736712e-03 1.87959647e-03] [-3.52895386e-04 -3.92736712e-03 1.87959647e-03] [ 1.77904847e-04 1.19587235e-03 5.33656105e-03] [-1.77904848e-04 -1.19587235e-03 5.33656105e-03] [ 2.23166846e-04 -9.64808658e-04 -2.45436785e-03] [-2.23166842e-04 9.64808661e-04 -2.45436786e-03] [-2.08160263e-03 -3.13348853e-03 -2.49111677e-03] [ 2.08160263e-03 3.13348853e-03 -2.49111677e-03] [-7.40157457e-04 -4.52011425e-03 4.29136540e-03] [ 7.40157457e-04 4.52011425e-03 4.29136539e-03] [-1.13144548e-03 4.25295319e-03 2.25908652e-03] [ 1.13144548e-03 -4.25295318e-03 2.25908652e-03] [-2.42313675e-04 -4.38695336e-04 -4.48235239e-03] [ 2.42313675e-04 4.38695338e-04 -4.48235238e-03] [ 8.86585003e-04 -2.74770537e-03 -1.55845449e-03] [-8.86585004e-04 2.74770536e-03 -1.55845449e-03] [-3.51284907e-03 -4.27411150e-04 -7.90015978e-04] [ 3.51284907e-03 4.27411148e-04 -7.90015977e-04] [ 1.38263139e-03 -1.86674201e-03 1.95195990e-03] [-1.38263139e-03 1.86674201e-03 1.95195990e-03] [-3.93592609e-03 -6.78782126e-04 -1.82270115e-03] [ 3.93592610e-03 6.78782127e-04 -1.82270116e-03] [ 4.19870105e-03 2.73459576e-03 -2.55897987e-03] [-4.19870105e-03 -2.73459577e-03 -2.55897987e-03] [-3.30194141e-03 -2.58988579e-03 1.88153392e-04] [ 3.30194141e-03 2.58988579e-03 1.88153391e-04] [ 1.76092655e-03 4.72913079e-04 3.05576477e-03] [-1.76092655e-03 -4.72913079e-04 3.05576477e-03] [-2.11986811e-03 5.59635832e-03 -7.76726197e-03] [ 2.11986811e-03 -5.59635832e-03 -7.76726197e-03] [-4.25582583e-03 -1.46020856e-03 2.70518191e-03] [ 4.25582583e-03 1.46020856e-03 2.70518191e-03] [-2.87509973e-03 2.35156371e-03 -4.55015372e-03] [ 2.87509973e-03 -2.35156371e-03 -4.55015372e-03] [ 3.17432776e-03 4.04659535e-03 8.92817864e-04] [-3.17432776e-03 -4.04659535e-03 8.92817864e-04] [-7.31798638e-03 8.73787267e-04 2.80892591e-03] [ 7.31798638e-03 -8.73787268e-04 2.80892590e-03] [ 1.76707078e-03 -2.09462280e-03 1.93604614e-03] [-1.76707078e-03 2.09462280e-03 1.93604614e-03] [-3.90310171e-03 3.42859146e-03 5.62374260e-03] [ 3.90310171e-03 -3.42859146e-03 5.62374260e-03] [ 2.73782627e-03 -1.40511377e-03 1.13810540e-03] [-2.73782627e-03 1.40511377e-03 1.13810540e-03] [ 2.48300286e-03 -7.36099591e-03 -5.92873021e-05] [-2.48300286e-03 7.36099591e-03 -5.92873024e-05] [ 3.47518981e-04 -2.71319843e-03 -1.71009413e-03] [-3.47518982e-04 2.71319843e-03 -1.71009413e-03] [-4.30033992e-04 -8.89685176e-06 3.30727629e-04] [ 4.30033992e-04 8.89685314e-06 3.30727630e-04] [-1.20948870e-03 2.22175821e-03 -1.27443466e-03] [ 1.20948870e-03 -2.22175821e-03 -1.27443466e-03] [ 9.06515280e-05 5.95532327e-03 -1.69711513e-03] [-9.06515281e-05 -5.95532327e-03 -1.69711513e-03] [-5.33747062e-03 -2.23130079e-03 2.68579763e-03] [ 5.33747062e-03 2.23130079e-03 2.68579763e-03] [-1.50594997e-04 -9.30104109e-05 1.08447901e-03] [ 1.50594996e-04 9.30104007e-05 1.08447901e-03] [-1.34974717e-04 -1.71172217e-03 -1.83971011e-03] [ 1.34974715e-04 1.71172218e-03 -1.83971010e-03] [-1.30267983e-03 2.51780764e-03 3.32582499e-03] [ 1.30267983e-03 -2.51780764e-03 3.32582499e-03] [-4.05242272e-03 -4.18815903e-04 -1.40720795e-03] [ 4.05242272e-03 4.18815902e-04 -1.40720795e-03] [ 3.50728486e-03 -1.10105634e-03 -2.88650730e-04] [-3.50728486e-03 1.10105634e-03 -2.88650735e-04]] Final stress: [-2.18731924e-04 -3.01570878e-04 -1.13150746e-04 7.44833013e-16 -2.00853846e-16 -8.45453504e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.32379460e-03 7.54284393e-04 -1.87633367e-04] [ 2.32379460e-03 -7.54284405e-04 -1.87633365e-04] [-3.06125533e-03 3.69549474e-03 -9.07574751e-06] [ 3.06125533e-03 -3.69549474e-03 -9.07574708e-06] [-1.55226260e-03 -2.20574182e-03 -2.61880929e-03] [ 1.55226260e-03 2.20574182e-03 -2.61880929e-03] [ 4.42755085e-03 -4.81381221e-03 -1.79403311e-04] [-4.42755085e-03 4.81381221e-03 -1.79403309e-04] [-5.00323409e-04 2.41283371e-03 -2.06065797e-03] [ 5.00323410e-04 -2.41283371e-03 -2.06065797e-03] [-6.11327435e-04 4.85814481e-04 3.05979174e-03] [ 6.11327435e-04 -4.85814479e-04 3.05979174e-03] [ 3.54199651e-03 2.72211048e-04 -3.12197644e-03] [-3.54199651e-03 -2.72211048e-04 -3.12197644e-03] [ 6.71173442e-03 -4.76412569e-03 -4.42097043e-03] [-6.71173442e-03 4.76412569e-03 -4.42097043e-03] [-1.31531011e-04 4.21894775e-03 -4.35743230e-03] [ 1.31531011e-04 -4.21894775e-03 -4.35743230e-03] [-1.46675735e-03 -1.20220562e-04 2.31581680e-03] [ 1.46675735e-03 1.20220561e-04 2.31581680e-03] [-5.53568987e-03 -3.07247327e-03 4.83547641e-04] [ 5.53568987e-03 3.07247327e-03 4.83547641e-04] [ 4.08282302e-03 6.94364167e-04 1.97149230e-03] [-4.08282302e-03 -6.94364173e-04 1.97149230e-03] [-4.71666694e-04 1.04134101e-03 -1.82514311e-04] [ 4.71666693e-04 -1.04134101e-03 -1.82514312e-04] [ 3.84863404e-04 4.52359945e-03 6.47361842e-03] [-3.84863403e-04 -4.52359945e-03 6.47361841e-03] [-3.33027824e-03 1.77132575e-03 -2.70151613e-03] [ 3.33027824e-03 -1.77132575e-03 -2.70151613e-03] [-9.82788828e-05 2.39179877e-03 1.70655075e-03] [ 9.82788822e-05 -2.39179877e-03 1.70655075e-03] [ 4.11868618e-03 -3.19465083e-03 -4.28595961e-04] [-4.11868618e-03 3.19465083e-03 -4.28595963e-04] [ 4.81130687e-04 -3.46738567e-03 1.72709267e-03] [-4.81130687e-04 3.46738567e-03 1.72709267e-03] [-5.15345894e-03 -1.30531845e-03 2.98882138e-04] [ 5.15345895e-03 1.30531845e-03 2.98882139e-04] [ 4.19752957e-04 8.14503540e-04 -2.32229583e-03] [-4.19752955e-04 -8.14503541e-04 -2.32229583e-03] [ 1.25960826e-04 -9.27819215e-04 4.83218329e-03] [-1.25960826e-04 9.27819215e-04 4.83218329e-03] [-6.21051679e-04 4.13504863e-03 3.71371333e-03] [ 6.21051679e-04 -4.13504863e-03 3.71371333e-03] [-1.85513284e-03 2.73533236e-03 -2.39310462e-03] [ 1.85513284e-03 -2.73533236e-03 -2.39310462e-03] [-7.69905519e-05 3.17179011e-04 -4.07065061e-03] [ 7.69905524e-05 -3.17179013e-04 -4.07065061e-03] [-8.88581068e-04 -3.92390295e-03 2.09797831e-03] [ 8.88581069e-04 3.92390295e-03 2.09797831e-03] [-2.99067637e-03 4.70357662e-04 -6.78190843e-04] [ 2.99067637e-03 -4.70357660e-04 -6.78190844e-04] [ 9.92762758e-04 2.44470763e-03 -1.50817822e-03] [-9.92762759e-04 -2.44470763e-03 -1.50817822e-03] [-3.51121731e-03 5.91200938e-04 -1.64802486e-03] [ 3.51121731e-03 -5.91200939e-04 -1.64802486e-03] [ 1.32747775e-03 1.52314042e-03 1.73961286e-03] [-1.32747775e-03 -1.52314042e-03 1.73961286e-03] [-2.96436790e-03 2.23151410e-03 2.08832063e-04] [ 2.96436790e-03 -2.23151410e-03 2.08832063e-04] [ 3.79280311e-03 -2.51976888e-03 -2.18009348e-03] [-3.79280310e-03 2.51976888e-03 -2.18009348e-03] [-1.85460818e-03 -4.83207641e-03 -7.15936872e-03] [ 1.85460818e-03 4.83207641e-03 -7.15936872e-03] [ 1.81164034e-03 -6.41471226e-04 2.90825532e-03] [-1.81164034e-03 6.41471224e-04 2.90825533e-03] [-2.54787465e-03 -1.96050589e-03 -3.95378569e-03] [ 2.54787466e-03 1.96050589e-03 -3.95378569e-03] [-3.70610262e-03 1.43305086e-03 2.28612638e-03] [ 3.70610262e-03 -1.43305086e-03 2.28612638e-03] [-6.48107310e-03 -8.41212561e-04 2.43460716e-03] [ 6.48107310e-03 8.41212560e-04 2.43460716e-03] [ 2.90049769e-03 -3.41045708e-03 7.62420148e-04] [-2.90049770e-03 3.41045708e-03 7.62420147e-04] [-3.32602816e-03 -3.02465651e-03 5.16586445e-03] [ 3.32602816e-03 3.02465651e-03 5.16586444e-03] [ 1.56807839e-03 1.89638789e-03 1.70838444e-03] [-1.56807839e-03 -1.89638789e-03 1.70838444e-03] [-2.56716089e-03 -1.17104348e-03 8.75176360e-04] [ 2.56716089e-03 1.17104348e-03 8.75176360e-04] [-2.01889428e-03 -6.55340214e-03 -1.31080822e-04] [ 2.01889428e-03 6.55340214e-03 -1.31080822e-04] [-1.62494429e-04 -2.40441086e-03 -1.49263535e-03] [ 1.62494429e-04 2.40441086e-03 -1.49263534e-03] [ 5.42235684e-04 -1.41333336e-04 3.60725607e-04] [-5.42235683e-04 1.41333336e-04 3.60725608e-04] [ 1.03027735e-03 1.59737295e-03 -1.05896468e-03] [-1.03027735e-03 -1.59737294e-03 -1.05896468e-03] [-2.51098496e-04 5.30440452e-03 -1.41485582e-03] [ 2.51098496e-04 -5.30440452e-03 -1.41485582e-03] [ 4.77012312e-03 -2.01953927e-03 2.44950818e-03] [-4.77012312e-03 2.01953927e-03 2.44950818e-03] [ 4.13407146e-05 2.17167210e-04 9.66031687e-04] [-4.13407154e-05 -2.17167205e-04 9.66031686e-04] [-1.10174046e-03 -2.25290821e-03 2.86273368e-03] [ 1.10174046e-03 2.25290821e-03 2.86273368e-03] [-2.79655462e-05 1.77533289e-03 -1.63091174e-03] [ 2.79655469e-05 -1.77533289e-03 -1.63091174e-03] [ 3.19964311e-03 1.09036464e-03 -2.67856662e-04] [-3.19964311e-03 -1.09036464e-03 -2.67856662e-04] [-3.56702603e-03 3.67337987e-04 -1.23036252e-03] [ 3.56702603e-03 -3.67337986e-04 -1.23036252e-03]] Final stress: [-2.16303201e-04 -3.04599951e-04 -1.22177768e-04 9.46882417e-16 2.15917885e-15 7.66896270e-05] Minimization converged after 41 steps. Minimization converged after 33 steps. Minimization converged after 53 steps. Minimization converged after 51 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. Minimization converged after 54 steps. Minimization converged after 52 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 110 steps. Minimization converged after 109 steps. Minimization converged after 116 steps. Minimization converged after 117 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 58 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[-3.33893017e-04 -9.75930383e-05 8.87958501e-05] [-2.27862363e-04 -6.64274434e-05 -1.10061651e-04] [ 3.72870393e-05 9.76537838e-05 1.17019849e-04] [ 4.76477806e-05 1.24127188e-04 -1.27574269e-04] [ 1.33376058e-04 -1.46908714e-06 -1.03879846e-04] [-9.95596081e-06 2.41578269e-05 6.62593574e-05] [ 1.15424836e-04 8.99021048e-05 7.61185538e-05] [ 2.02091327e-04 1.36947004e-04 -4.62979127e-05] [-2.18593894e-05 -5.77354503e-05 -8.76522673e-05] [-4.22114834e-05 -9.56868513e-06 7.08176355e-05] [ 3.53075939e-04 -9.34709022e-05 3.33018303e-05] [ 2.35249874e-04 -1.08171685e-04 -1.41352503e-05] [ 4.24352116e-05 -5.42941277e-05 6.42490874e-06] [ 3.35565693e-05 -4.26777114e-05 1.41161321e-05] [ 4.87408238e-05 7.03925523e-05 -1.16196382e-04] [ 2.07095299e-04 2.73946056e-05 6.88876200e-05] [ 5.28999642e-05 1.08292154e-04 -1.23390986e-05] [ 7.38441278e-05 1.28440966e-04 -1.25449505e-05] [-9.09660422e-05 1.17256812e-05 -8.25560708e-05] [-8.91739079e-05 -5.64195115e-07 7.25496029e-05] [ 2.44117793e-05 6.89665661e-05 3.30106517e-05] [ 2.42706267e-05 2.64349361e-05 1.20733574e-05] [-1.11865289e-04 5.73928493e-05 -1.68895273e-04] [ 9.56572967e-05 1.40171644e-05 1.88175518e-04] [-1.28619757e-04 -1.23550534e-04 -8.92120523e-05] [ 1.26387042e-05 -2.05805977e-04 -3.04420750e-05] [-1.22162780e-04 4.11402079e-05 -1.59972380e-04] [ 5.28501915e-05 4.48362390e-05 2.21554961e-04] [-7.37942580e-05 -9.80772522e-05 -3.12520111e-05] [-8.75692798e-05 -8.15799924e-05 3.44837667e-05] [ 2.18781366e-05 -4.88870435e-05 2.03269269e-04] [-4.74118730e-05 -4.68360433e-05 -2.26959531e-04] [-1.16041493e-05 2.88036033e-05 -3.23400472e-05] [-6.93875552e-05 1.86440669e-05 4.32516713e-05] [ 8.76521255e-05 -3.29276535e-05 -8.32423177e-05] [-4.11364785e-05 -8.61284516e-05 1.45721483e-04] [-1.89097378e-04 3.33964086e-05 -1.99025228e-04] [-7.38152073e-05 -3.04563662e-05 1.61449451e-04] [-6.37765005e-05 -1.29861978e-04 -1.45637284e-04] [-1.72379022e-04 1.56310485e-05 2.03418690e-04] [-2.75223804e-04 -7.12075180e-05 6.53648511e-05] [-1.35140575e-04 8.08415110e-05 -1.09373805e-04] [-1.15426687e-04 -3.24086834e-05 9.60781348e-05] [-1.96333411e-04 5.18381266e-05 -9.99550900e-05] [-7.08629233e-05 -2.27548307e-04 1.54466949e-04] [-3.39607906e-06 -1.81250325e-04 -1.40274870e-04] [-4.67670238e-05 -5.91085925e-05 -1.98153229e-04] [-9.74020062e-05 -6.30676641e-05 1.18994222e-04] [ 2.17392982e-04 -6.66568645e-05 -4.20521134e-04] [ 2.18248760e-04 -3.81321541e-05 4.99861079e-04] [ 2.14650576e-04 -2.85369647e-04 1.38627328e-04] [-1.58617228e-05 -2.28583786e-04 -2.05406348e-04] [-4.33047644e-05 -5.95176202e-06 8.44091541e-05] [ 1.59782864e-04 9.12415329e-05 -1.72027276e-05] [ 2.44806236e-04 2.06461283e-04 5.72267313e-05] [ 1.14904701e-04 1.23274324e-04 -1.41222677e-04] [ 9.88055912e-05 2.97649837e-04 -8.59192849e-05] [ 2.35621965e-04 6.80984911e-05 7.85465885e-05] [ 6.19356193e-05 8.36765058e-05 2.12922172e-04] [-1.50040922e-04 -2.67439113e-05 -1.72363190e-04] [-3.27647184e-04 1.03982061e-04 -1.85749988e-04] [-1.09417730e-04 7.35080374e-06 1.35016481e-04] [-2.31919799e-04 9.06446281e-05 7.04331207e-05] [-2.19162439e-04 4.00651141e-05 -4.29403317e-05] [-1.89729079e-04 -3.79413259e-05 -2.34142461e-04] [-2.16422082e-04 -3.16706488e-05 1.68903093e-04] [-2.21251060e-05 -1.66600960e-05 3.48250756e-06] [-7.31352120e-05 5.24168232e-05 6.66549397e-05] [-2.48646017e-04 -1.53023304e-04 1.28996742e-04] [-1.58794017e-04 -9.78131135e-05 -2.75627734e-04] [-8.96621954e-05 -1.53801340e-04 9.40272861e-05] [-1.81044076e-04 -1.08545177e-04 1.61504180e-05] [-1.16337980e-04 -8.26512131e-05 4.86728238e-06] [-1.85604946e-05 8.62611958e-05 -5.67885611e-05] [ 2.30681571e-05 -1.37842105e-05 1.13583570e-04] [-2.92742935e-05 -5.86203872e-05 -1.44967483e-04] [-2.90192722e-04 2.44659009e-04 -3.16345699e-05] [-2.14632636e-04 1.63135006e-04 1.49595334e-04] [ 1.95372804e-04 -1.59296257e-05 -9.83811077e-05] [ 2.88994046e-05 9.15150664e-05 1.78132139e-04] [ 9.29152561e-05 -1.70949740e-04 -1.53151776e-04] [ 7.55150911e-05 -1.70612669e-04 1.30458000e-04] [ 4.83334772e-05 -3.61623941e-05 1.17814440e-04] [ 6.10544427e-05 -9.29593584e-06 -1.24769716e-04] [ 1.66223576e-04 1.04839906e-04 2.89800953e-07] [ 3.45496661e-05 4.65657378e-05 -7.78585449e-05] [ 2.57008249e-04 -1.10114508e-04 1.20852443e-05] [ 7.73049754e-05 -1.12841940e-04 -9.56849772e-06] [ 1.32718500e-04 1.18059742e-05 3.10142836e-05] [ 1.26615722e-04 4.23746347e-05 -5.71772431e-06] [ 1.73189372e-05 2.43564117e-04 -5.75582728e-05] [ 4.75207459e-05 2.20655748e-04 5.87543478e-05] [ 2.41020769e-04 5.28101216e-05 5.12305879e-05] [ 3.08745722e-04 7.15775188e-05 -3.84486992e-05] [-7.48588122e-05 -2.01698241e-05 -1.52953133e-04] [ 3.85180668e-05 -1.06433146e-04 1.36775292e-04] [ 3.78041016e-06 7.78967800e-05 7.11352212e-05] [-1.02371483e-04 7.85347724e-05 -3.77888155e-05] [ 1.59356124e-04 8.47745182e-05 8.16296985e-06] [ 2.40760599e-04 1.66181735e-04 -3.87963519e-05] [ 1.21278705e-04 -2.27815471e-05 2.05231257e-04] [ 1.06122561e-04 -2.10748572e-05 -8.25397072e-05]] Final stress: [-1.74697319e-06 -2.03547099e-06 -2.99020106e-06 1.84220918e-04 -1.53683100e-04 -5.79795265e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 69 steps. Final forces: [[ 2.33447150e-03 5.82614843e-03 -1.20559615e-03] [ 4.18503747e-03 -1.19700250e-03 1.58455792e-03] [-1.68828585e-03 -7.32310449e-04 -2.73236334e-03] [-2.29679787e-03 -7.69639887e-05 1.83821746e-03] [ 9.86635190e-04 -1.46020833e-03 -2.17788557e-04] [-1.51598583e-03 -1.55461563e-03 -1.25779838e-03] [-3.64403272e-03 1.54296475e-03 -1.03398664e-03] [ 5.24004806e-04 -4.66740166e-03 -5.36393519e-03] [ 5.01068659e-04 -9.52864764e-05 8.91721235e-04] [ 6.31978729e-04 -9.47687626e-04 9.97506723e-04] [-4.87542909e-03 9.12100559e-04 -7.17910218e-04] [-6.58349575e-03 1.73947789e-03 9.87015076e-05] [-1.88328774e-03 1.72312585e-03 -1.29027058e-03] [-1.72868146e-03 1.95600769e-03 -3.80383542e-03] [-2.66712762e-03 -5.20768025e-03 4.51664203e-04] [-2.27820087e-04 -4.43013947e-04 -3.69667036e-03] [-1.94774538e-03 -1.95539292e-03 -1.51134892e-03] [-2.07902177e-03 -1.86353958e-03 -8.01482539e-04] [ 1.82108842e-03 -4.40725755e-05 3.51343763e-03] [ 2.09269773e-03 -9.55551943e-04 -3.60621158e-04] [-7.11127357e-04 -1.93688260e-04 -3.25455925e-03] [-9.72296080e-04 4.56534529e-04 9.67308899e-04] [-1.10641694e-03 -3.75792589e-03 2.99700209e-03] [ 2.72907843e-03 3.33495363e-03 -3.47582151e-03] [ 2.69058006e-03 -2.28318654e-03 9.52828870e-03] [ 2.98847210e-03 6.75325337e-03 -3.55593933e-04] [-2.85621348e-03 1.59097365e-04 5.36259854e-03] [ 3.18845837e-04 -5.53936395e-03 -2.86391996e-04] [ 2.06273884e-03 1.87330814e-03 -5.77384614e-05] [-1.78314689e-04 1.81305316e-03 -5.70548362e-04] [-2.08893711e-03 1.31453911e-03 -3.92576113e-03] [-2.47874450e-03 1.67779763e-03 3.91417703e-03] [ 1.82365999e-04 1.37132828e-04 1.63380574e-03] [ 2.53867574e-04 5.47946698e-04 -1.11749648e-03] [ 4.40395292e-04 1.30201231e-03 7.27853948e-04] [-8.63620154e-04 2.38217584e-03 -1.34495958e-03] [-1.12279389e-03 7.28399649e-05 2.48853512e-03] [ 2.11838186e-03 -2.07031525e-03 -4.75336590e-03] [-4.34549696e-03 2.42203865e-03 2.39141705e-03] [-1.99147218e-03 3.04892906e-03 -4.24164112e-03] [ 2.24794084e-04 -3.81079598e-03 -4.52596556e-03] [-1.55729925e-03 -4.00233579e-03 6.54922505e-03] [ 3.34144503e-03 -5.74800547e-04 -1.57354363e-03] [ 2.56986420e-03 1.14767611e-03 2.41134256e-03] [ 1.49401055e-03 3.57103380e-03 -1.45329531e-03] [ 2.62569548e-03 3.52035343e-03 3.01495072e-03] [ 2.32827114e-03 -6.71739630e-04 -1.49034351e-04] [ 1.03553909e-03 -2.67523565e-04 6.79272839e-04] [-6.56678022e-04 -9.41797222e-04 9.77372664e-03] [-2.78181445e-03 1.99368320e-04 -1.01479384e-02] [-2.81694525e-03 3.60054536e-03 -2.60900909e-03] [-5.09552535e-03 3.66334681e-03 3.43080299e-03] [-6.71618302e-04 -3.13741802e-03 1.37717357e-03] [ 2.85244559e-03 1.64848432e-04 1.24216859e-03] [ 5.81051367e-03 2.66212106e-03 -5.17918651e-04] [ 9.01068999e-04 -2.91931036e-03 1.20475121e-03] [ 1.06379055e-03 -8.04830379e-03 5.21380037e-03] [-3.49213617e-03 -4.47897845e-03 -1.05556288e-03] [ 2.09593363e-03 8.00013282e-04 -2.01280903e-03] [-1.57915047e-03 -1.23136377e-03 2.69703408e-03] [ 2.52026999e-03 2.94288960e-04 2.53726708e-03] [ 5.28548165e-03 -1.12183192e-03 -3.18652305e-03] [-8.52361000e-05 -3.48953342e-03 2.96440463e-03] [-7.68661686e-04 -5.20016468e-03 -3.20937221e-03] [-3.96681183e-04 1.11845115e-03 4.75898721e-03] [ 2.39656725e-03 -2.64936228e-04 -3.71913992e-03] [ 2.03688198e-03 -8.62032286e-04 1.08547268e-03] [ 9.71475270e-04 -1.06537027e-03 1.46846038e-03] [ 4.07118720e-03 8.45033347e-04 -3.88943957e-03] [ 5.11095246e-03 2.53900085e-03 1.91924164e-03] [ 5.12089071e-03 -5.13808648e-04 -1.60452088e-03] [ 8.10402674e-05 4.70652255e-03 1.33551525e-03] [ 2.83546195e-03 2.88261181e-03 -2.46067826e-03] [ 2.50388587e-03 3.70184977e-03 1.19090315e-03] [-4.84750837e-04 -3.54634944e-04 -2.32508860e-03] [-1.15956965e-03 -8.08728939e-05 6.64400011e-04] [ 1.81063709e-03 -1.81382926e-04 -3.78342381e-04] [ 2.97309716e-03 -3.03294473e-03 -3.23175329e-04] [-3.44700344e-03 2.83377005e-03 2.98526074e-03] [-5.10417564e-03 -8.51394324e-04 -3.71145462e-03] [ 3.44177368e-04 3.25045445e-03 2.07371111e-03] [ 8.53687985e-04 2.68445459e-03 -1.79349758e-03] [ 2.70454189e-04 1.78990253e-03 -1.30855541e-03] [ 3.90776663e-04 3.22493882e-03 1.57857304e-03] [-2.39596986e-03 -2.83357366e-03 -1.31715217e-04] [-6.64200507e-03 1.86635370e-03 2.05399731e-03] [ 2.06055491e-03 1.09820533e-03 -4.45541636e-04] [ 1.88996013e-03 8.15337715e-03 -1.12979677e-03] [-1.35235417e-03 -1.15950609e-03 -7.26908355e-04] [-1.58097470e-03 -2.28583704e-05 4.90028523e-04] [-7.24521030e-04 -1.50256261e-03 1.34474267e-03] [ 9.48051344e-05 -3.46585748e-03 -2.11114071e-03] [ 2.35150632e-03 5.14686666e-03 -1.44430797e-04] [-3.01070967e-03 -1.90895832e-03 1.16210168e-03] [ 1.63868488e-03 -1.46000051e-03 2.05604871e-03] [ 6.04187220e-04 9.54846698e-05 2.18003996e-03] [ 2.42325160e-03 -1.64716949e-03 -8.32299782e-04] [ 5.32741502e-04 -3.20165272e-03 2.44608556e-03] [-2.71041436e-03 -4.22415098e-03 -2.34963170e-03] [-3.09425984e-03 -5.96733821e-03 -1.65027538e-03] [ 5.22715869e-04 -9.82115503e-04 -2.47600639e-03] [-3.43881418e-03 3.96791568e-03 -1.94618709e-03]] Final stress: [-3.71936002e-05 2.80151840e-05 -7.03464123e-06 -1.80583351e-04 1.53792457e-04 -9.54659123e-05] Minimization converged after 183 steps. Minimization converged after 135 steps. Minimization converged after 138 steps. Minimization converged after 141 steps. Minimization converged after 136 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 142 steps. Minimization converged after 146 steps. Minimization converged after 142 steps. Minimization converged after 142 steps. Minimization converged after 111 steps. Minimization converged after 109 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 21 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 21 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 41 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 4.01523107e-03 5.24163864e-03 -2.76633047e-05] [-4.01523107e-03 -5.24163867e-03 -2.76632984e-05] [ 3.09998811e-03 3.33442867e-04 -2.10900034e-03] [-3.09998811e-03 -3.33442867e-04 -2.10900034e-03] [ 3.04942954e-03 1.43067941e-03 -2.80045523e-03] [-3.04942954e-03 -1.43067941e-03 -2.80045523e-03] [-5.13179413e-03 -1.15069137e-03 3.31589860e-04] [ 5.13179413e-03 1.15069137e-03 3.31589870e-04] [ 5.13775490e-04 7.60656506e-03 -4.04789955e-03] [-5.13775490e-04 -7.60656506e-03 -4.04789955e-03] [ 3.72145767e-04 -3.16482151e-03 -5.27168867e-04] [-3.72145767e-04 3.16482151e-03 -5.27168864e-04] [-3.86914724e-03 1.27754619e-03 -3.25708918e-04] [ 3.86914724e-03 -1.27754619e-03 -3.25708923e-04] [-6.72180866e-03 -4.38625018e-03 6.28023668e-03] [ 6.72180866e-03 4.38625019e-03 6.28023669e-03] [ 8.78011785e-04 3.26491939e-03 -3.98942240e-03] [-8.78011784e-04 -3.26491939e-03 -3.98942240e-03] [-8.73214771e-04 -2.58710301e-03 -3.76597207e-04] [ 8.73214770e-04 2.58710300e-03 -3.76597211e-04] [ 6.73170954e-03 -5.04385126e-03 5.04651377e-03] [-6.73170954e-03 5.04385126e-03 5.04651377e-03] [-5.98667354e-03 1.72819792e-03 6.88452414e-04] [ 5.98667354e-03 -1.72819792e-03 6.88452416e-04] [ 3.29264296e-04 -4.43412531e-03 2.63158665e-03] [-3.29264295e-04 4.43412532e-03 2.63158666e-03] [-1.37207254e-03 4.25333588e-03 -3.16953704e-03] [ 1.37207254e-03 -4.25333588e-03 -3.16953704e-03] [ 3.97126135e-03 7.23856284e-03 -2.55114437e-03] [-3.97126135e-03 -7.23856284e-03 -2.55114437e-03] [ 7.91370874e-04 -6.57155930e-03 3.84805986e-03] [-7.91370873e-04 6.57155930e-03 3.84805986e-03] [-5.83822295e-03 -1.58516807e-03 -1.03055275e-03] [ 5.83822295e-03 1.58516807e-03 -1.03055275e-03] [-5.95052674e-03 2.77648895e-03 1.72312449e-03] [ 5.95052674e-03 -2.77648894e-03 1.72312449e-03] [ 8.88455764e-04 4.48733095e-03 5.59566393e-03] [-8.88455766e-04 -4.48733095e-03 5.59566393e-03] [ 3.15080836e-04 1.03295339e-03 7.21941424e-03] [-3.15080832e-04 -1.03295339e-03 7.21941424e-03] [ 1.67390578e-04 -2.63895192e-03 -3.66928020e-03] [-1.67390581e-04 2.63895192e-03 -3.66928020e-03] [-5.33231761e-03 -1.12862468e-02 -1.77505616e-03] [ 5.33231761e-03 1.12862468e-02 -1.77505617e-03] [-1.78241077e-03 -2.91935446e-05 4.61777111e-03] [ 1.78241077e-03 2.91935461e-05 4.61777111e-03] [-4.61252271e-04 4.69744787e-03 4.97685089e-03] [ 4.61252270e-04 -4.69744788e-03 4.97685089e-03] [ 3.07077148e-04 1.25995635e-03 -4.59124064e-03] [-3.07077146e-04 -1.25995635e-03 -4.59124064e-03] [ 1.50371613e-04 -3.16775378e-04 -6.81389661e-03] [-1.50371613e-04 3.16775379e-04 -6.81389661e-03] [-3.02005496e-03 -1.94743086e-03 -2.50740307e-03] [ 3.02005496e-03 1.94743086e-03 -2.50740307e-03] [ 4.66729604e-04 -3.55537805e-03 8.22985704e-03] [-4.66729602e-04 3.55537805e-03 8.22985704e-03] [-5.02098333e-03 3.99360276e-04 3.58820895e-03] [ 5.02098333e-03 -3.99360271e-04 3.58820896e-03] [ 1.94837704e-03 3.27961876e-03 -8.73248471e-04] [-1.94837704e-03 -3.27961876e-03 -8.73248472e-04] [-8.15222038e-03 -3.68426014e-03 -1.44602479e-03] [ 8.15222038e-03 3.68426014e-03 -1.44602479e-03] [ 1.03437536e-03 2.82034843e-03 6.46153234e-03] [-1.03437537e-03 -2.82034843e-03 6.46153234e-03] [-3.80909786e-03 4.36094578e-03 -9.14431549e-03] [ 3.80909787e-03 -4.36094578e-03 -9.14431548e-03] [-1.47913239e-03 -2.24601733e-03 3.44927874e-03] [ 1.47913239e-03 2.24601733e-03 3.44927875e-03] [-3.66872874e-03 3.20119632e-04 -3.13548446e-03] [ 3.66872874e-03 -3.20119632e-04 -3.13548446e-03] [ 2.45941693e-03 3.08490898e-03 -4.01230522e-03] [-2.45941693e-03 -3.08490897e-03 -4.01230522e-03] [-8.98742246e-03 4.14411618e-03 -2.62869745e-03] [ 8.98742246e-03 -4.14411617e-03 -2.62869745e-03] [ 1.68833295e-04 -5.78841980e-04 -1.42418870e-03] [-1.68833295e-04 5.78841981e-04 -1.42418870e-03] [-3.02259807e-03 2.44639194e-03 3.08829616e-03] [ 3.02259807e-03 -2.44639194e-03 3.08829616e-03] [ 3.77181213e-03 1.49029940e-03 1.41027683e-03] [-3.77181213e-03 -1.49029940e-03 1.41027683e-03] [ 5.71612124e-04 3.62835961e-04 4.09365388e-04] [-5.71612124e-04 -3.62835963e-04 4.09365390e-04] [-6.40644604e-04 1.55164082e-03 -1.96420600e-03] [ 6.40644603e-04 -1.55164082e-03 -1.96420600e-03] [-4.51147844e-04 -4.12603908e-04 -3.60618265e-03] [ 4.51147844e-04 4.12603903e-04 -3.60618265e-03] [-2.28785256e-03 -3.79728719e-03 -3.24927827e-03] [ 2.28785256e-03 3.79728722e-03 -3.24927827e-03] [ 2.37905773e-03 6.24773082e-05 -2.06962489e-05] [-2.37905773e-03 -6.24773091e-05 -2.06962479e-05] [-7.57925918e-03 -1.19844867e-03 4.25468886e-04] [ 7.57925918e-03 1.19844867e-03 4.25468888e-04] [ 6.19181891e-04 1.25965841e-03 3.08611299e-03] [-6.19181891e-04 -1.25965841e-03 3.08611299e-03] [ 3.40442551e-03 -2.81079713e-03 -4.84163297e-03] [-3.40442551e-03 2.81079714e-03 -4.84163298e-03] [ 2.17697827e-03 2.96812492e-03 6.44694292e-04] [-2.17697827e-03 -2.96812492e-03 6.44694300e-04] [-1.92025671e-03 -8.64838141e-04 1.37666231e-03] [ 1.92025671e-03 8.64838138e-04 1.37666230e-03] [ 6.95637331e-03 -2.24917503e-03 1.52926952e-03] [-6.95637330e-03 2.24917502e-03 1.52926953e-03]] Final stress: [ 1.74618477e-04 1.71704031e-04 1.41082148e-04 2.83892780e-15 -4.06243877e-17 -1.37483407e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-3.21987123e-03 2.43356358e-03 -4.71291573e-04] [ 3.21987123e-03 -2.43356356e-03 -4.71291578e-04] [-3.05047073e-03 8.55137491e-04 -1.61413946e-03] [ 3.05047073e-03 -8.55137495e-04 -1.61413946e-03] [-2.10207143e-03 1.31690233e-03 -2.76853230e-03] [ 2.10207143e-03 -1.31690233e-03 -2.76853230e-03] [ 4.64928642e-03 -8.27095169e-04 -4.16964355e-04] [-4.64928641e-03 8.27095159e-04 -4.16964368e-04] [-4.87418528e-04 6.47068929e-03 -3.26178159e-03] [ 4.87418528e-04 -6.47068929e-03 -3.26178159e-03] [-9.58113694e-04 -2.71348890e-03 -1.21760547e-04] [ 9.58113694e-04 2.71348890e-03 -1.21760549e-04] [ 3.55799189e-03 1.27062851e-03 -5.76727234e-04] [-3.55799189e-03 -1.27062851e-03 -5.76727229e-04] [ 5.99104253e-03 -3.17970365e-03 5.58094142e-03] [-5.99104254e-03 3.17970365e-03 5.58094141e-03] [-7.60784800e-04 2.41524969e-03 -2.97810116e-03] [ 7.60784800e-04 -2.41524969e-03 -2.97810116e-03] [ 3.29420382e-04 -2.46089370e-03 1.32360342e-04] [-3.29420382e-04 2.46089370e-03 1.32360347e-04] [-5.61070392e-03 -4.30032719e-03 4.54995232e-03] [ 5.61070392e-03 4.30032719e-03 4.54995232e-03] [ 4.99139628e-03 -3.70903975e-06 3.28645700e-04] [-4.99139628e-03 3.70906332e-06 3.28645693e-04] [-1.57392378e-04 -3.48253121e-03 1.56389382e-03] [ 1.57392378e-04 3.48253120e-03 1.56389381e-03] [ 7.80792435e-04 3.88547682e-03 -3.25472319e-03] [-7.80792435e-04 -3.88547682e-03 -3.25472319e-03] [-2.93012932e-03 5.95459152e-03 -2.08703595e-03] [ 2.93012932e-03 -5.95459152e-03 -2.08703595e-03] [-6.26994076e-04 -5.39680964e-03 2.87858751e-03] [ 6.26994076e-04 5.39680964e-03 2.87858751e-03] [ 5.20549809e-03 -1.32090245e-03 -5.02018264e-04] [-5.20549809e-03 1.32090245e-03 -5.02018262e-04] [ 9.86721765e-04 -2.96860680e-03 4.46196586e-03] [-9.86721765e-04 2.96860680e-03 4.46196586e-03] [-4.55969609e-03 -2.28569594e-03 1.38380134e-03] [ 4.55969609e-03 2.28569594e-03 1.38380135e-03] [-5.10966598e-04 2.46665895e-03 -2.66862466e-03] [ 5.10966592e-04 -2.46665894e-03 -2.66862465e-03] [ 5.72332532e-04 -9.37372724e-04 5.75363954e-03] [-5.72332529e-04 9.37372728e-04 5.75363954e-03] [-1.43018359e-03 -9.18114542e-05 3.91855199e-03] [ 1.43018359e-03 9.18114531e-05 3.91855199e-03] [-4.13316296e-03 8.67532957e-03 -2.31641580e-03] [ 4.13316296e-03 -8.67532957e-03 -2.31641580e-03] [ 3.72645724e-04 -1.27739097e-03 -5.17331571e-03] [-3.72645725e-04 1.27739098e-03 -5.17331571e-03] [-6.96539893e-04 -3.33321747e-03 4.19793852e-03] [ 6.96539894e-04 3.33321747e-03 4.19793853e-03] [-2.33769579e-03 1.67253528e-03 -1.95557933e-03] [ 2.33769579e-03 -1.67253528e-03 -1.95557933e-03] [ 4.14295543e-04 8.12302001e-04 -5.30836500e-03] [-4.14295543e-04 -8.12302001e-04 -5.30836500e-03] [-4.10815849e-03 3.13051266e-04 3.13859853e-03] [ 4.10815849e-03 -3.13051271e-04 3.13859853e-03] [-1.65799332e-04 2.56247993e-03 6.55129387e-03] [ 1.65799334e-04 -2.56247993e-03 6.55129387e-03] [-6.73484673e-03 2.26460576e-03 -5.86224335e-04] [ 6.73484673e-03 -2.26460576e-03 -5.86224335e-04] [ 1.72820922e-03 -2.96686347e-03 -1.02327991e-03] [-1.72820922e-03 2.96686346e-03 -1.02327991e-03] [-2.96709872e-03 -4.38021700e-03 -6.69862723e-03] [ 2.96709873e-03 4.38021700e-03 -6.69862723e-03] [-5.11175957e-05 -1.27818526e-03 6.08657357e-03] [ 5.11175904e-05 1.27818526e-03 6.08657357e-03] [-2.63959846e-03 -5.37126052e-04 -2.52338111e-03] [ 2.63959846e-03 5.37126053e-04 -2.52338112e-03] [-8.90900268e-04 2.14447557e-03 2.47680516e-03] [ 8.90900268e-04 -2.14447557e-03 2.47680517e-03] [-8.68164489e-03 -2.58533916e-03 -1.51818445e-03] [ 8.68164489e-03 2.58533916e-03 -1.51818445e-03] [ 3.00455910e-03 -1.63945734e-03 -3.88930462e-03] [-3.00455910e-03 1.63945734e-03 -3.88930462e-03] [-2.05363742e-03 -1.48450567e-03 2.70900966e-03] [ 2.05363741e-03 1.48450567e-03 2.70900965e-03] [ 7.55458347e-04 5.62940524e-04 -1.88782592e-03] [-7.55458346e-04 -5.62940525e-04 -1.88782592e-03] [-2.79495356e-03 1.48288015e-03 8.80452578e-04] [ 2.79495356e-03 -1.48288014e-03 8.80452582e-04] [-8.93675901e-04 8.19852142e-04 3.40208596e-04] [ 8.93675901e-04 -8.19852140e-04 3.40208595e-04] [ 5.68648759e-04 1.70986254e-03 -2.16584740e-03] [-5.68648759e-04 -1.70986254e-03 -2.16584741e-03] [ 4.34975915e-04 -5.38881581e-04 -2.08184315e-03] [-4.34975915e-04 5.38881587e-04 -2.08184314e-03] [ 1.12604206e-03 -1.55173266e-04 -2.75774926e-03] [-1.12604206e-03 1.55173248e-04 -2.75774926e-03] [-1.56831521e-03 -5.93584537e-04 -5.39643818e-05] [ 1.56831521e-03 5.93584538e-04 -5.39643837e-05] [ 5.99462691e-03 -1.25663954e-03 8.95859129e-04] [-5.99462691e-03 1.25663954e-03 8.95859129e-04] [ 7.62059292e-05 1.44584255e-03 2.82639678e-03] [-7.62059283e-05 -1.44584257e-03 2.82639678e-03] [ 1.89677214e-03 -1.54155923e-03 5.52476193e-04] [-1.89677214e-03 1.54155923e-03 5.52476203e-04] [ 3.61427985e-03 2.86496637e-03 -3.72399045e-03] [-3.61427985e-03 -2.86496637e-03 -3.72399046e-03] [ 6.55316572e-03 2.45623469e-03 2.14242208e-03] [-6.55316572e-03 -2.45623470e-03 2.14242209e-03] [-1.49223672e-03 7.79111953e-04 1.03522382e-03] [ 1.49223672e-03 -7.79111954e-04 1.03522381e-03]] Final stress: [ 1.88777783e-04 1.56841439e-04 1.32967257e-04 -9.52283441e-16 9.27191907e-16 1.12721678e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 4.39487945e-03 2.85986358e-04 1.57303541e-04] [-4.39487945e-03 -2.85986374e-04 1.57303547e-04] [ 3.47520350e-03 3.75570923e-05 -1.47882581e-03] [-3.47520350e-03 -3.75570874e-05 -1.47882582e-03] [ 3.84119902e-03 -4.62394078e-03 3.65853726e-03] [-3.84119902e-03 4.62394079e-03 3.65853726e-03] [-4.85217352e-03 3.81494511e-03 -2.75427322e-03] [ 4.85217352e-03 -3.81494509e-03 -2.75427320e-03] [ 1.49270420e-03 -6.56522173e-03 4.55128202e-03] [-1.49270420e-03 6.56522173e-03 4.55128202e-03] [ 2.50101251e-04 4.61903113e-03 -1.01314017e-03] [-2.50101251e-04 -4.61903113e-03 -1.01314017e-03] [-3.50260907e-03 -2.27264378e-03 4.14166649e-05] [ 3.50260907e-03 2.27264377e-03 4.14166595e-05] [-8.15440134e-03 4.88989270e-03 -6.60369867e-03] [ 8.15440134e-03 -4.88989270e-03 -6.60369866e-03] [ 3.95030599e-04 -3.97117563e-03 3.53533680e-03] [-3.95030599e-04 3.97117563e-03 3.53533680e-03] [-3.75966626e-04 2.36445684e-03 2.81267557e-04] [ 3.75966627e-04 -2.36445685e-03 2.81267549e-04] [ 6.50335985e-03 4.02492361e-03 -7.34445079e-03] [-6.50335985e-03 -4.02492361e-03 -7.34445080e-03] [-4.76704361e-03 -1.83607719e-03 -1.75070322e-03] [ 4.76704361e-03 1.83607715e-03 -1.75070321e-03] [-6.88712883e-04 1.35035278e-03 1.43823854e-03] [ 6.88712881e-04 -1.35035277e-03 1.43823856e-03] [-4.55102518e-04 -5.86450131e-03 2.47910361e-03] [ 4.55102519e-04 5.86450132e-03 2.47910362e-03] [ 3.85694063e-03 -4.39309768e-03 2.36853065e-03] [-3.85694063e-03 4.39309768e-03 2.36853065e-03] [ 1.35595872e-04 5.49302274e-03 -4.56013860e-03] [-1.35595873e-04 -5.49302274e-03 -4.56013861e-03] [-5.73763072e-03 -1.33939243e-03 1.14883213e-03] [ 5.73763072e-03 1.33939243e-03 1.14883213e-03] [-5.59780659e-03 2.45122007e-03 -4.92517148e-03] [ 5.59780659e-03 -2.45122007e-03 -4.92517148e-03] [ 1.94393198e-03 5.24391919e-03 -2.39723805e-03] [-1.94393198e-03 -5.24391919e-03 -2.39723805e-03] [ 1.58403516e-03 -2.40479575e-03 3.17947373e-03] [-1.58403515e-03 2.40479575e-03 3.17947372e-03] [-1.01967080e-03 3.21208610e-03 -3.91173653e-03] [ 1.01967079e-03 -3.21208611e-03 -3.91173652e-03] [ 4.99311169e-04 -1.62642655e-03 -1.99430611e-03] [-4.99311169e-04 1.62642655e-03 -1.99430612e-03] [ 3.52829556e-03 -7.28403965e-03 5.83421881e-03] [-3.52829556e-03 7.28403965e-03 5.83421881e-03] [ 9.40512111e-04 1.66098102e-03 7.13300296e-03] [-9.40512108e-04 -1.66098103e-03 7.13300296e-03] [ 1.55565393e-03 2.13138540e-03 -3.18509603e-03] [-1.55565394e-03 -2.13138541e-03 -3.18509603e-03] [ 5.23519975e-04 -2.92409060e-04 2.72959427e-03] [-5.23519975e-04 2.92409060e-04 2.72959427e-03] [-2.69256774e-03 -2.10024498e-03 6.65371240e-03] [ 2.69256774e-03 2.10024498e-03 6.65371239e-03] [ 4.97859398e-03 -2.36913100e-04 -2.84768396e-03] [-4.97859398e-03 2.36913107e-04 -2.84768397e-03] [-3.28866677e-03 -2.20553431e-03 -7.98771145e-03] [ 3.28866677e-03 2.20553432e-03 -7.98771144e-03] [ 7.99250179e-03 -2.21410511e-03 -3.12670388e-04] [-7.99250179e-03 2.21410511e-03 -3.12670388e-04] [-2.66422470e-03 3.01804021e-03 5.32582356e-04] [ 2.66422470e-03 -3.01804021e-03 5.32582356e-04] [ 4.09308257e-03 7.46176441e-03 3.93572847e-03] [-4.09308257e-03 -7.46176441e-03 3.93572847e-03] [ 1.54274292e-03 1.62756228e-03 -8.14646367e-03] [-1.54274291e-03 -1.62756228e-03 -8.14646367e-03] [ 5.45423832e-03 1.17789274e-03 3.94306658e-03] [-5.45423832e-03 -1.17789273e-03 3.94306658e-03] [ 1.62724064e-03 -1.71135238e-03 -2.82727922e-03] [-1.62724063e-03 1.71135238e-03 -2.82727923e-03] [ 7.16559386e-03 4.51187848e-03 1.10907680e-03] [-7.16559386e-03 -4.51187847e-03 1.10907679e-03] [-4.63377486e-03 9.15823311e-04 4.30488958e-03] [ 4.63377486e-03 -9.15823306e-04 4.30488959e-03] [ 2.76270165e-03 1.92774686e-03 -3.45451646e-03] [-2.76270165e-03 -1.92774686e-03 -3.45451645e-03] [ 5.71191733e-04 -6.16007161e-04 1.10974231e-03] [-5.71191737e-04 6.16007162e-04 1.10974230e-03] [ 3.63341024e-03 -9.26879731e-04 7.93815940e-04] [-3.63341025e-03 9.26879725e-04 7.93815936e-04] [ 2.72487720e-03 2.02338325e-04 -1.77670404e-05] [-2.72487720e-03 -2.02338326e-04 -1.77670380e-05] [ 2.43785876e-04 -1.84841045e-03 1.61328010e-03] [-2.43785876e-04 1.84841045e-03 1.61328010e-03] [-1.60458754e-03 1.26223853e-03 1.42278824e-03] [ 1.60458754e-03 -1.26223855e-03 1.42278823e-03] [-4.84160864e-03 -1.01281841e-02 1.95350010e-03] [ 4.84160864e-03 1.01281841e-02 1.95350010e-03] [-1.10528539e-03 -1.22012371e-03 -6.30299207e-04] [ 1.10528539e-03 1.22012370e-03 -6.30299205e-04] [-7.11243632e-03 1.87797540e-03 2.55133469e-04] [ 7.11243633e-03 -1.87797540e-03 2.55133469e-04] [ 1.32765012e-03 2.62143977e-03 -2.56794642e-03] [-1.32765012e-03 -2.62143973e-03 -2.56794642e-03] [-2.58091854e-03 3.48791616e-03 7.08269544e-04] [ 2.58091854e-03 -3.48791616e-03 7.08269531e-04] [-3.92528640e-03 -3.58778403e-03 6.17551627e-03] [ 3.92528640e-03 3.58778403e-03 6.17551628e-03] [-7.18890594e-03 -2.69885231e-03 -2.18226029e-03] [ 7.18890594e-03 2.69885231e-03 -2.18226030e-03] [ 1.70789890e-03 6.31245660e-04 -1.53863900e-04] [-1.70789890e-03 -6.31245660e-04 -1.53863885e-04]] Final stress: [-2.68894001e-04 -1.08397209e-04 -1.40677864e-04 -3.19049978e-15 7.67441311e-16 -1.39711666e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-5.31792336e-03 -1.95358729e-03 -3.47587721e-04] [ 5.31792336e-03 1.95358730e-03 -3.47587724e-04] [-4.04071642e-03 4.53651229e-04 -1.71217424e-03] [ 4.04071642e-03 -4.53651234e-04 -1.71217423e-03] [-4.63940620e-03 -5.56613415e-03 4.15117081e-03] [ 4.63940620e-03 5.56613415e-03 4.15117081e-03] [ 5.54390503e-03 5.31653189e-03 -4.65888371e-03] [-5.54390503e-03 -5.31653189e-03 -4.65888371e-03] [-1.83327927e-03 -7.51719562e-03 5.57479631e-03] [ 1.83327927e-03 7.51719562e-03 5.57479631e-03] [-2.37248518e-05 5.58794024e-03 -1.51832234e-03] [ 2.37248512e-05 -5.58794025e-03 -1.51832234e-03] [ 4.17438558e-03 -2.77414655e-03 -1.29319210e-04] [-4.17438558e-03 2.77414655e-03 -1.29319208e-04] [ 9.62154289e-03 6.47474237e-03 -7.70524390e-03] [-9.62154289e-03 -6.47474237e-03 -7.70524390e-03] [-5.30700292e-04 -4.94062582e-03 4.20892886e-03] [ 5.30700293e-04 4.94062583e-03 4.20892886e-03] [ 4.93297777e-04 2.48755510e-03 2.57830991e-04] [-4.93297778e-04 -2.48755510e-03 2.57830993e-04] [-7.64895519e-03 4.52687094e-03 -8.61127172e-03] [ 7.64895519e-03 -4.52687094e-03 -8.61127172e-03] [ 5.45663075e-03 -4.32116129e-03 -2.70755781e-03] [-5.45663075e-03 4.32116131e-03 -2.70755782e-03] [ 8.23227053e-04 1.15048914e-03 1.69639393e-03] [-8.23227052e-04 -1.15048914e-03 1.69639392e-03] [ 6.43844266e-04 -6.42812728e-03 2.35662589e-03] [-6.43844266e-04 6.42812727e-03 2.35662588e-03] [-4.55044245e-03 -4.74596486e-03 2.49033345e-03] [ 4.55044245e-03 4.74596486e-03 2.49033345e-03] [-1.37012086e-04 6.39370631e-03 -5.60030503e-03] [ 1.37012087e-04 -6.39370631e-03 -5.60030503e-03] [ 6.66209486e-03 -1.45637500e-03 1.61746781e-03] [-6.66209486e-03 1.45637500e-03 1.61746781e-03] [ 2.08523924e-03 -6.22534763e-03 -3.02548256e-03] [-2.08523924e-03 6.22534763e-03 -3.02548256e-03] [-6.99323579e-03 -2.85838307e-03 -5.64738344e-03] [ 6.99323579e-03 2.85838307e-03 -5.64738344e-03] [-1.21671832e-03 -4.36112590e-03 -3.76814176e-03] [ 1.21671832e-03 4.36112590e-03 -3.76814175e-03] [ 1.91414932e-03 3.13773622e-03 4.44062212e-03] [-1.91414931e-03 -3.13773621e-03 4.44062212e-03] [ 4.06724498e-03 7.87913180e-03 7.25449922e-03] [-4.06724498e-03 -7.87913181e-03 7.25449922e-03] [ 5.30534649e-04 1.94091514e-03 -2.02604695e-03] [-5.30534648e-04 -1.94091514e-03 -2.02604695e-03] [ 1.94576181e-03 -2.75592058e-03 -4.25255576e-03] [-1.94576181e-03 2.75592059e-03 -4.25255577e-03] [ 1.37251375e-03 -1.41752574e-03 7.74819435e-03] [-1.37251375e-03 1.41752574e-03 7.74819436e-03] [-3.42972055e-03 2.63147753e-03 7.70626400e-03] [ 3.42972055e-03 -2.63147753e-03 7.70626400e-03] [ 3.06790609e-04 9.74176508e-05 3.33608916e-03] [-3.06790609e-04 -9.74176539e-05 3.33608917e-03] [-3.94499286e-03 3.12415277e-03 -9.15477170e-03] [ 3.94499286e-03 -3.12415277e-03 -9.15477170e-03] [ 5.54864189e-03 -1.39282969e-04 -3.04586235e-03] [-5.54864189e-03 1.39282970e-04 -3.04586235e-03] [-3.11663226e-03 -3.66396257e-03 6.68253516e-04] [ 3.11663226e-03 3.66396257e-03 6.68253517e-04] [ 9.27504067e-03 2.49185850e-03 -5.20369646e-04] [-9.27504067e-03 -2.49185850e-03 -5.20369646e-04] [ 1.55980034e-03 -2.60787513e-03 -9.16136502e-03] [-1.55980034e-03 2.60787513e-03 -9.16136502e-03] [ 4.60840536e-03 -8.44935212e-03 4.74313482e-03] [-4.60840537e-03 8.44935212e-03 4.74313482e-03] [ 2.09863579e-03 2.07835098e-03 -3.30485180e-03] [-2.09863579e-03 -2.07835098e-03 -3.30485180e-03] [ 6.35730299e-03 -1.32538164e-03 4.55702344e-03] [-6.35730299e-03 1.32538164e-03 4.55702345e-03] [-5.35400741e-03 -1.04297790e-03 4.73166733e-03] [ 5.35400741e-03 1.04297790e-03 4.73166733e-03] [ 7.59717943e-03 -5.87087452e-03 1.35067363e-03] [-7.59717943e-03 5.87087452e-03 1.35067362e-03] [ 8.27985432e-04 6.75164419e-04 8.57027241e-04] [-8.27985432e-04 -6.75164418e-04 8.57027242e-04] [ 3.42143350e-03 -2.26647120e-03 -4.26486704e-03] [-3.42143350e-03 2.26647120e-03 -4.26486704e-03] [-4.50518609e-03 -1.01652825e-03 1.18746274e-03] [ 4.50518609e-03 1.01652825e-03 1.18746274e-03] [-3.36319347e-03 1.53332888e-04 5.67993434e-05] [ 3.36319347e-03 -1.53332887e-04 5.67993415e-05] [-3.27573343e-04 -2.10158783e-03 1.64338438e-03] [ 3.27573341e-04 2.10158783e-03 1.64338438e-03] [ 1.82545502e-03 1.01070907e-03 2.07754222e-03] [-1.82545502e-03 -1.01070907e-03 2.07754222e-03] [ 5.92767770e-03 -1.08170139e-02 2.23108254e-03] [-5.92767770e-03 1.08170139e-02 2.23108254e-03] [ 1.61735987e-03 -1.63928987e-03 -7.32549958e-04] [-1.61735987e-03 1.63928987e-03 -7.32549959e-04] [ 8.37887177e-03 2.28649340e-03 4.77528332e-04] [-8.37887177e-03 -2.28649340e-03 4.77528331e-04] [-1.38277649e-03 5.01674601e-03 -2.81194536e-03] [ 1.38277649e-03 -5.01674603e-03 -2.81194536e-03] [-4.62227235e-03 4.42031813e-03 8.02048311e-03] [ 4.62227235e-03 -4.42031813e-03 8.02048311e-03] [-3.26353108e-03 -4.70340455e-03 1.40008169e-03] [ 3.26353108e-03 4.70340455e-03 1.40008169e-03] [ 2.24567585e-03 -4.90862609e-04 6.68784224e-05] [-2.24567585e-03 4.90862606e-04 6.68784281e-05] [-8.15128294e-03 2.76185142e-03 -2.20138064e-03] [ 8.15128294e-03 -2.76185143e-03 -2.20138064e-03]] Final stress: [-2.89597040e-04 -9.85206724e-05 -1.44600804e-04 -1.22049467e-15 1.06389839e-15 1.65467035e-04] Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 53 steps. Minimization converged after 45 steps. Minimization converged after 51 steps. Minimization converged after 53 steps. Minimization converged after 111 steps. Minimization converged after 113 steps. Minimization converged after 112 steps. Minimization converged after 115 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 110 steps. Minimization converged after 114 steps. Minimization converged after 116 steps. Minimization converged after 118 steps. Minimization converged after 43 steps. Minimization converged after 40 steps. Minimization converged after 49 steps. Minimization converged after 50 steps. Minimization converged after 52 steps. Minimization converged after 53 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 2.64297074e-03 6.69299162e-03 2.52946121e-03] [-1.78703175e-03 4.65670895e-03 -5.34451407e-03] [ 3.87724315e-03 -6.83021502e-03 -2.54556673e-03] [-4.43998769e-03 -8.39734513e-03 -2.13253991e-03] [ 4.36318569e-03 -5.89581837e-03 -8.78426243e-03] [-5.77829427e-03 -1.71492797e-03 7.45173486e-03] [-2.08788540e-03 6.64230111e-03 -3.13201241e-03] [ 1.73617362e-03 2.55121376e-03 -1.74125050e-03] [ 1.96627942e-03 3.81142787e-03 8.66536957e-03] [-2.05682849e-03 2.94088789e-03 -8.29094404e-03] [ 4.04883570e-03 -1.94889017e-04 2.56084481e-03] [-3.91670330e-03 -2.48666094e-03 -4.07353740e-03] [-5.46257241e-03 7.66241319e-04 5.02014305e-03] [ 5.34260845e-03 1.67006098e-03 -6.13767000e-03] [-1.42147505e-02 -7.26410912e-03 -3.89560582e-03] [ 1.41077999e-02 -5.84000918e-03 4.75355046e-03] [ 3.00642455e-03 -4.00519688e-03 3.98892905e-03] [-2.20511081e-03 -2.34023257e-03 -5.86242599e-03] [-2.70676802e-04 -9.70171712e-04 -1.55015511e-04] [ 3.82498800e-04 -1.01360312e-03 4.19761014e-04] [ 5.92550469e-03 -8.63715644e-03 -5.37697437e-03] [-5.85639647e-03 -8.41783788e-03 3.64714410e-03] [-4.23840319e-03 -3.43073455e-03 -3.09716275e-03] [ 4.01923219e-03 5.81034961e-04 2.16440445e-03] [-3.12861725e-03 -2.82615548e-03 -4.69947813e-03] [ 3.33687497e-03 3.95501552e-03 8.55849535e-03] [ 1.01967232e-03 3.43330861e-03 -1.81137112e-03] [-9.67818409e-04 1.28093741e-03 -1.07069573e-03] [ 3.24209182e-03 1.25345835e-02 1.30898189e-02] [-1.48804067e-03 8.10766494e-03 -1.38035916e-02] [ 6.08696087e-03 -7.19741513e-03 1.80077834e-03] [-5.84225716e-03 -5.37887629e-03 -4.17640044e-03] [-6.63340871e-03 -4.07811487e-03 -1.81200506e-03] [ 6.68429076e-03 2.69053706e-04 2.36008524e-03] [-3.66812123e-03 1.01446377e-02 2.72779564e-03] [ 1.33363738e-02 3.77203269e-03 -1.10617752e-04] [-1.96379274e-03 1.07594753e-02 -1.80640293e-03] [-3.41107274e-03 6.85412230e-04 1.48419760e-03] [ 4.90414847e-03 7.37018065e-03 2.93221293e-03] [-4.17975221e-03 3.92120933e-03 -2.02179236e-03] [-4.83951916e-03 7.94425377e-03 -6.25195762e-04] [ 3.31059338e-03 2.79046101e-03 5.07505120e-03] [ 1.00300488e-03 -5.13184051e-04 -2.38709029e-03] [ 7.62865050e-03 7.46034442e-03 -8.66486522e-03] [-3.07202784e-03 4.93902099e-03 8.37140075e-03] [-6.61256555e-03 2.02178460e-03 1.46435348e-02] [ 4.56438605e-03 -1.88276608e-03 -4.40701923e-04] [ 3.92053843e-03 -3.34141749e-03 3.33941210e-03] [-3.27214452e-03 -3.03732521e-03 1.76421392e-03] [-6.46559556e-03 -2.30651022e-03 -1.92197726e-03] [ 5.15653238e-03 3.97083335e-03 4.76118136e-03] [ 5.02419851e-03 -2.48120496e-03 -3.69674370e-03] [-1.26374811e-02 1.88650089e-03 -4.96106503e-03] [ 3.88610608e-05 -1.17473511e-03 2.65751486e-03] [ 3.44731898e-03 4.60622314e-03 -6.31826309e-04] [ 1.34906003e-03 1.08537703e-02 -2.35593241e-03] [-5.43107326e-03 6.65806514e-03 1.29706905e-03] [ 2.01162337e-03 9.01276894e-03 3.18936439e-03] [ 1.53191155e-02 2.06565631e-04 -5.71415614e-03] [ 1.10525149e-03 -7.45987495e-03 -5.43074709e-03] [-1.59982870e-02 -1.11160195e-03 3.84103828e-03] [-7.87883659e-04 -5.87982314e-03 4.16142910e-03] [-6.56117881e-03 2.97825996e-03 2.71123229e-03] [ 3.26841082e-03 -9.47400292e-03 1.70310699e-04] [ 7.26357644e-03 3.05283274e-03 -5.83699233e-03] [-3.81493911e-03 -1.00899791e-02 -3.19635173e-03] [ 3.75840078e-03 3.28735336e-03 6.11940227e-03] [-9.57449928e-03 -3.59617570e-03 8.17197337e-04] [-3.02029532e-03 3.53509901e-03 -6.58551935e-03] [ 8.22556251e-03 -4.28746009e-03 -1.37290122e-03] [ 2.95257090e-03 8.99801686e-03 -3.62150996e-03] [-4.14862400e-03 -3.77673090e-03 -5.59128995e-03] [-6.76401350e-03 2.76225713e-03 3.22613352e-03] [ 6.99134927e-03 1.56844181e-04 5.87064698e-03] [ 3.13620294e-03 3.84048756e-03 -5.29114861e-03] [ 2.27857658e-04 -6.51512655e-04 -5.72438401e-05] [-2.69471284e-03 3.74909764e-03 5.02021924e-03] [-4.93788639e-04 -3.62438086e-04 -7.80551954e-05] [ 8.73350427e-03 -2.59976812e-03 1.17116295e-02] [-9.24233717e-03 -1.09889800e-03 -5.85728441e-03] [ 5.82836088e-03 4.42066206e-03 5.31439056e-03] [-6.39330002e-03 3.12640424e-03 -4.22807262e-03] [ 2.18531127e-03 -3.77276257e-03 -3.50116819e-03] [-2.12170012e-03 -3.11476925e-03 2.75691322e-03] [ 1.50129961e-03 -1.33816229e-03 -1.47329856e-03] [-1.37397491e-03 -4.43180846e-03 -3.05211461e-03] [-4.30944631e-03 -1.04350387e-02 1.59009755e-03] [ 5.85445083e-03 4.22646609e-03 -5.51681731e-03] [-6.28025455e-03 -8.80446627e-03 -5.09850570e-03] [ 6.02056796e-03 -6.49630862e-03 4.89553948e-03] [-6.46047715e-03 7.08565931e-03 5.31997234e-03] [ 5.86315146e-03 5.14066966e-03 -5.15155005e-03] [ 4.81804221e-03 -5.94781385e-04 -8.47286841e-03] [-3.33783358e-03 -8.59214959e-03 1.03154082e-02] [-1.38409643e-03 8.51888112e-03 -3.18885363e-04] [ 4.50316214e-03 -1.16490884e-03 -8.00904868e-03] [-8.08397440e-04 5.28535193e-03 2.75575410e-03] [-3.03470614e-03 2.03525799e-03 1.19066834e-02] [-3.73239610e-03 -8.51104827e-03 -2.82489197e-03] [ 2.03051548e-03 -6.30032115e-03 -1.40578752e-03] [ 2.72309869e-03 -6.82098605e-03 4.97237823e-03] [-1.52862931e-03 -8.67418326e-03 2.52359838e-03]] Final stress: [-8.26190326e-05 5.60633301e-05 7.96511581e-06 1.39214601e-04 2.32697640e-06 -2.09849282e-04] Minimization converged after 144 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.89390365e-03 -4.29279187e-03 -5.24746263e-03] [-2.69034768e-03 -6.28782832e-03 2.51786231e-03] [ 4.42531509e-03 8.30971910e-03 -2.08468213e-03] [-3.87566043e-03 6.78107897e-03 -2.43697849e-03] [ 5.70323172e-03 1.79181785e-03 7.38739085e-03] [-4.32472984e-03 5.85033135e-03 -8.66597955e-03] [-1.66047834e-03 -2.16125485e-03 -1.91128290e-03] [ 2.03310838e-03 -6.21505187e-03 -2.88076805e-03] [ 2.14232680e-03 -3.38518564e-03 -8.32625681e-03] [-2.04001599e-03 -4.20930643e-03 8.69276432e-03] [ 3.92276789e-03 2.30524190e-03 -3.85184904e-03] [-4.05558598e-03 1.02563729e-04 2.38424459e-03] [-5.30397145e-03 -1.56768862e-03 -6.09906942e-03] [ 5.41528978e-03 -6.95616466e-04 4.98141854e-03] [-1.41512278e-02 5.42994933e-03 4.52388408e-03] [ 1.42698725e-02 6.82587301e-03 -3.72765597e-03] [ 2.29178689e-03 2.30417095e-03 -5.72302372e-03] [-3.06052148e-03 3.91868655e-03 3.90362545e-03] [-3.30109102e-04 9.10639147e-04 6.23371069e-04] [ 2.25564700e-04 8.66927535e-04 -3.29118808e-04] [ 5.67000017e-03 8.75291565e-03 3.90396501e-03] [-5.73903006e-03 8.96320596e-03 -5.58996624e-03] [-3.84885411e-03 -3.88862606e-04 2.15806734e-03] [ 4.04361156e-03 3.48137830e-03 -3.04824784e-03] [-3.35755523e-03 -3.89228293e-03 8.11142504e-03] [ 3.13474442e-03 2.75924897e-03 -4.27853601e-03] [ 1.00388714e-03 -1.29639799e-03 -1.12210512e-03] [-1.06206145e-03 -3.38686623e-03 -1.62460325e-03] [ 1.50933864e-03 -8.02801765e-03 -1.35950509e-02] [-3.19053932e-03 -1.22944741e-02 1.29275671e-02] [ 5.74972388e-03 5.30715372e-03 -4.00829125e-03] [-5.99143302e-03 7.07639841e-03 1.71015356e-03] [-6.58287053e-03 -3.17368545e-04 2.23756702e-03] [ 6.52815316e-03 3.90878076e-03 -1.70205335e-03] [-1.32382149e-02 -3.73745463e-03 -1.77162482e-04] [ 3.49613583e-03 -1.00566271e-02 2.79685346e-03] [ 3.59438842e-03 -7.20808287e-04 1.51081884e-03] [ 1.96970829e-03 -1.06746267e-02 -1.91728405e-03] [ 4.41305001e-03 -3.81809315e-03 -2.09832941e-03] [-4.85199369e-03 -7.25997439e-03 2.85009161e-03] [-3.61843277e-03 -2.75023834e-03 5.03416598e-03] [ 4.77497590e-03 -7.82098322e-03 -6.01123176e-04] [-7.32806893e-03 -7.33876535e-03 -8.49910846e-03] [-1.03373254e-03 4.46663656e-04 -2.30267500e-03] [ 6.34327687e-03 -2.08179958e-03 1.42776584e-02] [ 3.02385457e-03 -4.81948428e-03 8.09356686e-03] [-3.82848171e-03 3.25800810e-03 3.51113611e-03] [-4.88865338e-03 1.99619146e-03 -5.96308945e-04] [ 6.28190201e-03 2.26815851e-03 -2.12353464e-03] [ 3.63072400e-03 3.11806781e-03 1.86427634e-03] [-4.99383506e-03 2.41636381e-03 -3.64720120e-03] [-5.24829984e-03 -3.93483700e-03 4.71335279e-03] [ 1.05381782e-04 1.14451531e-03 2.65551540e-03] [ 1.24828605e-02 -1.90824457e-03 -4.89921787e-03] [-1.33839726e-03 -1.08330934e-02 -2.44365116e-03] [-3.29686598e-03 -4.60142881e-03 -6.48042604e-04] [-1.87024177e-03 -9.07413603e-03 3.26067463e-03] [ 5.18581703e-03 -6.54257392e-03 1.30448379e-03] [-1.04988288e-03 7.28643425e-03 -5.27971299e-03] [-1.51015201e-02 -9.58437407e-05 -5.65244754e-03] [ 7.49592890e-04 5.73389439e-03 4.04372719e-03] [ 1.57596715e-02 1.20290960e-03 3.82651009e-03] [-3.13871785e-03 9.59309999e-03 -3.14790017e-04] [ 6.50222853e-03 -2.98443208e-03 2.50041568e-03] [ 3.67599166e-03 1.01535345e-02 -2.64180767e-03] [-7.18039179e-03 -3.03765808e-03 -5.52293515e-03] [ 9.59410862e-03 3.32745783e-03 6.18645448e-04] [-3.74863956e-03 -3.38908544e-03 6.24355751e-03] [-8.27444176e-03 3.99066289e-03 -1.15001586e-03] [ 3.01692078e-03 -3.62833839e-03 -6.68324007e-03] [ 3.68559852e-03 4.39300219e-03 -5.24238514e-03] [-2.65099151e-03 -8.75172769e-03 -3.58878927e-03] [-6.41313145e-03 5.95922084e-04 5.49947462e-03] [ 6.30639241e-03 -2.71981251e-03 3.18118762e-03] [-1.29444897e-04 7.58099222e-04 -2.03824892e-05] [-2.91750076e-03 -3.67726117e-03 -5.15708042e-03] [ 3.83491953e-04 4.86794904e-04 -1.32441680e-04] [ 2.45094524e-03 -3.58585817e-03 4.86637630e-03] [ 9.30274880e-03 7.42448966e-04 -5.71216652e-03] [-8.79908283e-03 2.16970700e-03 1.13717093e-02] [ 6.58566962e-03 -3.29008409e-03 -4.38621113e-03] [-6.02538714e-03 -4.54313076e-03 5.43490032e-03] [ 2.11883182e-03 3.19600069e-03 2.75773552e-03] [-2.17861117e-03 3.83213919e-03 -3.47069816e-03] [ 1.61615730e-03 4.38142645e-03 -2.94216813e-03] [-1.73516007e-03 1.43905899e-03 -1.39915330e-03] [-6.22184497e-03 -4.16890209e-03 -5.39507663e-03] [ 4.71506181e-03 1.00334531e-02 1.58130767e-03] [-6.15991877e-03 6.55146817e-03 5.05599852e-03] [ 6.42069262e-03 8.79116232e-03 -5.25795459e-03] [-5.71156761e-03 -4.94041177e-03 -5.02702369e-03] [ 6.28905507e-03 -6.82902669e-03 5.18614058e-03] [ 3.14970248e-03 8.01449810e-03 1.00803665e-02] [-4.53525298e-03 2.55312273e-04 -8.28598934e-03] [-4.41665150e-03 1.17765345e-03 -7.79710646e-03] [ 1.52208562e-03 -8.72440147e-03 -6.66822699e-04] [ 3.00672542e-03 -1.89507203e-03 1.15812221e-02] [ 5.65113958e-04 -5.62552051e-03 3.06505856e-03] [-2.04218247e-03 6.21924069e-03 -1.35916444e-03] [ 3.63068487e-03 8.38971505e-03 -2.79347972e-03] [ 1.57552381e-03 8.49927567e-03 2.40091483e-03] [-2.65716523e-03 6.77030768e-03 4.85451472e-03]] Final stress: [-8.03743588e-05 5.44621844e-05 7.46912522e-06 -1.39040025e-04 -2.25854484e-06 -2.04354269e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-9.97063513e-04 -3.84780304e-03 -3.16503643e-03] [ 1.34538835e-03 -3.95446241e-03 1.60493695e-03] [-2.91071332e-03 5.51804937e-03 -8.49229940e-04] [ 2.65932455e-03 4.57926438e-03 -1.05678263e-03] [-3.59470270e-03 1.55892203e-03 5.34270531e-03] [ 2.95171649e-03 3.36239530e-03 -5.88070254e-03] [ 1.30884665e-03 -2.38697565e-03 -1.89865079e-04] [-1.46581865e-03 -3.87914135e-03 -1.66910486e-03] [-1.32788909e-03 -2.19364039e-03 -5.77999008e-03] [ 1.24980469e-03 -2.38958901e-03 5.75775072e-03] [-2.96911719e-03 1.38509901e-03 -2.79580825e-03] [ 3.07337145e-03 3.41117349e-04 2.03865641e-03] [ 3.57802120e-03 -9.98767298e-04 -3.89710706e-03] [-3.65489062e-03 -5.43649678e-04 3.56994574e-03] [ 9.46457023e-03 4.40046828e-03 3.11783271e-03] [-9.55821700e-03 4.76720088e-03 -2.59977772e-03] [-1.50035497e-03 1.79485152e-03 -3.54406147e-03] [ 1.83147632e-03 2.44023473e-03 2.80164537e-03] [-5.30125328e-05 7.30176922e-04 1.20836043e-04] [ 1.00356714e-04 7.49033414e-04 -1.59212768e-04] [-3.73652510e-03 5.53580840e-03 2.70669373e-03] [ 3.85266330e-03 5.50240158e-03 -3.19458341e-03] [ 2.67960139e-03 -5.03732163e-04 1.24099281e-03] [-2.78051319e-03 1.91986226e-03 -1.69876929e-03] [ 2.33878622e-03 -1.71678203e-03 4.91943706e-03] [-2.21145506e-03 9.18759632e-04 -3.80501794e-03] [-6.39552434e-04 -1.26309410e-03 -4.59701024e-04] [ 7.13757651e-04 -2.25802932e-03 -1.01915441e-03] [-1.25783270e-03 -5.65107559e-03 -8.90069189e-03] [ 2.00846047e-03 -7.58553250e-03 8.78396268e-03] [-3.90216989e-03 3.59714853e-03 -2.52778865e-03] [ 3.99374988e-03 4.33445856e-03 1.26288638e-03] [ 4.27330767e-03 2.30292094e-04 1.59112955e-03] [-4.29837611e-03 2.13758752e-03 -1.32759151e-03] [-6.04360204e-04 -6.92203692e-03 -1.18147466e-03] [-3.22975464e-03 -6.59878913e-04 7.29125133e-04] [-1.70964651e-03 -6.65158097e-03 1.63641665e-03] [ 7.51291703e-03 -1.98480174e-03 1.20019822e-04] [-3.43875819e-03 -5.33546603e-03 -3.65680120e-04] [ 2.13852079e-03 -1.88548358e-03 3.14015640e-03] [ 3.53979067e-03 -4.86939958e-03 1.58776640e-03] [-2.72505834e-03 -2.56580679e-03 -1.56678668e-03] [-1.80815127e-03 -2.54838077e-03 4.86695867e-03] [-4.11168134e-03 -2.05126734e-03 8.88443353e-03] [ 9.07629217e-04 -1.35925583e-04 -2.31009201e-03] [ 4.57479346e-03 -4.43866456e-03 -6.34450886e-03] [-2.17095825e-03 1.71999757e-03 9.19587165e-04] [-3.85512748e-03 1.63163972e-03 -1.31987090e-03] [ 2.57244523e-03 1.38150795e-03 -5.37620686e-04] [ 2.91651031e-03 1.88002856e-03 1.71272090e-03] [-7.59088488e-03 -1.38601390e-03 -3.43394508e-03] [-4.37023887e-04 7.54064712e-04 1.86223115e-03] [ 4.36682396e-03 -2.29130540e-03 3.15404101e-03] [ 2.56298545e-03 1.30357518e-03 -2.39796123e-03] [-3.54125368e-03 -3.93855862e-03 1.01654056e-03] [ 8.06270553e-04 -5.82654881e-03 1.83353831e-03] [ 2.52590431e-03 -2.95466990e-03 -8.67015488e-04] [ 6.61036896e-04 -6.76240129e-03 -1.57047106e-03] [-1.03847219e-02 6.16137700e-04 2.76154794e-03] [-2.94768750e-04 4.05035124e-03 2.93362283e-03] [ 1.00584298e-02 4.03739667e-05 -3.55922896e-03] [ 4.59539012e-04 4.77375831e-03 -3.44747291e-03] [ 4.74595988e-03 -2.12144354e-03 -3.26784742e-03] [-2.75934910e-03 6.57785384e-03 -1.51509804e-03] [-4.37284090e-03 -1.97224936e-03 2.02023597e-03] [ 2.51079657e-03 6.19344181e-03 3.08855196e-04] [-1.99508353e-03 -2.43077118e-03 -4.22147725e-03] [ 5.62200888e-03 2.87805536e-03 -1.08485547e-03] [ 2.32755470e-03 -2.25892153e-03 3.96987195e-03] [-6.20503865e-03 2.53339286e-03 8.12751758e-04] [-4.13518883e-03 -2.46812816e-03 2.01368305e-03] [ 4.47667725e-03 -1.04586945e-04 4.30830526e-03] [ 2.49291506e-03 -5.31495248e-03 -2.11479595e-03] [-3.12716147e-03 1.70240919e-03 -4.02823528e-03] [-1.81993117e-03 -2.54904680e-03 3.21306703e-03] [-1.85590426e-04 2.21373038e-04 1.56968103e-05] [ 2.07923835e-03 -2.66464898e-03 -3.36290874e-03] [ 3.38430790e-05 3.75316542e-04 -1.06552507e-04] [-5.98117795e-03 1.00950732e-03 -4.52380500e-03] [ 5.78432970e-03 1.88211701e-03 7.15304450e-03] [-4.41651460e-03 -2.17148988e-03 -2.88887447e-03] [ 4.18028357e-03 -2.71466500e-03 3.37293520e-03] [-1.46715815e-03 2.37071939e-03 1.97402318e-03] [ 1.50188189e-03 2.55888654e-03 -2.30229085e-03] [-1.21757433e-03 2.61264928e-03 -1.67018474e-03] [ 1.24204440e-03 1.03208528e-03 -4.34484681e-04] [ 3.19943916e-03 -4.90595926e-04 -3.05375811e-03] [-2.60124235e-03 5.15732908e-03 1.43282220e-03] [ 4.23610751e-03 4.56170573e-03 3.33635657e-03] [-4.30475558e-03 5.59013220e-03 -3.39234613e-03] [ 3.76023093e-03 -3.72014476e-03 -3.49723639e-03] [-4.02431529e-03 -4.46189852e-03 3.52177440e-03] [-2.31551868e-03 5.07124015e-03 6.47290962e-03] [ 3.03810461e-03 1.10130025e-03 -5.70211367e-03] [-5.02254403e-04 -3.60140918e-03 1.18555262e-03] [-2.07677681e-03 -8.85669792e-04 7.44774956e-03] [-5.33376205e-04 -5.13135142e-03 -3.43552968e-04] [ 2.71331217e-03 5.73206811e-04 -5.84788355e-03] [ 1.91820704e-03 4.62159452e-03 3.37229448e-03] [-1.07331509e-03 5.28606854e-03 1.76242926e-03] [-2.35359516e-03 5.32433650e-03 -2.07628088e-03] [ 1.33837742e-03 4.25315078e-03 -8.55788838e-04]] Final stress: [-3.60381157e-05 2.33325214e-05 -5.51823443e-07 -1.30125645e-04 1.31174096e-06 1.36343745e-04] Minimization converged after 50 steps. Minimization converged after 55 steps. Minimization converged after 143 steps. Minimization converged after 142 steps. Minimization converged after 144 steps. Minimization converged after 148 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 3.52478662e-03 -5.06244383e-03 -1.79772831e-03] [-3.52478662e-03 5.06244395e-03 -1.79772834e-03] [ 2.99900078e-03 1.01661292e-03 -1.71142409e-04] [-2.99900078e-03 -1.01661294e-03 -1.71142396e-04] [ 4.17143167e-03 -4.01227760e-04 -2.21477221e-04] [-4.17143167e-03 4.01227752e-04 -2.21477231e-04] [-6.89923209e-03 1.81634607e-03 -3.29284482e-03] [ 6.89923209e-03 -1.81634610e-03 -3.29284486e-03] [-2.15371802e-03 -1.19317506e-04 6.21606032e-04] [ 2.15371802e-03 1.19317505e-04 6.21606036e-04] [ 1.06378814e-03 4.17164948e-04 -1.00099863e-03] [-1.06378814e-03 -4.17164955e-04 -1.00099864e-03] [ 3.88203000e-04 -2.82979327e-04 -5.96712963e-04] [-3.88203001e-04 2.82979341e-04 -5.96712948e-04] [-7.23887259e-03 7.64389168e-04 -4.06700558e-04] [ 7.23887259e-03 -7.64389190e-04 -4.06700576e-04] [-1.24703609e-03 -4.09586477e-04 -4.85672262e-05] [ 1.24703609e-03 4.09586484e-04 -4.85672204e-05] [-1.21086985e-03 -7.69879278e-04 -1.50608920e-04] [ 1.21086985e-03 7.69879292e-04 -1.50608909e-04] [ 7.05372970e-03 -2.66585150e-05 4.28787796e-05] [-7.05372970e-03 2.66585122e-05 4.28787848e-05] [-1.17690510e-03 -6.60234808e-03 -1.36781431e-03] [ 1.17690510e-03 6.60234822e-03 -1.36781435e-03] [-1.15756558e-03 -1.05071399e-03 -5.15238488e-04] [ 1.15756559e-03 1.05071395e-03 -5.15238541e-04] [-2.62714441e-03 2.75835669e-03 -8.68626857e-04] [ 2.62714441e-03 -2.75835671e-03 -8.68626881e-04] [ 5.56287043e-03 1.12033651e-03 -5.48801605e-04] [-5.56287043e-03 -1.12033651e-03 -5.48801598e-04] [-2.84355070e-03 -1.04104096e-04 -1.03788891e-03] [ 2.84355070e-03 1.04104102e-04 -1.03788890e-03] [-5.50086178e-03 6.37289070e-05 6.99848880e-04] [ 5.50086178e-03 -6.37289281e-05 6.99848895e-04] [-5.15337872e-03 5.77925515e-03 7.28521233e-04] [ 5.15337872e-03 -5.77925515e-03 7.28521230e-04] [ 2.99331794e-03 6.29428485e-03 -2.93706958e-04] [-2.99331794e-03 -6.29428486e-03 -2.93706956e-04] [ 3.55644007e-03 -2.68168149e-03 7.55807233e-03] [-3.55644009e-03 2.68168151e-03 7.55807235e-03] [-2.86412090e-03 3.89417796e-04 -3.60524993e-03] [ 2.86412092e-03 -3.89417771e-04 -3.60524994e-03] [-2.42428620e-03 -4.07591482e-03 -4.04638916e-03] [ 2.42428619e-03 4.07591482e-03 -4.04638916e-03] [ 1.18006822e-03 -1.70563122e-03 5.63292491e-03] [-1.18006822e-03 1.70563122e-03 5.63292491e-03] [-2.59063191e-03 2.78832096e-03 4.00903889e-03] [ 2.59063191e-03 -2.78832093e-03 4.00903887e-03] [ 2.72959516e-03 4.68222381e-03 -6.51333195e-03] [-2.72959516e-03 -4.68222378e-03 -6.51333192e-03] [-1.89181977e-03 -2.36388582e-03 -3.91508742e-03] [ 1.89181977e-03 2.36388582e-03 -3.91508743e-03] [ 1.77941436e-04 -4.22941409e-03 3.93397035e-03] [-1.77941435e-04 4.22941409e-03 3.93397035e-03] [ 5.14645606e-03 -3.92639507e-03 1.30668582e-03] [-5.14645606e-03 3.92639506e-03 1.30668582e-03] [-4.60226120e-03 -6.24654405e-03 -7.01971579e-04] [ 4.60226120e-03 6.24654405e-03 -7.01971586e-04] [ 5.58237538e-03 1.89734012e-03 -4.78125366e-04] [-5.58237538e-03 -1.89734013e-03 -4.78125365e-04] [-6.63468071e-03 1.47267183e-03 2.24298097e-04] [ 6.63468071e-03 -1.47267184e-03 2.24298095e-04] [ 4.78918919e-03 2.51234546e-03 7.32598388e-03] [-4.78918917e-03 -2.51234544e-03 7.32598389e-03] [-5.29344649e-03 4.82583715e-03 -6.15138964e-03] [ 5.29344647e-03 -4.82583712e-03 -6.15138966e-03] [-8.66726344e-04 1.57362509e-03 1.68347584e-03] [ 8.66726346e-04 -1.57362509e-03 1.68347583e-03] [ 5.49645469e-04 1.53680962e-03 -2.35359230e-03] [-5.49645471e-04 -1.53680962e-03 -2.35359229e-03] [ 6.25143567e-03 4.49865865e-03 -4.71776644e-03] [-6.25143567e-03 -4.49865866e-03 -4.71776643e-03] [-7.61978862e-03 2.47191725e-03 4.93955126e-03] [ 7.61978862e-03 -2.47191726e-03 4.93955125e-03] [ 2.04458061e-04 9.73482751e-04 -4.27660726e-03] [-2.04458064e-04 -9.73482751e-04 -4.27660727e-03] [ 3.33826088e-04 1.01779265e-03 2.95438152e-03] [-3.33826087e-04 -1.01779265e-03 2.95438153e-03] [ 2.77060086e-03 -3.52667091e-04 1.13688054e-03] [-2.77060086e-03 3.52667109e-04 1.13688055e-03] [-2.81865789e-03 -4.35859332e-04 2.24681691e-04] [ 2.81865789e-03 4.35859334e-04 2.24681685e-04] [ 3.59123258e-03 -6.05387733e-04 -2.61059651e-04] [-3.59123258e-03 6.05387733e-04 -2.61059654e-04] [-2.60766378e-03 -9.33404636e-04 7.91210311e-04] [ 2.60766378e-03 9.33404654e-04 7.91210328e-04] [-2.78320277e-03 1.23969934e-03 -2.37418036e-04] [ 2.78320277e-03 -1.23969944e-03 -2.37418030e-04] [ 6.58671055e-03 -2.16203728e-04 1.16246302e-04] [-6.58671055e-03 2.16203729e-04 1.16246295e-04] [-8.51032493e-03 5.46470986e-04 -1.40605527e-04] [ 8.51032493e-03 -5.46470985e-04 -1.40605528e-04] [-1.92069017e-03 5.97706835e-03 4.25834868e-04] [ 1.92069017e-03 -5.97706846e-03 4.25834872e-04] [ 3.31429861e-03 -8.08196754e-04 -7.02416033e-04] [-3.31429860e-03 8.08196743e-04 -7.02415998e-04] [-4.48977908e-03 -3.05093962e-03 3.52290870e-03] [ 4.48977908e-03 3.05093960e-03 3.52290867e-03] [-5.99503098e-03 -4.50991163e-03 7.39637470e-04] [ 5.99503097e-03 4.50991161e-03 7.39637513e-04] [ 6.69833447e-03 -6.32282879e-03 1.80123085e-03] [-6.69833447e-03 6.32282878e-03 1.80123081e-03]] Final stress: [-3.40678777e-05 2.36834883e-05 -2.79385597e-08 -3.40487785e-15 -4.58923515e-15 -9.27816483e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-3.52998994e-03 -5.06564116e-03 -1.79929449e-03] [ 3.52998994e-03 5.06564129e-03 -1.79929452e-03] [-3.00094394e-03 1.01706289e-03 -1.72153187e-04] [ 3.00094394e-03 -1.01706290e-03 -1.72153175e-04] [-4.17257788e-03 -4.02350327e-04 -2.21689210e-04] [ 4.17257788e-03 4.02350322e-04 -2.21689218e-04] [ 6.90269932e-03 1.82038154e-03 -3.29848446e-03] [-6.90269932e-03 -1.82038157e-03 -3.29848450e-03] [ 2.15621724e-03 -1.19169819e-04 6.22870724e-04] [-2.15621724e-03 1.19169816e-04 6.22870729e-04] [-1.06848410e-03 4.17721811e-04 -1.00188103e-03] [ 1.06848410e-03 -4.17721819e-04 -1.00188104e-03] [-3.89765305e-04 -2.83041463e-04 -5.98302095e-04] [ 3.89765306e-04 2.83041473e-04 -5.98302084e-04] [ 7.23688417e-03 7.64694055e-04 -4.08357818e-04] [-7.23688418e-03 -7.64694087e-04 -4.08357840e-04] [ 1.24298919e-03 -4.10208363e-04 -4.89644558e-05] [-1.24298919e-03 4.10208369e-04 -4.89644509e-05] [ 1.21929748e-03 -7.70519794e-04 -1.49512861e-04] [-1.21929748e-03 7.70519809e-04 -1.49512854e-04] [-7.06028448e-03 -2.72271505e-05 4.19808645e-05] [ 7.06028448e-03 2.72271468e-05 4.19808680e-05] [ 1.18650744e-03 -6.60522528e-03 -1.36841113e-03] [-1.18650744e-03 6.60522535e-03 -1.36841115e-03] [ 1.15055354e-03 -1.05473949e-03 -5.11652519e-04] [-1.15055354e-03 1.05473946e-03 -5.11652552e-04] [ 2.62995255e-03 2.75980616e-03 -8.67868317e-04] [-2.62995255e-03 -2.75980617e-03 -8.67868328e-04] [-5.56263628e-03 1.12169342e-03 -5.49697599e-04] [ 5.56263628e-03 -1.12169341e-03 -5.49697590e-04] [ 2.84215140e-03 -1.04761798e-04 -1.03859696e-03] [-2.84215140e-03 1.04761802e-04 -1.03859695e-03] [ 5.50929831e-03 6.34542190e-05 7.00365096e-04] [-5.50929831e-03 -6.34542420e-05 7.00365109e-04] [ 2.98976622e-03 -6.29719674e-03 -2.88404390e-04] [-2.98976622e-03 6.29719674e-03 -2.88404392e-04] [-5.15418875e-03 -5.78058285e-03 7.23460481e-04] [ 5.15418875e-03 5.78058285e-03 7.23460483e-04] [-2.86149549e-03 -3.82046679e-04 -3.61195944e-03] [ 2.86149547e-03 3.82046692e-04 -3.61195943e-03] [ 3.55318848e-03 2.69051594e-03 7.56746499e-03] [-3.55318847e-03 -2.69051592e-03 7.56746499e-03] [ 1.18349987e-03 1.71287286e-03 5.63346248e-03] [-1.18349987e-03 -1.71287286e-03 5.63346248e-03] [-2.42851204e-03 4.08659363e-03 -4.04476000e-03] [ 2.42851204e-03 -4.08659364e-03 -4.04476000e-03] [ 2.72464831e-03 -4.68819985e-03 -6.51555446e-03] [-2.72464830e-03 4.68819987e-03 -6.51555448e-03] [-2.58432815e-03 -2.79381806e-03 4.01048162e-03] [ 2.58432814e-03 2.79381809e-03 4.01048164e-03] [ 1.78178430e-04 4.22691596e-03 3.94039021e-03] [-1.78178432e-04 -4.22691596e-03 3.94039021e-03] [-1.89483384e-03 2.35906210e-03 -3.92078157e-03] [ 1.89483384e-03 -2.35906210e-03 -3.92078156e-03] [-4.59882125e-03 6.24604174e-03 -7.00431495e-04] [ 4.59882125e-03 -6.24604174e-03 -7.00431489e-04] [ 5.14424301e-03 3.92306587e-03 1.30674976e-03] [-5.14424301e-03 -3.92306588e-03 1.30674975e-03] [-6.63846529e-03 -1.46896455e-03 2.19193425e-04] [ 6.63846529e-03 1.46896455e-03 2.19193427e-04] [ 5.58543764e-03 -1.89464721e-03 -4.73902360e-04] [-5.58543764e-03 1.89464720e-03 -4.73902362e-04] [-5.30269765e-03 -4.82590040e-03 -6.15924045e-03] [ 5.30269767e-03 4.82590042e-03 -6.15924044e-03] [ 4.79762246e-03 -2.51016648e-03 7.33373311e-03] [-4.79762248e-03 2.51016651e-03 7.33373309e-03] [ 5.50186883e-04 -1.53687177e-03 -2.35321127e-03] [-5.50186880e-04 1.53687177e-03 -2.35321127e-03] [-8.66448514e-04 -1.57403070e-03 1.68247008e-03] [ 8.66448511e-04 1.57403070e-03 1.68247009e-03] [-7.62726320e-03 -2.47782786e-03 4.93914773e-03] [ 7.62726320e-03 2.47782786e-03 4.93914774e-03] [ 6.25765762e-03 -4.50687812e-03 -4.71782341e-03] [-6.25765762e-03 4.50687812e-03 -4.71782341e-03] [ 3.33840757e-04 -1.02060806e-03 2.95805699e-03] [-3.33840757e-04 1.02060806e-03 2.95805698e-03] [ 2.05461017e-04 -9.76224930e-04 -4.28177603e-03] [-2.05461016e-04 9.76224931e-04 -4.28177602e-03] [-2.77256739e-03 -3.52263599e-04 1.13826127e-03] [ 2.77256739e-03 3.52263610e-04 1.13826128e-03] [ 2.83378144e-03 -4.35978733e-04 2.25265267e-04] [-2.83378144e-03 4.35978734e-04 2.25265261e-04] [-3.58957955e-03 -6.05835428e-04 -2.61291745e-04] [ 3.58957955e-03 6.05835427e-04 -2.61291746e-04] [ 2.60531706e-03 -9.35075774e-04 7.92342145e-04] [-2.60531706e-03 9.35075793e-04 7.92342162e-04] [ 2.79271519e-03 1.23776904e-03 -2.38359685e-04] [-2.79271519e-03 -1.23776914e-03 -2.38359679e-04] [-6.60480273e-03 -2.16857284e-04 1.16432435e-04] [ 6.60480273e-03 2.16857286e-04 1.16432429e-04] [ 8.52123577e-03 5.47426143e-04 -1.40749693e-04] [-8.52123577e-03 -5.47426141e-04 -1.40749695e-04] [ 1.92354718e-03 5.98121298e-03 4.26409459e-04] [-1.92354718e-03 -5.98121304e-03 4.26409463e-04] [-4.48948944e-03 3.05145891e-03 3.53025692e-03] [ 4.48948945e-03 -3.05145893e-03 3.53025695e-03] [ 3.31298982e-03 8.06810739e-04 -7.04407292e-04] [-3.31298983e-03 -8.06810754e-04 -7.04407325e-04] [ 6.70171376e-03 6.32596126e-03 1.79625477e-03] [-6.70171376e-03 -6.32596127e-03 1.79625480e-03] [-5.99740080e-03 4.51187313e-03 7.42469619e-04] [ 5.99740080e-03 -4.51187314e-03 7.42469590e-04]] Final stress: [-3.41181271e-05 2.37228721e-05 -2.23187659e-08 -1.26921035e-15 2.38305596e-15 9.28174911e-05] Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 18 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 16 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 31 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 3.00699851e-03 3.47062952e-03 -5.47697884e-04] [-3.00699851e-03 -3.47062951e-03 -5.47697884e-04] [ 2.24112199e-03 -5.92903278e-04 3.81108187e-04] [-2.24112199e-03 5.92903280e-04 3.81108187e-04] [ 2.10642540e-03 1.97091500e-03 -2.52908444e-03] [-2.10642540e-03 -1.97091500e-03 -2.52908444e-03] [-3.85068756e-03 -3.31619044e-03 3.59793746e-03] [ 3.85068756e-03 3.31619045e-03 3.59793747e-03] [ 4.02444410e-04 6.17754971e-03 -2.59367101e-03] [-4.02444409e-04 -6.17754971e-03 -2.59367102e-03] [ 4.89227182e-04 -1.93382294e-03 -3.89546377e-04] [-4.89227183e-04 1.93382294e-03 -3.89546378e-04] [-1.86266453e-03 1.75571383e-03 -1.18362803e-03] [ 1.86266452e-03 -1.75571384e-03 -1.18362803e-03] [-5.33942213e-03 -5.39633654e-03 7.07636041e-03] [ 5.33942213e-03 5.39633654e-03 7.07636041e-03] [ 3.72285119e-05 3.74523063e-03 -4.30145505e-03] [-3.72285127e-05 -3.74523063e-03 -4.30145505e-03] [ 6.63156033e-04 -1.83261620e-03 -7.87100514e-04] [-6.63156034e-04 1.83261620e-03 -7.87100518e-04] [ 4.09970295e-03 -2.91722790e-03 4.20270086e-03] [-4.09970295e-03 2.91722790e-03 4.20270086e-03] [-2.67332492e-03 -1.10025129e-03 1.81914992e-03] [ 2.67332492e-03 1.10025128e-03 1.81914992e-03] [-7.82066698e-05 -4.51234107e-03 9.77293248e-04] [ 7.82066686e-05 4.51234107e-03 9.77293253e-04] [-9.51978068e-04 5.63695005e-03 -3.71959594e-03] [ 9.51978066e-04 -5.63695006e-03 -3.71959593e-03] [ 3.57948254e-03 5.00089605e-03 -2.97736040e-04] [-3.57948254e-03 -5.00089605e-03 -2.97736042e-04] [-9.95449062e-04 -4.56637427e-03 1.74131874e-03] [ 9.95449062e-04 4.56637427e-03 1.74131874e-03] [-3.61497723e-03 -2.00450253e-04 -1.29886166e-03] [ 3.61497723e-03 2.00450251e-04 -1.29886166e-03] [-3.23628177e-03 3.60641280e-03 1.79715361e-03] [ 3.23628177e-03 -3.60641280e-03 1.79715361e-03] [ 1.17131448e-03 2.17836756e-03 4.01033485e-03] [-1.17131448e-03 -2.17836756e-03 4.01033485e-03] [ 1.92132857e-03 8.06981217e-04 4.62252792e-03] [-1.92132857e-03 -8.06981219e-04 4.62252791e-03] [-1.24930230e-03 -2.27550127e-03 -2.94252195e-03] [ 1.24930230e-03 2.27550127e-03 -2.94252195e-03] [-2.99342617e-03 -7.08630309e-03 -1.31769899e-03] [ 2.99342617e-03 7.08630309e-03 -1.31769899e-03] [-1.83240875e-03 9.89347043e-04 3.09833283e-03] [ 1.83240875e-03 -9.89347042e-04 3.09833283e-03] [-4.58309831e-04 2.05038022e-03 2.19068653e-03] [ 4.58309831e-04 -2.05038022e-03 2.19068653e-03] [-1.24445034e-03 6.83000047e-04 -4.49458305e-03] [ 1.24445034e-03 -6.83000046e-04 -4.49458306e-03] [-6.75739239e-04 -2.05900350e-03 -4.88017536e-03] [ 6.75739239e-04 2.05900350e-03 -4.88017536e-03] [-1.13883010e-03 -2.40267234e-04 -1.93170062e-03] [ 1.13883010e-03 2.40267235e-04 -1.93170062e-03] [ 3.23420132e-04 -2.53583619e-03 5.51627268e-03] [-3.23420126e-04 2.53583620e-03 5.51627268e-03] [-2.20327246e-03 -1.49530718e-03 3.48746464e-03] [ 2.20327246e-03 1.49530718e-03 3.48746464e-03] [ 8.24041654e-04 2.33273784e-03 -1.41478464e-03] [-8.24041655e-04 -2.33273784e-03 -1.41478464e-03] [-5.22452203e-03 -2.95387745e-03 -3.71264402e-04] [ 5.22452203e-03 2.95387745e-03 -3.71264402e-04] [-6.06800999e-04 -4.65345014e-04 4.67682826e-03] [ 6.06800998e-04 4.65345013e-04 4.67682826e-03] [-3.78142460e-03 4.12597260e-03 -2.59362864e-03] [ 3.78142460e-03 -4.12597260e-03 -2.59362864e-03] [-2.97942773e-03 -2.82180782e-04 2.47955692e-03] [ 2.97942772e-03 2.82180783e-04 2.47955692e-03] [-2.39763206e-03 1.03985384e-03 -3.52020937e-03] [ 2.39763206e-03 -1.03985384e-03 -3.52020937e-03] [ 1.23224405e-03 1.92746509e-03 -2.25448976e-03] [-1.23224405e-03 -1.92746509e-03 -2.25448976e-03] [-4.57909112e-03 4.73900986e-03 -1.30528026e-03] [ 4.57909112e-03 -4.73900986e-03 -1.30528025e-03] [-1.09845990e-03 -9.30876354e-04 3.00905697e-04] [ 1.09845991e-03 9.30876354e-04 3.00905701e-04] [-3.48954992e-03 1.66915759e-03 1.99361944e-03] [ 3.48954991e-03 -1.66915759e-03 1.99361944e-03] [ 3.33866232e-03 6.17346072e-04 1.00174920e-03] [-3.33866232e-03 -6.17346075e-04 1.00174920e-03] [ 1.94657145e-03 -4.58912560e-04 7.73052465e-04] [-1.94657145e-03 4.58912561e-04 7.73052464e-04] [ 4.55758921e-04 1.05189515e-03 -1.64816926e-03] [-4.55758921e-04 -1.05189515e-03 -1.64816926e-03] [-4.96251997e-04 1.13548591e-03 -3.52147187e-03] [ 4.96251996e-04 -1.13548591e-03 -3.52147187e-03] [-3.94746134e-03 2.61133785e-03 -3.06267228e-03] [ 3.94746134e-03 -2.61133786e-03 -3.06267228e-03] [ 5.06695068e-04 1.16041452e-03 -4.77586686e-04] [-5.06695068e-04 -1.16041452e-03 -4.77586685e-04] [-3.71199354e-03 -7.50363413e-04 -3.32026109e-04] [ 3.71199354e-03 7.50363414e-04 -3.32026108e-04] [-1.12643672e-04 4.92953759e-04 2.66064635e-03] [ 1.12643671e-04 -4.92953754e-04 2.66064635e-03] [ 2.90812822e-03 -1.09310398e-03 -4.63655745e-03] [-2.90812821e-03 1.09310397e-03 -4.63655746e-03] [ 1.49244087e-03 3.91111506e-03 -4.19541426e-04] [-1.49244087e-03 -3.91111506e-03 -4.19541423e-04] [-8.26474711e-04 3.46883561e-04 4.03105931e-04] [ 8.26474708e-04 -3.46883564e-04 4.03105926e-04] [ 5.39018086e-03 -1.97897257e-03 -3.53670919e-05] [-5.39018086e-03 1.97897257e-03 -3.53670880e-05]] Final stress: [ 1.23089320e-04 9.25838799e-05 7.38578157e-05 8.36457440e-16 -3.91940058e-15 -8.68955200e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.88700170e-03 6.72718969e-03 -7.73941907e-04] [ 4.88700170e-03 -6.72718971e-03 -7.73941888e-04] [-3.55120723e-03 -8.84154062e-04 3.49505581e-04] [ 3.55120722e-03 8.84154082e-04 3.49505567e-04] [-3.12227891e-03 2.71986495e-03 -3.67481029e-03] [ 3.12227890e-03 -2.71986495e-03 -3.67481028e-03] [ 6.14566410e-03 -4.77578148e-03 5.39550474e-03] [-6.14566410e-03 4.77578155e-03 5.39550482e-03] [-6.34008888e-04 9.43829570e-03 -4.11628586e-03] [ 6.34008887e-04 -9.43829570e-03 -4.11628587e-03] [-7.19000889e-04 -2.62872304e-03 -7.81928959e-04] [ 7.19000890e-04 2.62872304e-03 -7.81928953e-04] [ 2.42022848e-03 2.70116461e-03 -1.41908810e-03] [-2.42022848e-03 -2.70116462e-03 -1.41908813e-03] [ 8.83546056e-03 -8.26537244e-03 1.20057183e-02] [-8.83546056e-03 8.26537243e-03 1.20057183e-02] [ 1.24866508e-04 5.65004132e-03 -6.68910908e-03] [-1.24866508e-04 -5.65004134e-03 -6.68910909e-03] [-1.20483197e-03 -2.90526838e-03 -1.52539324e-03] [ 1.20483197e-03 2.90526837e-03 -1.52539327e-03] [-6.12904744e-03 -4.36291271e-03 6.51512133e-03] [ 6.12904744e-03 4.36291270e-03 6.51512133e-03] [ 4.20454533e-03 -2.19464191e-03 2.79784015e-03] [-4.20454533e-03 2.19464177e-03 2.79784019e-03] [-4.58531801e-05 -7.42939920e-03 1.43211085e-03] [ 4.58531859e-05 7.42939926e-03 1.43211093e-03] [ 8.52465252e-04 8.39269393e-03 -6.98371554e-03] [-8.52465252e-04 -8.39269390e-03 -6.98371550e-03] [-6.01051445e-03 8.18101882e-03 -4.49287115e-04] [ 6.01051445e-03 -8.18101883e-03 -4.49287123e-04] [ 1.81781812e-03 -7.25217536e-03 2.48710054e-03] [-1.81781811e-03 7.25217535e-03 2.48710052e-03] [ 5.56095027e-03 -7.20291737e-04 -2.00545099e-03] [-5.56095027e-03 7.20291746e-04 -2.00545100e-03] [ 1.17164152e-03 -3.40095567e-03 6.47750951e-03] [-1.17164153e-03 3.40095567e-03 6.47750952e-03] [-5.55338885e-03 -5.57704320e-03 2.78028587e-03] [ 5.55338885e-03 5.57704320e-03 2.78028586e-03] [-1.44950619e-03 3.21903810e-03 -3.88556229e-03] [ 1.44950623e-03 -3.21903813e-03 -3.88556232e-03] [ 2.82772153e-03 -1.18294659e-03 7.12689269e-03] [-2.82772156e-03 1.18294656e-03 7.12689271e-03] [-2.83213482e-03 -1.43735246e-03 4.94505946e-03] [ 2.83213482e-03 1.43735246e-03 4.94505945e-03] [-4.85830170e-03 1.14752423e-02 -1.25678894e-03] [ 4.85830170e-03 -1.14752423e-02 -1.25678894e-03] [-1.33047010e-03 -8.15830529e-04 -6.67961840e-03] [ 1.33047011e-03 8.15830513e-04 -6.67961838e-03] [-2.43411724e-04 -3.24312684e-03 3.49921106e-03] [ 2.43411714e-04 3.24312682e-03 3.49921104e-03] [-1.95749866e-03 3.26022154e-04 -3.09130497e-03] [ 1.95749865e-03 -3.26022156e-04 -3.09130496e-03] [-1.62007113e-03 3.19443358e-03 -7.65370907e-03] [ 1.62007113e-03 -3.19443358e-03 -7.65370908e-03] [-4.95813172e-03 1.37430796e-03 5.17939040e-03] [ 4.95813173e-03 -1.37430794e-03 5.17939038e-03] [ 6.01451651e-04 3.97328971e-03 8.66836781e-03] [-6.01451664e-04 -3.97328968e-03 8.66836783e-03] [-8.14079270e-03 4.99792851e-03 -9.71116183e-04] [ 8.14079269e-03 -4.99792850e-03 -9.71116185e-04] [ 1.16843086e-03 -3.14705078e-03 -2.14978320e-03] [-1.16843086e-03 3.14705079e-03 -2.14978320e-03] [-5.72577204e-03 -5.85745210e-03 -4.15568916e-03] [ 5.72577202e-03 5.85745209e-03 -4.15568916e-03] [-4.58309131e-04 6.46536384e-04 6.17109337e-03] [ 4.58309143e-04 -6.46536389e-04 6.17109337e-03] [-3.80181132e-03 -1.89073137e-03 -5.63842826e-03] [ 3.80181132e-03 1.89073137e-03 -5.63842824e-03] [-4.21893455e-03 4.77721856e-04 4.03423257e-03] [ 4.21893455e-03 -4.77721855e-04 4.03423255e-03] [-6.96738506e-03 -7.49337366e-03 -2.20520610e-03] [ 6.96738505e-03 7.49337368e-03 -2.20520611e-03] [ 9.51823374e-04 -4.07454718e-03 -3.37654730e-03] [-9.51823358e-04 4.07454720e-03 -3.37654728e-03] [-5.35015756e-03 -2.30073816e-03 3.06201054e-03] [ 5.35015757e-03 2.30073816e-03 3.06201056e-03] [-1.69729346e-03 1.41561345e-03 6.27954909e-04] [ 1.69729345e-03 -1.41561345e-03 6.27954885e-04] [-5.13287480e-03 6.19136991e-04 1.86410759e-03] [ 5.13287479e-03 -6.19137027e-04 1.86410756e-03] [-3.15391730e-03 -9.09340449e-04 1.26955164e-03] [ 3.15391730e-03 9.09340444e-04 1.26955164e-03] [-9.70026287e-04 1.83287138e-03 -2.96933706e-03] [ 9.70026288e-04 -1.83287137e-03 -2.96933706e-03] [ 1.01911958e-03 2.29299860e-03 -5.77718521e-03] [-1.01911958e-03 -2.29299864e-03 -5.77718525e-03] [ 6.74231108e-03 1.93850825e-03 -5.21634363e-03] [-6.74231108e-03 -1.93850823e-03 -5.21634363e-03] [-8.01760367e-04 1.91929052e-03 -7.72210375e-04] [ 8.01760367e-04 -1.91929052e-03 -7.72210369e-04] [ 5.61669257e-03 -1.08501763e-03 -2.78952369e-04] [-5.61669257e-03 1.08501764e-03 -2.78952371e-04] [-4.92079463e-04 1.68928100e-03 4.34068922e-03] [ 4.92079463e-04 -1.68928088e-03 4.34068921e-03] [ 2.27387775e-03 -6.44513734e-03 -5.75531114e-04] [-2.27387774e-03 6.44513734e-03 -5.75531161e-04] [ 4.34372218e-03 1.12165731e-03 -7.34174981e-03] [-4.34372219e-03 -1.12165732e-03 -7.34174976e-03] [ 8.21858552e-03 2.32537424e-03 4.57203746e-04] [-8.21858553e-03 -2.32537423e-03 4.57203684e-04] [-1.26939155e-03 -5.54953625e-04 9.27612591e-04] [ 1.26939155e-03 5.54953626e-04 9.27612648e-04]] Final stress: [ 1.08333992e-04 1.07781646e-04 8.41646803e-05 5.75004743e-15 -6.29732959e-15 1.36283218e-04] Minimization converged after 114 steps. Minimization converged after 113 steps. Minimization converged after 34 steps. Minimization converged after 31 steps. Minimization converged after 37 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 48 steps. Minimization converged after 108 steps. Minimization converged after 109 steps. Minimization converged after 108 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.58104607e-03 -4.78098623e-03 2.77929960e-04] [ 2.58104607e-03 4.78098623e-03 2.77929959e-04] [-3.00715447e-03 5.35641701e-03 -4.04671938e-04] [ 3.00715447e-03 -5.35641702e-03 -4.04671937e-04] [-9.99260106e-04 -3.69861158e-03 -1.78264884e-03] [ 9.99260106e-04 3.69861159e-03 -1.78264884e-03] [ 4.93655270e-03 -3.97508402e-03 -2.38339035e-03] [-4.93655270e-03 3.97508402e-03 -2.38339035e-03] [ 6.18144268e-04 2.41712380e-03 -1.85071703e-03] [-6.18144268e-04 -2.41712380e-03 -1.85071703e-03] [-1.24166033e-03 1.36406128e-03 1.95114649e-03] [ 1.24166033e-03 -1.36406128e-03 1.95114649e-03] [ 4.20080157e-03 6.93164695e-04 -4.04310559e-03] [-4.20080157e-03 -6.93164695e-04 -4.04310559e-03] [ 5.30009030e-03 1.90475474e-03 -6.75122124e-03] [-5.30009030e-03 -1.90475474e-03 -6.75122124e-03] [-1.09242894e-03 4.28945447e-03 -4.73535731e-03] [ 1.09242894e-03 -4.28945447e-03 -4.73535731e-03] [-7.47875128e-04 -1.92470539e-03 3.19974107e-03] [ 7.47875128e-04 1.92470539e-03 3.19974106e-03] [-7.41840655e-03 -3.89518060e-03 -2.17987320e-04] [ 7.41840655e-03 3.89518060e-03 -2.17987318e-04] [ 6.78029242e-03 -3.92542607e-04 -2.72213858e-04] [-6.78029242e-03 3.92542598e-04 -2.72213857e-04] [-2.53918454e-03 1.35045423e-03 -8.84141584e-04] [ 2.53918454e-03 -1.35045423e-03 -8.84141577e-04] [ 1.80112109e-03 3.17078341e-04 7.65101787e-03] [-1.80112109e-03 -3.17078338e-04 7.65101787e-03] [-3.52494183e-03 3.38006736e-03 -3.62701169e-03] [ 3.52494183e-03 -3.38006736e-03 -3.62701169e-03] [-1.31286872e-03 2.23201090e-03 1.90835268e-03] [ 1.31286872e-03 -2.23201090e-03 1.90835268e-03] [ 4.82326689e-03 -3.53498449e-03 5.33158829e-04] [-4.82326689e-03 3.53498449e-03 5.33158831e-04] [ 2.51481219e-04 -4.40374036e-03 1.94290699e-03] [-2.51481220e-04 4.40374036e-03 1.94290699e-03] [-5.28544745e-03 -7.35100414e-04 -9.22340541e-04] [ 5.28544745e-03 7.35100414e-04 -9.22340541e-04] [ 1.58581630e-03 1.11293699e-03 -2.92039250e-03] [-1.58581630e-03 -1.11293699e-03 -2.92039250e-03] [-1.99185126e-03 8.90461134e-04 8.05529109e-03] [ 1.99185126e-03 -8.90461134e-04 8.05529109e-03] [-5.75209790e-04 5.03015405e-03 4.08665243e-03] [ 5.75209791e-04 -5.03015404e-03 4.08665243e-03] [-3.55980288e-03 5.22326870e-03 -1.84677125e-03] [ 3.55980288e-03 -5.22326870e-03 -1.84677125e-03] [ 8.67853835e-04 -9.88606401e-04 -2.76135806e-03] [-8.67853834e-04 9.88606400e-04 -2.76135806e-03] [-6.56680930e-04 -5.13637351e-03 -7.65239876e-04] [ 6.56680929e-04 5.13637352e-03 -7.65239876e-04] [-3.01840568e-03 -8.25735195e-05 -3.43916222e-04] [ 3.01840568e-03 8.25735164e-05 -3.43916221e-04] [ 1.70680835e-03 8.25720016e-04 -1.48573642e-03] [-1.70680835e-03 -8.25720017e-04 -1.48573642e-03] [-2.19325399e-03 6.40895845e-04 -9.04943377e-04] [ 2.19325399e-03 -6.40895845e-04 -9.04943376e-04] [-1.20758281e-03 5.53703509e-04 2.88593748e-03] [ 1.20758281e-03 -5.53703510e-04 2.88593748e-03] [-3.71027801e-03 3.88472605e-03 -7.65800754e-04] [ 3.71027801e-03 -3.88472605e-03 -7.65800756e-04] [ 2.97992566e-03 -2.41551836e-03 -1.97562235e-03] [-2.97992566e-03 2.41551836e-03 -1.97562235e-03] [-2.80827968e-03 -4.20412569e-03 -1.04455078e-02] [ 2.80827968e-03 4.20412569e-03 -1.04455078e-02] [ 2.45472550e-03 5.03739622e-04 5.47817268e-03] [-2.45472550e-03 -5.03739623e-04 5.47817268e-03] [ 1.50148257e-04 -2.56938023e-03 -2.67284713e-03] [-1.50148258e-04 2.56938024e-03 -2.67284713e-03] [-4.40748497e-03 1.22145112e-03 3.76124091e-03] [ 4.40748497e-03 -1.22145112e-03 3.76124091e-03] [-9.70102500e-03 -1.75751768e-03 3.24834696e-04] [ 9.70102500e-03 1.75751768e-03 3.24834694e-04] [ 3.03619462e-03 -4.06703849e-03 9.63158288e-05] [-3.03619462e-03 4.06703849e-03 9.63158323e-05] [-3.89338984e-03 -4.52768419e-03 4.67362841e-03] [ 3.89338984e-03 4.52768419e-03 4.67362841e-03] [ 4.16313947e-03 8.48775591e-04 9.15642895e-04] [-4.16313947e-03 -8.48775591e-04 9.15642895e-04] [-2.37253175e-03 -7.92046727e-04 3.54362305e-05] [ 2.37253175e-03 7.92046726e-04 3.54362297e-05] [ 1.05804808e-03 -7.54929921e-03 6.85915353e-04] [-1.05804808e-03 7.54929921e-03 6.85915355e-04] [ 3.68924558e-04 -2.11570467e-03 -1.83729161e-03] [-3.68924555e-04 2.11570467e-03 -1.83729161e-03] [-1.40665068e-03 -1.11827441e-03 2.21299529e-03] [ 1.40665068e-03 1.11827441e-03 2.21299529e-03] [-1.93612743e-03 2.12668081e-03 -9.58306512e-04] [ 1.93612743e-03 -2.12668081e-03 -9.58306512e-04] [-3.37604703e-03 5.87002103e-03 -2.39610947e-03] [ 3.37604702e-03 -5.87002103e-03 -2.39610947e-03] [ 7.11824556e-03 -3.92826585e-03 2.97894541e-03] [-7.11824556e-03 3.92826585e-03 2.97894541e-03] [ 1.12265809e-03 3.45022785e-03 1.59355111e-03] [-1.12265809e-03 -3.45022785e-03 1.59355111e-03] [-1.78881902e-03 -2.13008054e-03 5.37553654e-03] [ 1.78881902e-03 2.13008054e-03 5.37553654e-03] [-1.67637982e-03 1.10943421e-03 -3.73100777e-04] [ 1.67637982e-03 -1.10943421e-03 -3.73100777e-04] [ 2.06212085e-03 1.28891782e-03 -6.74831161e-04] [-2.06212085e-03 -1.28891782e-03 -6.74831165e-04] [-4.41636037e-03 -3.83235673e-04 3.78232262e-04] [ 4.41636037e-03 3.83235672e-04 3.78232269e-04]] Final stress: [-1.07494505e-04 -8.63598044e-05 4.50817550e-06 -2.71927798e-15 2.48619701e-15 7.56516982e-05] Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 113 steps. Minimization converged after 115 steps. Minimization converged after 116 steps. Minimization converged after 117 steps. Minimization converged after 44 steps. Minimization converged after 37 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 49 steps. Minimization converged after 144 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.40345770e-03 3.69673637e-03 1.98009914e-03] [ 1.31517547e-03 3.16469476e-03 -2.32527666e-03] [-1.25695574e-03 -1.65499300e-03 -2.66597230e-04] [ 1.34522541e-03 -1.76275605e-03 -1.80099799e-04] [-2.01213840e-03 -7.28172829e-04 -1.69961251e-03] [ 2.17714880e-03 -3.28394131e-04 1.57474088e-03] [ 9.23694159e-04 -9.92945935e-04 3.15977937e-03] [-7.53930120e-04 -1.76414759e-03 -3.94226751e-03] [-6.25894388e-04 5.05109133e-04 1.46567045e-03] [ 6.46271103e-04 4.59035901e-04 -1.48211819e-03] [-1.31840400e-03 -6.54911583e-04 1.18762036e-03] [ 1.29783517e-03 -7.98598228e-04 -1.35910148e-03] [ 1.52440825e-03 1.07471745e-03 1.55957974e-04] [-1.49713557e-03 1.18777159e-03 -5.17905206e-04] [ 4.50812071e-03 -6.91343358e-04 8.40407140e-04] [-4.45455298e-03 -2.82281883e-04 -9.74368489e-04] [-1.75621080e-03 1.46542542e-04 9.78859170e-04] [ 1.68532283e-03 2.12070163e-04 -1.22318175e-03] [ 1.18901064e-03 1.92585896e-04 -1.17266223e-03] [-1.18455016e-03 1.86999864e-04 1.44932469e-03] [-1.93057012e-03 -2.07687528e-03 -1.80872990e-03] [ 1.87874906e-03 -2.05544467e-03 1.65261176e-03] [ 1.03950131e-03 -1.19399971e-03 -8.86346180e-04] [-1.04710533e-03 -1.06871108e-03 1.04049343e-03] [ 6.17143085e-04 -3.39507139e-03 1.89882291e-03] [-7.33695257e-04 -2.40991881e-03 -1.13907240e-03] [ 6.52688306e-04 1.65206134e-04 3.29746913e-04] [-6.71883668e-04 -1.77561438e-04 -2.41485037e-04] [-7.83979908e-04 3.41656627e-03 3.68234648e-03] [ 6.76279247e-04 3.07316858e-03 -3.47423443e-03] [-1.55395732e-03 -2.06418488e-03 6.51119223e-04] [ 1.48925333e-03 -1.90418987e-03 -9.74208746e-04] [ 2.46531666e-03 -2.05566898e-03 -5.72858136e-04] [-2.51774583e-03 -1.54096653e-03 5.46482413e-04] [ 1.80343229e-03 5.68408544e-04 6.38341062e-04] [-4.94883633e-04 3.66620592e-03 -1.29714112e-03] [-2.69691242e-03 9.79562387e-04 -4.22620122e-04] [ 9.41216028e-04 3.50197136e-03 1.40309641e-03] [-2.27190626e-03 1.26916142e-03 8.72307755e-05] [ 9.96123298e-04 1.26404049e-03 -1.76005756e-03] [ 2.09203920e-03 1.22797820e-03 4.96556192e-05] [-1.02198742e-03 1.20009353e-03 2.00555426e-03] [ 1.96880601e-03 3.70477043e-04 3.70456223e-03] [ 1.28325395e-03 8.18300222e-04 2.04094600e-03] [-2.01804349e-03 1.00072913e-03 -3.23442215e-03] [-1.14987849e-03 1.47720371e-04 -1.58374461e-03] [ 7.06603064e-04 -9.31653631e-04 -1.13424042e-03] [ 2.61186947e-03 -7.27119699e-04 -1.44533958e-04] [-4.99055541e-04 -1.10256937e-03 1.46007060e-03] [-2.68017683e-03 -4.81946426e-04 3.35662559e-04] [ 7.07116734e-04 -1.39040841e-05 2.01948752e-03] [ 2.64472406e-03 6.83678669e-04 -1.45462217e-03] [-1.11226350e-03 -1.92603953e-04 -2.08190676e-03] [-2.02929507e-03 9.82403818e-04 1.41911003e-03] [ 7.38868633e-05 2.62408727e-03 1.07583226e-03] [-1.16582445e-04 -1.99168043e-04 7.24175517e-04] [-6.71670890e-05 2.58668499e-03 -9.54541157e-04] [-1.79491848e-05 -1.40841337e-04 -5.75571109e-04] [ 1.67879173e-04 -1.90425419e-03 1.38080601e-03] [ 5.25680802e-03 2.56100448e-04 1.59459000e-03] [-1.55590240e-04 -2.23186703e-03 -1.41773762e-03] [-5.20197871e-03 5.31128755e-04 -1.70725411e-03] [ 6.57615452e-05 -3.01769379e-03 -1.03845486e-03] [ 4.01511218e-04 2.44421680e-03 -4.87168434e-04] [-5.15444458e-05 -3.02704029e-03 6.32812514e-04] [-3.48241241e-04 2.49167198e-03 1.21641572e-04] [-1.87321587e-03 -5.10813744e-04 1.42268076e-03] [ 1.24316569e-03 4.18681654e-04 -2.28081426e-03] [ 2.03108111e-03 -5.14031051e-04 -1.44562991e-03] [-1.33608281e-03 4.40116069e-04 2.28679045e-03] [ 1.50257754e-03 -3.95077574e-03 -2.58513760e-04] [ 1.11947806e-03 1.78644861e-03 1.29624368e-03] [-1.53050941e-03 -4.14118112e-03 2.71549529e-04] [-1.05535137e-03 2.23712704e-03 -1.36135909e-03] [ 1.64361842e-04 -7.46671232e-04 1.32584033e-03] [ 8.51081936e-05 8.52773499e-04 5.17180239e-04] [-9.85454816e-05 -7.25070564e-04 -1.48363158e-03] [-1.71571464e-04 8.05338671e-04 -7.00560946e-04] [-4.90825025e-03 1.84424961e-03 1.06432203e-03] [ 4.96239813e-03 1.79600482e-03 -5.76884153e-04] [-9.46826628e-04 1.42098906e-03 1.50702744e-03] [ 1.03776499e-03 1.25926699e-03 -1.35847573e-03] [-4.43461262e-04 -2.12294044e-04 -1.31935315e-03] [ 4.40689337e-04 -1.20476959e-04 1.28314495e-03] [-9.58970497e-04 1.12474584e-03 -2.71020100e-03] [ 9.80223582e-04 1.12667635e-03 2.42898489e-03] [ 3.41683832e-03 -3.28072874e-03 9.40667356e-04] [-3.62891320e-03 -1.63973380e-03 -1.36719934e-03] [ 5.00621730e-04 -1.75620201e-03 -8.74323577e-04] [-5.00567998e-04 -1.49866635e-03 8.19877931e-04] [ 2.18172262e-03 1.32810189e-03 1.64984723e-03] [-2.11872633e-03 1.11333989e-03 -1.72924932e-03] [ 4.81002317e-04 -4.96179359e-04 -2.81664105e-03] [-4.21135624e-04 -1.01249887e-03 3.04529729e-03] [ 5.69442085e-04 4.21526390e-04 1.83382069e-03] [-9.29290329e-04 3.78078338e-03 3.08230584e-03] [-5.80250792e-04 2.49862228e-04 -1.34245518e-03] [ 9.63478868e-04 3.95188330e-03 -2.61466317e-03] [ 1.48086813e-03 -1.31869859e-03 -2.06159570e-03] [-8.80265892e-04 -2.63657193e-03 2.30538814e-03] [-1.40475095e-03 -1.23478287e-03 1.82620981e-03] [ 9.09312466e-04 -2.68656525e-03 -2.35914285e-03]] Final stress: [-9.72139714e-06 5.25215375e-06 -6.67192034e-06 8.33426795e-05 -1.82623309e-07 6.60902539e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 1.66800215e-03 -2.63904336e-04 -2.81408929e-03] [-2.01793672e-03 -3.33825687e-03 1.80637788e-03] [ 3.05540153e-03 4.74281335e-03 -1.25196747e-03] [-2.78005606e-03 4.19955211e-03 -1.05309001e-03] [ 3.97501136e-03 1.03634857e-03 5.26241695e-03] [-3.32396353e-03 3.07696332e-03 -5.94533042e-03] [-1.47283230e-03 -6.55157112e-05 -2.91843420e-03] [ 1.77495953e-03 -2.27751465e-03 7.46371439e-04] [ 1.45742834e-03 -2.17229534e-03 -5.24441093e-03] [-1.41642557e-03 -2.57471685e-03 5.27406757e-03] [ 2.87037965e-03 1.17638779e-03 -2.87644440e-03] [-2.91025919e-03 2.44620978e-04 2.30706002e-03] [-3.33170563e-03 -1.58995789e-03 -3.62982174e-03] [ 3.38445763e-03 -1.07999423e-03 2.80070690e-03] [-1.00455492e-02 1.19653730e-03 9.57090132e-04] [ 1.01059392e-02 2.76651722e-03 -6.53713563e-04] [ 1.85610206e-03 1.03664442e-03 -3.33660668e-03] [-2.22412028e-03 1.68432013e-03 2.28627512e-03] [-4.22059164e-04 9.65027700e-04 1.71124546e-03] [ 3.73206173e-04 7.97932738e-04 -1.20270806e-03] [ 4.09934386e-03 5.33624826e-03 2.85886667e-03] [-4.12596195e-03 5.44515080e-03 -3.73403434e-03] [-2.54262114e-03 1.88559516e-03 1.88966958e-03] [ 2.59910298e-03 2.94467308e-03 -1.92988741e-03] [-1.87377409e-03 -3.49014429e-06 3.36243544e-03] [ 1.67946215e-03 3.65125952e-03 -1.07039917e-03] [ 4.83670493e-04 -5.66215625e-04 2.40318975e-04] [-4.97161984e-04 -1.73292360e-03 -1.17130096e-03] [ 1.46069244e-03 -5.68445931e-03 -8.85255245e-03] [-2.22337932e-03 -7.60020064e-03 9.03500322e-03] [ 3.38339224e-03 3.59553701e-03 -2.56591167e-03] [-3.51045608e-03 4.48385242e-03 1.38189965e-03] [-4.73765319e-03 2.94829876e-04 1.10756281e-03] [ 4.66768522e-03 2.70914210e-03 -1.08921948e-03] [-7.69518622e-03 -2.52451092e-03 -3.40486500e-04] [ 2.21612526e-03 -7.20166447e-03 2.22119594e-03] [ 2.98377798e-03 -8.51120201e-04 1.04496865e-03] [ 5.14695638e-04 -7.70498401e-03 -1.67511440e-03] [ 2.87857534e-03 -2.22587816e-03 -1.45077060e-03] [-3.35543745e-03 -4.57019407e-03 2.00056701e-03] [-2.76790113e-03 -1.95157908e-03 2.50724618e-03] [ 3.37737519e-03 -4.69044112e-03 -1.15249134e-03] [-4.47024349e-03 -4.58448432e-03 -6.27036150e-03] [-1.17353717e-03 7.43621830e-05 -2.42386454e-03] [ 4.11918029e-03 -1.81465665e-03 8.98398308e-03] [ 2.00350691e-03 -2.70135868e-03 5.13373556e-03] [-2.00396861e-03 2.81082140e-03 2.95885056e-03] [-3.70453883e-03 1.69998237e-03 -4.71292205e-04] [ 3.36727009e-03 1.93951830e-03 -1.75210762e-03] [ 2.93827892e-03 2.64520720e-03 1.53341542e-03] [-2.79155870e-03 1.08613900e-03 -3.22108788e-03] [-4.11934614e-03 -2.49113582e-03 3.60275593e-03] [ 4.99991407e-04 4.16124820e-04 2.75671019e-03] [ 7.51893292e-03 -1.44180221e-03 -3.65785959e-03] [-3.82172341e-04 -6.22556157e-03 -1.18412470e-03] [-3.10280684e-03 -2.05792542e-03 -9.71477581e-04] [-8.73369426e-04 -5.46464929e-03 1.61002812e-03] [ 3.59943479e-03 -2.87893741e-03 1.36446112e-03] [-2.92248219e-04 4.92247436e-03 -3.58854398e-03] [-1.06282109e-02 -1.18689794e-04 -3.72064104e-03] [ 2.61968517e-04 3.90268445e-03 3.04245938e-03] [ 1.08512949e-02 7.81780656e-04 2.89117709e-03] [-1.44270792e-03 7.27379839e-03 -5.28455977e-04] [ 2.89871378e-03 -2.78155173e-03 1.22270391e-03] [ 1.75272442e-03 7.13657304e-03 -1.31531865e-03] [-3.22699610e-03 -2.42528066e-03 -3.08029567e-03] [ 6.15185160e-03 2.25965763e-03 -1.76642925e-04] [-2.52558082e-03 -2.32952172e-03 4.70369082e-03] [-5.50942718e-03 2.48684288e-03 -9.89743366e-07] [ 2.17974856e-03 -2.36020560e-03 -4.80813214e-03] [ 1.04120036e-03 4.18920112e-03 -3.16011899e-03] [-3.54470611e-03 -4.47560285e-03 -2.44969543e-03] [-1.94009199e-03 2.60806672e-03 3.21021108e-03] [ 4.95805218e-03 -1.75964586e-03 2.21767221e-03] [ 4.53840201e-04 7.29511142e-04 -1.35528354e-03] [-1.18933781e-03 -2.16632288e-03 -2.52008459e-03] [-4.20635759e-04 6.78100107e-04 1.17179924e-03] [ 1.01777510e-03 -2.22257831e-03 2.26473745e-03] [ 7.18486730e-03 -6.73984010e-04 -3.32279315e-03] [-6.93155518e-03 -2.21334946e-04 6.02808732e-03] [ 4.23700059e-03 -2.21791261e-03 -2.82646010e-03] [-3.95721831e-03 -2.97129914e-03 3.41112816e-03] [ 1.57954620e-03 1.84332783e-03 2.60676913e-03] [-1.59712072e-03 2.22970483e-03 -2.96159550e-03] [ 1.08922221e-03 1.00437608e-03 2.92248441e-04] [-1.13603558e-03 -2.46426217e-04 -2.46090714e-03] [-5.51933922e-03 -3.04462837e-03 -3.64603698e-03] [ 4.71926277e-03 5.58333402e-03 1.55709992e-03] [-3.53931761e-03 4.15662344e-03 3.09400041e-03] [ 3.66879454e-03 5.34002099e-03 -3.32956947e-03] [-4.06093105e-03 -2.93898388e-03 -3.68960009e-03] [ 4.35369716e-03 -3.97510694e-03 3.69935866e-03] [ 1.61586608e-03 2.84078749e-03 6.86168152e-03] [-2.10753782e-03 -3.27920417e-04 -5.86738871e-03] [-2.06203161e-03 -4.89123271e-04 -5.02090319e-03] [ 1.27007632e-03 -6.88391000e-03 -1.53573494e-03] [ 1.60457147e-03 -1.72258191e-03 6.78437106e-03] [-5.94430335e-04 -5.71617977e-03 2.73706873e-03] [-2.14111429e-03 3.85738632e-03 -7.02146350e-06] [ 2.28839942e-03 5.25236745e-03 -2.94362600e-03] [ 1.99817801e-03 4.94120810e-03 7.27426506e-05] [-1.82547700e-03 4.43918333e-03 3.61250733e-03]] Final stress: [-4.17463334e-05 2.88148415e-05 -5.18765484e-06 -9.01016967e-05 -9.15566296e-07 -1.46301136e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-1.64130622e-03 -2.90859469e-04 -2.78168853e-03] [ 1.98656788e-03 -3.33107945e-03 1.79129803e-03] [-3.02729109e-03 4.70193396e-03 -1.22916228e-03] [ 2.75666664e-03 4.16239644e-03 -1.03351628e-03] [-3.93332552e-03 1.03256317e-03 5.21714874e-03] [ 3.29302930e-03 3.03681352e-03 -5.88792384e-03] [ 1.46988481e-03 -1.19649576e-04 -2.83297305e-03] [-1.76497993e-03 -2.27855571e-03 7.17405847e-04] [-1.43291541e-03 -2.11631513e-03 -5.18970151e-03] [ 1.39288766e-03 -2.50804054e-03 5.21206696e-03] [-2.85120860e-03 1.17068347e-03 -2.85730636e-03] [ 2.89089343e-03 2.55776011e-04 2.29967475e-03] [ 3.30432650e-03 -1.57284675e-03 -3.59249992e-03] [-3.35693799e-03 -1.06852186e-03 2.78415062e-03] [ 9.93857799e-03 1.23448991e-03 9.80657526e-04] [-9.99807932e-03 2.78324382e-03 -6.73072011e-04] [-1.83314144e-03 1.03888728e-03 -3.31072999e-03] [ 2.19481085e-03 1.67215776e-03 2.28014242e-03] [ 4.15487152e-04 9.61130240e-04 1.66839889e-03] [-3.67564341e-04 7.94781027e-04 -1.17240197e-03] [-4.07052223e-03 5.25529716e-03 2.81095295e-03] [ 4.09834297e-03 5.35969554e-03 -3.66437797e-03] [ 2.53490675e-03 1.85933105e-03 1.87276786e-03] [-2.59133918e-03 2.91757695e-03 -1.91266428e-03] [ 1.85168580e-03 -4.62743113e-06 3.35293429e-03] [-1.66174752e-03 3.57403662e-03 -1.11929374e-03] [-4.74926193e-04 -5.71660920e-04 2.44662289e-04] [ 4.88872152e-04 -1.72101571e-03 -1.16862101e-03] [-1.45093932e-03 -5.64664595e-03 -8.77601784e-03] [ 2.20082297e-03 -7.52754251e-03 8.96518713e-03] [-3.35768644e-03 3.57290965e-03 -2.54572625e-03] [ 3.48254724e-03 4.44424259e-03 1.37557750e-03] [ 4.69842836e-03 3.01836751e-04 1.10537892e-03] [-4.63066800e-03 2.67849046e-03 -1.08958782e-03] [-4.92036783e-04 -7.63077688e-03 -1.65011995e-03] [-2.96401620e-03 -8.45865998e-04 1.02868698e-03] [-2.18821058e-03 -7.13503393e-03 2.19004856e-03] [ 7.59225139e-03 -2.49055220e-03 -3.29468207e-04] [-3.35756062e-03 -4.65130417e-03 -1.14470574e-03] [ 2.71102181e-03 -1.93399392e-03 2.48195839e-03] [ 3.33852604e-03 -4.52905889e-03 1.97983348e-03] [-2.82686275e-03 -2.20837186e-03 -1.44038962e-03] [-1.98823507e-03 -2.66395346e-03 5.08146300e-03] [-4.09640879e-03 -1.80905874e-03 8.90225221e-03] [ 1.17329983e-03 6.52079359e-05 -2.42249690e-03] [ 4.44022689e-03 -4.53132322e-03 -6.23892985e-03] [-2.88390746e-03 2.60679426e-03 1.50435386e-03] [-3.34221494e-03 1.92663871e-03 -1.72254249e-03] [ 3.63560923e-03 1.67774736e-03 -4.59514038e-04] [ 2.00258110e-03 2.78277752e-03 2.90788781e-03] [-7.43427614e-03 -1.42837657e-03 -3.62425785e-03] [-4.98959215e-04 4.19458073e-04 2.72664245e-03] [ 4.09579451e-03 -2.45899646e-03 3.56512645e-03] [ 2.74800510e-03 1.07670598e-03 -3.18655438e-03] [-3.56917251e-03 -2.86333617e-03 1.34273270e-03] [ 8.59607888e-04 -5.40960557e-03 1.58839044e-03] [ 3.07719941e-03 -2.05148923e-03 -9.61827770e-04] [ 3.75513105e-04 -6.16205561e-03 -1.17433733e-03] [-1.07534760e-02 7.59002824e-04 2.86883686e-03] [-2.66398153e-04 3.87661654e-03 3.02061132e-03] [ 1.05347264e-02 -1.26613059e-04 -3.68273771e-03] [ 2.95980923e-04 4.88054867e-03 -3.55623606e-03] [ 3.20866052e-03 -2.39832937e-03 -3.06326775e-03] [-1.75381081e-03 7.05535317e-03 -1.33466366e-03] [-2.88120334e-03 -2.75236608e-03 1.23454146e-03] [ 1.44548791e-03 7.19313244e-03 -4.78917621e-04] [-2.15128865e-03 -2.32874627e-03 -4.74272416e-03] [ 5.44625514e-03 2.48767930e-03 -2.15598054e-05] [ 2.48999095e-03 -2.29747121e-03 4.63971267e-03] [-6.07651022e-03 2.26317169e-03 -1.52574192e-04] [-4.92866797e-03 -1.76709929e-03 2.20080697e-03] [ 1.97150096e-03 2.53012652e-03 3.20906231e-03] [ 3.54123210e-03 -4.43619388e-03 -2.42686752e-03] [-1.08704612e-03 4.08385196e-03 -3.15662051e-03] [-1.03600054e-03 -2.21874147e-03 2.25905384e-03] [ 4.09611806e-04 6.60530655e-04 1.16133934e-03] [ 1.20242490e-03 -2.16470051e-03 -2.50944368e-03] [-4.42511200e-04 7.12378100e-04 -1.34117365e-03] [-7.09992138e-03 -6.24748990e-04 -3.32307800e-03] [ 6.85207083e-03 -1.74275052e-04 5.98392303e-03] [-4.18032650e-03 -2.18160432e-03 -2.78463029e-03] [ 3.90588579e-03 -2.92377982e-03 3.36054152e-03] [-1.56506456e-03 1.82247223e-03 2.57686816e-03] [ 1.58272300e-03 2.19984561e-03 -2.92644396e-03] [-1.07088137e-03 9.95472573e-04 2.85663178e-04] [ 1.11670284e-03 -2.42384116e-04 -2.42429974e-03] [ 5.40736278e-03 -2.97057947e-03 -3.60447256e-03] [-4.62227664e-03 5.51868004e-03 1.55284796e-03] [ 3.49718223e-03 4.11452387e-03 3.04903390e-03] [-3.62307820e-03 5.27841461e-03 -3.28064962e-03] [ 4.03532803e-03 -2.93492227e-03 -3.65892075e-03] [-4.32308404e-03 -3.95116969e-03 3.66806944e-03] [-1.61286628e-03 2.83158581e-03 6.80337042e-03] [ 2.09950605e-03 -2.95965013e-04 -5.82650379e-03] [ 5.68443515e-04 -5.64195989e-03 2.65726674e-03] [-1.59322092e-03 -1.70704783e-03 6.73660328e-03] [-1.23280218e-03 -6.78877440e-03 -1.48981810e-03] [ 2.04009365e-03 -4.97256957e-04 -5.01244942e-03] [ 1.81752496e-03 4.40904438e-03 3.58013054e-03] [-1.97440510e-03 4.90359255e-03 8.92351611e-05] [-2.27232350e-03 5.20829273e-03 -2.91285815e-03] [ 2.11653343e-03 3.83732333e-03 -1.19796886e-05]] Final stress: [-4.10307480e-05 2.83039475e-05 -5.26462388e-06 -9.00159446e-05 9.04931343e-07 1.44901277e-04] Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 139 steps. Minimization converged after 146 steps. Minimization converged after 137 steps. Minimization converged after 140 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 3.20545822e-03 -9.74795133e-05 -5.86393033e-04] [-3.20545822e-03 9.74795538e-05 -5.86393043e-04] [ 2.93578374e-03 -2.72423529e-04 -7.27097037e-04] [-2.93578374e-03 2.72423522e-04 -7.27097032e-04] [ 3.72690679e-03 -5.07499360e-04 1.60289575e-04] [-3.72690679e-03 5.07499358e-04 1.60289571e-04] [-7.97115253e-03 3.06806690e-03 -3.52165616e-03] [ 7.97115253e-03 -3.06806691e-03 -3.52165617e-03] [-2.86278093e-03 4.02113588e-04 7.88864354e-04] [ 2.86278093e-03 -4.02113590e-04 7.88864356e-04] [ 9.16535249e-04 9.13047483e-05 -6.52240701e-04] [-9.16535249e-04 -9.13047516e-05 -6.52240703e-04] [ 1.12507218e-03 2.41015027e-04 -1.39174351e-03] [-1.12507218e-03 -2.41015024e-04 -1.39174351e-03] [-7.21385781e-03 -5.29887186e-04 -7.70227187e-04] [ 7.21385781e-03 5.29887177e-04 -7.70227196e-04] [-1.26378519e-03 -1.28132017e-04 -4.25330186e-04] [ 1.26378519e-03 1.28132018e-04 -4.25330183e-04] [-9.23779924e-04 -5.77331741e-04 1.03232703e-03] [ 9.23779924e-04 5.77331744e-04 1.03232703e-03] [ 6.47995329e-03 -1.75390040e-04 -8.40278538e-04] [-6.47995329e-03 1.75390038e-04 -8.40278537e-04] [-1.13866209e-03 5.30640121e-04 3.41448352e-04] [ 1.13866209e-03 -5.30640085e-04 3.41448342e-04] [-7.79161649e-04 -3.18027902e-03 3.31434185e-03] [ 7.79161649e-04 3.18027901e-03 3.31434184e-03] [-2.49135769e-03 9.90982751e-04 7.67974952e-04] [ 2.49135769e-03 -9.90982759e-04 7.67974951e-04] [ 6.54836766e-03 7.93605365e-04 -2.83560145e-04] [-6.54836765e-03 -7.93605363e-04 -2.83560143e-04] [-3.77969681e-03 -3.54853381e-04 -1.63592793e-04] [ 3.77969680e-03 3.54853384e-04 -1.63592792e-04] [-4.56743347e-03 -5.18056861e-04 -1.83518225e-05] [ 4.56743347e-03 5.18056857e-04 -1.83518153e-05] [-4.79409711e-03 5.25031252e-03 2.10265340e-04] [ 4.79409711e-03 -5.25031252e-03 2.10265339e-04] [ 2.85744062e-03 6.23469924e-03 -4.90805011e-04] [-2.85744062e-03 -6.23469924e-03 -4.90805011e-04] [ 1.97106400e-03 -1.10456105e-03 5.95892047e-03] [-1.97106401e-03 1.10456106e-03 5.95892047e-03] [-3.30504881e-03 -1.46473217e-03 -5.73056977e-03] [ 3.30504882e-03 1.46473218e-03 -5.73056978e-03] [-2.46106450e-03 -3.96141443e-03 -3.88772480e-03] [ 2.46106450e-03 3.96141443e-03 -3.88772480e-03] [ 1.54866661e-03 -1.98021111e-03 5.16220086e-03] [-1.54866661e-03 1.98021111e-03 5.16220086e-03] [-4.93212493e-03 4.29346895e-03 5.03963184e-03] [ 4.93212493e-03 -4.29346895e-03 5.03963183e-03] [ 4.67479674e-03 3.54503375e-03 -4.29339715e-03] [-4.67479675e-03 -3.54503374e-03 -4.29339714e-03] [-2.27578264e-03 -3.21230275e-03 -3.72608510e-03] [ 2.27578264e-03 3.21230275e-03 -3.72608510e-03] [ 1.19134005e-03 -4.59390266e-03 4.49212581e-03] [-1.19134005e-03 4.59390266e-03 4.49212581e-03] [ 5.44405778e-03 -4.18231164e-03 1.81866814e-03] [-5.44405777e-03 4.18231164e-03 1.81866814e-03] [-3.81441420e-03 -6.99441225e-03 -1.55358082e-04] [ 3.81441420e-03 6.99441225e-03 -1.55358083e-04] [ 5.32055721e-03 1.66159686e-03 -2.97247098e-04] [-5.32055721e-03 -1.66159686e-03 -2.97247098e-04] [-5.85726756e-03 7.72318529e-04 1.44778123e-04] [ 5.85726756e-03 -7.72318530e-04 1.44778122e-04] [ 4.79908339e-03 2.20280148e-03 7.03531971e-03] [-4.79908339e-03 -2.20280147e-03 7.03531972e-03] [-5.84823872e-03 2.85609044e-03 -7.56627316e-03] [ 5.84823872e-03 -2.85609043e-03 -7.56627316e-03] [-7.96217092e-04 1.55953487e-03 2.11839678e-03] [ 7.96217093e-04 -1.55953487e-03 2.11839678e-03] [ 1.45436028e-03 1.17955906e-03 -1.59212240e-03] [-1.45436028e-03 -1.17955906e-03 -1.59212240e-03] [ 6.35344120e-03 3.16396510e-03 -4.81608817e-03] [-6.35344121e-03 -3.16396510e-03 -4.81608817e-03] [-6.07396564e-03 3.94723833e-03 4.00229129e-03] [ 6.07396564e-03 -3.94723833e-03 4.00229129e-03] [ 1.92384558e-04 5.04745466e-04 -3.94753915e-03] [-1.92384558e-04 -5.04745467e-04 -3.94753915e-03] [ 3.96499433e-04 9.28732266e-04 2.50085103e-03] [-3.96499432e-04 -9.28732266e-04 2.50085103e-03] [ 2.89953902e-03 1.19156306e-03 -2.34545251e-04] [-2.89953902e-03 -1.19156306e-03 -2.34545247e-04] [-3.53300296e-03 -1.81287308e-04 2.05856450e-04] [ 3.53300296e-03 1.81287308e-04 2.05856448e-04] [ 3.79111908e-03 -5.07683793e-04 -1.18042735e-04] [-3.79111908e-03 5.07683793e-04 -1.18042734e-04] [-2.51158308e-03 -1.73640442e-03 1.22221268e-03] [ 2.51158308e-03 1.73640442e-03 1.22221268e-03] [-7.12334481e-04 -1.89422107e-03 -5.57160253e-04] [ 7.12334483e-04 1.89422104e-03 -5.57160251e-04] [ 7.32738974e-03 -5.34661572e-05 -1.70841839e-04] [-7.32738974e-03 5.34661572e-05 -1.70841841e-04] [-7.68656135e-03 5.32179410e-04 -1.58753868e-04] [ 7.68656135e-03 -5.32179409e-04 -1.58753869e-04] [-1.09234469e-03 8.44529422e-06 3.05417186e-04] [ 1.09234469e-03 -8.44532863e-06 3.05417185e-04] [ 4.60054557e-03 -1.90121145e-03 1.52244446e-05] [-4.60054557e-03 1.90121144e-03 1.52244549e-05] [-4.28103309e-03 -1.74962903e-03 3.28372120e-03] [ 4.28103309e-03 1.74962902e-03 3.28372119e-03] [-6.06327522e-03 -5.05345699e-03 -1.79571289e-03] [ 6.06327522e-03 5.05345699e-03 -1.79571288e-03] [ 6.86413563e-03 -6.10033663e-03 -1.00238961e-03] [-6.86413563e-03 6.10033663e-03 -1.00238962e-03]] Final stress: [-3.08458007e-05 2.04414304e-05 -4.31346692e-06 -2.05320441e-15 -2.06515555e-15 -9.49401978e-05] Minimization converged after 108 steps. Minimization converged after 32 steps. Minimization converged after 34 steps. Minimization converged after 15 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 14 steps. Minimization converged after 27 steps. Minimization converged after 31 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 43 steps. Minimization converged after 117 steps. Minimization converged after 116 steps. Minimization converged after 112 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.18885186e-03 -1.53427148e-03 -1.75866051e-03] [ 2.18885186e-03 1.53427149e-03 -1.75866052e-03] [-2.81969292e-03 -1.18333038e-03 7.35239835e-04] [ 2.81969292e-03 1.18333038e-03 7.35239837e-04] [-1.66166014e-03 -2.55623845e-03 5.10265356e-04] [ 1.66166014e-03 2.55623845e-03 5.10265357e-04] [ 5.79041418e-03 -1.49012087e-04 9.66705542e-04] [-5.79041418e-03 1.49012087e-04 9.66705538e-04] [ 3.47117333e-04 -8.69437748e-03 2.12104390e-03] [-3.47117332e-04 8.69437748e-03 2.12104390e-03] [-2.71348463e-04 3.55610940e-03 6.94545195e-04] [ 2.71348462e-04 -3.55610940e-03 6.94545199e-04] [ 2.46748770e-03 -2.79948440e-03 -1.50630429e-03] [-2.46748770e-03 2.79948439e-03 -1.50630429e-03] [ 2.70144455e-03 -1.97720869e-03 -8.40219407e-03] [-2.70144455e-03 1.97720868e-03 -8.40219407e-03] [ 1.81563821e-03 -1.99627430e-03 1.33999728e-03] [-1.81563821e-03 1.99627429e-03 1.33999728e-03] [-6.87776314e-04 4.90973180e-03 -8.77646970e-04] [ 6.87776315e-04 -4.90973180e-03 -8.77646972e-04] [-8.06831159e-03 6.71467779e-03 -4.38976779e-03] [ 8.06831159e-03 -6.71467779e-03 -4.38976779e-03] [ 7.64179591e-03 -3.84424947e-03 2.68711877e-05] [-7.64179591e-03 3.84424946e-03 2.68711870e-05] [-3.28271588e-03 -1.64761100e-03 3.13433227e-03] [ 3.28271588e-03 1.64761101e-03 3.13433228e-03] [-1.04466842e-05 1.45324023e-03 6.88449583e-03] [ 1.04466832e-05 -1.45324023e-03 6.88449584e-03] [-3.26137228e-03 -6.07554734e-03 1.92001818e-03] [ 3.26137228e-03 6.07554734e-03 1.92001818e-03] [ 1.28552430e-03 5.80620532e-03 -3.53465736e-03] [-1.28552430e-03 -5.80620532e-03 -3.53465736e-03] [ 5.79657657e-03 9.91576639e-04 7.21159245e-04] [-5.79657657e-03 -9.91576638e-04 7.21159245e-04] [ 1.40600922e-03 -3.85151985e-03 -8.80740208e-05] [-1.40600922e-03 3.85151985e-03 -8.80740189e-05] [-1.40537087e-03 -9.25087472e-04 -5.46507653e-03] [ 1.40537087e-03 9.25087470e-04 -5.46507653e-03] [ 2.90476452e-03 -2.70533848e-03 -3.54675302e-03] [-2.90476452e-03 2.70533848e-03 -3.54675303e-03] [-1.68618454e-03 2.70073290e-03 3.38168057e-03] [ 1.68618454e-03 -2.70073290e-03 3.38168057e-03] [ 5.04194270e-03 8.18639872e-03 4.82119848e-03] [-5.04194270e-03 -8.18639872e-03 4.82119848e-03] [ 1.26778893e-03 2.29896924e-03 -3.07874922e-03] [-1.26778893e-03 -2.29896924e-03 -3.07874922e-03] [ 4.33021634e-03 -4.01259286e-03 -3.00423887e-03] [-4.33021634e-03 4.01259286e-03 -3.00423887e-03] [-4.16153481e-05 -1.83002053e-03 3.99718144e-03] [ 4.16153482e-05 1.83002053e-03 3.99718144e-03] [-2.45413792e-03 1.57482488e-03 5.09832429e-03] [ 2.45413793e-03 -1.57482488e-03 5.09832429e-03] [ 8.44622851e-04 -1.93441857e-04 2.13412900e-03] [-8.44622852e-04 1.93441859e-04 2.13412900e-03] [-9.92849154e-04 -1.81140012e-03 -8.84417661e-03] [ 9.92849151e-04 1.81140013e-03 -8.84417661e-03] [ 1.01927671e-02 -3.17826132e-03 -1.13515533e-03] [-1.01927671e-02 3.17826132e-03 -1.13515533e-03] [ 3.19457015e-04 -3.22281227e-03 1.33196249e-03] [-3.19457018e-04 3.22281227e-03 1.33196250e-03] [ 6.76485805e-03 2.18335022e-03 7.03247643e-04] [-6.76485805e-03 -2.18335022e-03 7.03247644e-04] [-1.39658529e-03 -1.26530219e-03 -9.12385821e-03] [ 1.39658529e-03 1.26530220e-03 -9.12385820e-03] [ 1.60596321e-03 -1.22786376e-03 1.00326365e-02] [-1.60596321e-03 1.22786376e-03 1.00326365e-02] [ 3.34806310e-03 -1.39344103e-04 -5.20468110e-03] [-3.34806311e-03 1.39344101e-04 -5.20468110e-03] [ 1.56839208e-04 -2.24663216e-03 1.73272076e-03] [-1.56839206e-04 2.24663216e-03 1.73272076e-03] [-9.78881567e-03 7.66684078e-03 8.46874588e-03] [ 9.78881566e-03 -7.66684077e-03 8.46874587e-03] [ 1.75995852e-02 2.50758442e-04 1.84066554e-03] [-1.75995852e-02 -2.50758436e-04 1.84066554e-03] [-3.29317487e-03 7.51001593e-04 3.73411699e-03] [ 3.29317487e-03 -7.51001594e-04 3.73411700e-03] [ 3.22525018e-03 -1.23665762e-03 -2.68700748e-03] [-3.22525019e-03 1.23665762e-03 -2.68700748e-03] [ 1.52594300e-03 -2.23378873e-03 1.56759791e-03] [-1.52594300e-03 2.23378873e-03 1.56759790e-03] [ 1.62822419e-03 -3.70098117e-05 -1.28074646e-03] [-1.62822419e-03 3.70098107e-05 -1.28074646e-03] [ 4.29170373e-04 -3.87055498e-03 2.72607274e-03] [-4.29170371e-04 3.87055498e-03 2.72607273e-03] [ 6.15895779e-03 3.04915545e-03 -1.07871432e-03] [-6.15895779e-03 -3.04915545e-03 -1.07871432e-03] [-1.30853781e-03 -2.48795756e-03 6.15818485e-04] [ 1.30853781e-03 2.48795755e-03 6.15818481e-04] [-3.21251951e-03 -2.96228195e-04 1.37110886e-03] [ 3.21251951e-03 2.96228193e-04 1.37110886e-03] [ 7.36259983e-03 4.05498060e-03 -1.56450100e-03] [-7.36259983e-03 -4.05498060e-03 -1.56450101e-03] [-3.71863851e-03 2.72817788e-03 -1.95349625e-03] [ 3.71863851e-03 -2.72817787e-03 -1.95349625e-03] [-5.77735818e-03 7.87472847e-03 2.07214507e-03] [ 5.77735818e-03 -7.87472848e-03 2.07214506e-03] [-1.66846742e-03 -7.83800496e-04 1.90038232e-03] [ 1.66846742e-03 7.83800493e-04 1.90038231e-03] [ 2.25658027e-03 -1.98026628e-03 -3.33020050e-03] [-2.25658027e-03 1.98026627e-03 -3.33020051e-03] [-5.87657880e-03 -2.02792484e-04 -4.72974890e-03] [ 5.87657880e-03 2.02792477e-04 -4.72974889e-03]] Final stress: [-1.16306146e-04 -3.14804731e-05 -9.34386771e-05 6.09085017e-15 8.29483913e-16 1.13740760e-04] Minimization converged after 32 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 43 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 3.34787137e-04 -1.40479723e-05 -4.22741077e-04] [-3.34787138e-04 1.40479727e-05 -4.22741078e-04] [ 7.11508961e-04 -7.92369056e-04 2.52554072e-05] [-7.11508961e-04 7.92369058e-04 2.52554085e-05] [ 2.09058750e-04 4.32522801e-04 4.16912523e-04] [-2.09058751e-04 -4.32522801e-04 4.16912523e-04] [-1.21224834e-03 1.00924732e-03 2.75020402e-04] [ 1.21224834e-03 -1.00924732e-03 2.75020401e-04] [-7.35740344e-05 -5.31105645e-04 4.56651513e-04] [ 7.35740340e-05 5.31105644e-04 4.56651513e-04] [ 1.73942252e-04 7.14527327e-05 -8.24360699e-04] [-1.73942251e-04 -7.14527322e-05 -8.24360699e-04] [-9.18472193e-04 -1.34132321e-04 8.30806765e-04] [ 9.18472193e-04 1.34132321e-04 8.30806767e-04] [-1.07881218e-03 -1.10544311e-04 2.20856188e-03] [ 1.07881218e-03 1.10544311e-04 2.20856188e-03] [-8.72479304e-05 -9.74569413e-04 9.44246396e-04] [ 8.72479303e-05 9.74569413e-04 9.44246396e-04] [ 2.98594508e-04 2.90425357e-04 -8.82491769e-04] [-2.98594509e-04 -2.90425357e-04 -8.82491769e-04] [ 1.82438283e-03 6.63322055e-04 -2.19810043e-04] [-1.82438283e-03 -6.63322057e-04 -2.19810042e-04] [-1.68486282e-03 -4.32548791e-04 -1.34858814e-04] [ 1.68486282e-03 4.32548787e-04 -1.34858814e-04] [ 6.71022043e-04 -1.06417579e-03 7.81159325e-04] [-6.71022043e-04 1.06417579e-03 7.81159324e-04] [-4.43951412e-05 1.37722522e-04 -2.44068675e-03] [ 4.43951413e-05 -1.37722520e-04 -2.44068675e-03] [ 6.99861039e-04 -3.78172472e-04 9.08185519e-04] [-6.99861040e-04 3.78172470e-04 9.08185520e-04] [ 1.08922643e-04 -7.91478481e-04 -6.24374756e-04] [-1.08922642e-04 7.91478479e-04 -6.24374756e-04] [-1.11758971e-03 6.29238296e-04 1.05481033e-05] [ 1.11758971e-03 -6.29238295e-04 1.05481030e-05] [-3.11967231e-04 6.67433868e-04 -5.43171551e-04] [ 3.11967232e-04 -6.67433868e-04 -5.43171551e-04] [ 5.44020027e-04 4.96742693e-05 5.15009922e-04] [-5.44020028e-04 -4.96742695e-05 5.15009923e-04] [-7.84916490e-04 -1.58087877e-04 8.17082426e-04] [ 7.84916491e-04 1.58087876e-04 8.17082425e-04] [ 5.98153775e-04 -8.57145170e-05 -1.39541779e-03] [-5.98153775e-04 8.57145166e-05 -1.39541779e-03] [-3.93050244e-05 -1.72487248e-03 -8.24870457e-04] [ 3.93050242e-05 1.72487248e-03 -8.24870457e-04] [ 6.84105951e-04 -7.75555795e-04 9.23061431e-04] [-6.84105950e-04 7.75555795e-04 9.23061430e-04] [-7.04503167e-04 1.19616373e-04 9.27759884e-04] [ 7.04503167e-04 -1.19616373e-04 9.27759884e-04] [ 7.87312703e-05 1.29136924e-03 -2.37800533e-04] [-7.87312714e-05 -1.29136924e-03 -2.37800534e-04] [ 3.64228820e-04 -3.25315359e-05 -2.18726789e-05] [-3.64228820e-04 3.25315364e-05 -2.18726793e-05] [-8.34938225e-04 -3.91338567e-04 2.04921424e-04] [ 8.34938225e-04 3.91338567e-04 2.04921425e-04] [ 9.23785154e-04 4.08319385e-04 8.11489962e-04] [-9.23785155e-04 -4.08319385e-04 8.11489963e-04] [-5.68114432e-04 -6.85458297e-05 -4.49289340e-04] [ 5.68114433e-04 6.85458290e-05 -4.49289341e-04] [ 7.54089524e-04 -5.49205868e-04 -6.55496369e-05] [-7.54089524e-04 5.49205868e-04 -6.55496356e-05] [-7.30392401e-04 4.86213334e-04 5.06219943e-04] [ 7.30392401e-04 -4.86213334e-04 5.06219942e-04] [ 1.82676361e-04 3.54438533e-04 2.80386155e-03] [-1.82676362e-04 -3.54438534e-04 2.80386155e-03] [-9.78295559e-04 2.50931226e-04 -1.48102440e-03] [ 9.78295558e-04 -2.50931226e-04 -1.48102440e-03] [ 1.69029493e-04 6.03022530e-04 9.76001456e-04] [-1.69029494e-04 -6.03022528e-04 9.76001455e-04] [ 9.67475219e-04 -4.62538417e-04 -5.40782200e-04] [-9.67475218e-04 4.62538417e-04 -5.40782200e-04] [ 2.79391623e-03 -6.76711432e-04 -6.23135057e-04] [-2.79391623e-03 6.76711433e-04 -6.23135057e-04] [-1.96477892e-03 -2.91457210e-04 7.24843534e-05] [ 1.96477892e-03 2.91457211e-04 7.24843533e-05] [ 8.33055972e-04 6.45260426e-04 -1.65915525e-03] [-8.33055973e-04 -6.45260426e-04 -1.65915525e-03] [-8.81517811e-04 -4.83470898e-04 -3.99421895e-04] [ 8.81517812e-04 4.83470898e-04 -3.99421894e-04] [ 1.82660417e-04 4.84823407e-04 -9.23247277e-05] [-1.82660417e-04 -4.84823406e-04 -9.23247281e-05] [-3.08104377e-04 1.86833900e-03 2.36207914e-04] [ 3.08104377e-04 -1.86833900e-03 2.36207913e-04] [-2.71753189e-04 4.62027115e-04 2.70738732e-04] [ 2.71753189e-04 -4.62027114e-04 2.70738732e-04] [-7.17870080e-04 2.69241172e-04 -3.37938249e-04] [ 7.17870080e-04 -2.69241172e-04 -3.37938250e-04] [ 5.06700774e-04 1.13286780e-04 -1.21732562e-04] [-5.06700773e-04 -1.13286781e-04 -1.21732563e-04] [ 8.31264041e-04 -1.38256306e-03 1.72674649e-04] [-8.31264041e-04 1.38256306e-03 1.72674650e-04] [-1.35600692e-03 8.47342798e-04 -8.65990284e-04] [ 1.35600692e-03 -8.47342799e-04 -8.65990284e-04] [ 3.59348982e-04 -3.88172662e-04 -1.02612288e-04] [-3.59348982e-04 3.88172663e-04 -1.02612289e-04] [ 2.86896913e-04 1.72465522e-04 -6.30451041e-04] [-2.86896913e-04 -1.72465522e-04 -6.30451042e-04] [-4.63074999e-05 -1.25505664e-03 -1.63580456e-05] [ 4.63074998e-05 1.25505664e-03 -1.63580458e-05] [-5.96255557e-04 -9.63830512e-05 -1.97963656e-04] [ 5.96255557e-04 9.63830518e-05 -1.97963657e-04] [ 9.72405993e-04 1.99761291e-04 6.13240771e-05] [-9.72405993e-04 -1.99761289e-04 6.13240766e-05]] Final stress: [ 4.42303399e-05 7.66227876e-05 2.06412298e-05 -2.25497328e-15 -4.92341807e-16 -2.16609730e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-3.33496417e-04 -4.53842039e-05 -4.29232789e-04] [ 3.33496417e-04 4.53842023e-05 -4.29232788e-04] [-7.11626195e-04 -7.87857857e-04 3.02519731e-05] [ 7.11626195e-04 7.87857855e-04 3.02519707e-05] [-2.06190193e-04 4.33498449e-04 4.06890332e-04] [ 2.06190193e-04 -4.33498449e-04 4.06890331e-04] [ 1.21458518e-03 1.01172002e-03 2.55756147e-04] [-1.21458518e-03 -1.01172002e-03 2.55756144e-04] [ 7.69518499e-05 -5.35498214e-04 4.61176832e-04] [-7.69518498e-05 5.35498214e-04 4.61176833e-04] [-1.76565360e-04 6.89532178e-05 -8.21264244e-04] [ 1.76565361e-04 -6.89532182e-05 -8.21264246e-04] [ 9.13690710e-04 -1.34465207e-04 8.26608491e-04] [-9.13690710e-04 1.34465206e-04 8.26608492e-04] [ 1.08306264e-03 -1.10541940e-04 2.19659172e-03] [-1.08306264e-03 1.10541940e-04 2.19659172e-03] [ 8.40941262e-05 -9.74118178e-04 9.44363397e-04] [-8.40941262e-05 9.74118178e-04 9.44363398e-04] [-2.98670054e-04 2.86772276e-04 -8.83250640e-04] [ 2.98670053e-04 -2.86772277e-04 -8.83250639e-04] [-1.82357833e-03 6.67069101e-04 -2.17575896e-04] [ 1.82357833e-03 -6.67069102e-04 -2.17575897e-04] [ 1.68803498e-03 -4.57606163e-04 -1.39522941e-04] [-1.68803498e-03 4.57606166e-04 -1.39522940e-04] [-6.76825269e-04 -1.06303017e-03 7.78593251e-04] [ 6.76825269e-04 1.06303017e-03 7.78593252e-04] [ 3.83037289e-05 1.52447732e-04 -2.43298551e-03] [-3.83037287e-05 -1.52447733e-04 -2.43298551e-03] [-7.00581369e-04 -3.83921957e-04 8.99152849e-04] [ 7.00581368e-04 3.83921955e-04 8.99152849e-04] [-1.07589518e-04 -7.83080533e-04 -6.22898886e-04] [ 1.07589518e-04 7.83080532e-04 -6.22898886e-04] [ 1.11557982e-03 6.35698268e-04 1.48968425e-05] [-1.11557982e-03 -6.35698268e-04 1.48968412e-05] [ 5.43579378e-04 -4.50007339e-05 5.22854241e-04] [-5.43579379e-04 4.50007341e-05 5.22854242e-04] [-3.00939053e-04 -6.64445999e-04 -5.43481499e-04] [ 3.00939053e-04 6.64446000e-04 -5.43481499e-04] [ 6.06481289e-04 8.47693634e-05 -1.39096745e-03] [-6.06481290e-04 -8.47693627e-05 -1.39096745e-03] [-7.89723953e-04 1.71893196e-04 8.27402808e-04] [ 7.89723954e-04 -1.71893196e-04 8.27402807e-04] [ 6.87533354e-04 7.82484450e-04 9.16764302e-04] [-6.87533353e-04 -7.82484449e-04 9.16764302e-04] [-3.66958869e-05 1.72359275e-03 -8.24160562e-04] [ 3.66958865e-05 -1.72359275e-03 -8.24160561e-04] [ 7.25784177e-05 -1.29639353e-03 -2.42215861e-04] [-7.25784199e-05 1.29639353e-03 -2.42215862e-04] [-7.04863189e-04 -1.16324822e-04 9.13862732e-04] [ 7.04863189e-04 1.16324822e-04 9.13862732e-04] [-8.27469582e-04 3.89931859e-04 2.01447193e-04] [ 8.27469582e-04 -3.89931859e-04 2.01447192e-04] [ 3.63807942e-04 2.86207877e-05 -2.59881797e-05] [-3.63807942e-04 -2.86207870e-05 -2.59881804e-05] [-5.57364654e-04 6.71407302e-05 -4.47850607e-04] [ 5.57364654e-04 -6.71407298e-05 -4.47850608e-04] [ 9.26364657e-04 -4.13412275e-04 8.06100884e-04] [-9.26364657e-04 4.13412276e-04 8.06100884e-04] [-7.23236614e-04 -4.82409804e-04 5.08570958e-04] [ 7.23236615e-04 4.82409803e-04 5.08570957e-04] [ 7.51287136e-04 5.56775576e-04 -6.45569132e-05] [-7.51287137e-04 -5.56775575e-04 -6.45569134e-05] [-9.85743247e-04 -2.49065953e-04 -1.47207250e-03] [ 9.85743246e-04 2.49065953e-04 -1.47207250e-03] [ 1.86237700e-04 -3.36804302e-04 2.81002316e-03] [-1.86237699e-04 3.36804300e-04 2.81002316e-03] [ 9.67705059e-04 4.61190170e-04 -5.46599277e-04] [-9.67705060e-04 -4.61190169e-04 -5.46599277e-04] [ 1.61866164e-04 -6.02827496e-04 9.67563788e-04] [-1.61866162e-04 6.02827496e-04 9.67563787e-04] [-1.95030882e-03 2.93446047e-04 7.16378877e-05] [ 1.95030882e-03 -2.93446047e-04 7.16378885e-05] [ 2.79087745e-03 6.58943330e-04 -6.11316021e-04] [-2.79087745e-03 -6.58943330e-04 -6.11316021e-04] [-8.80504992e-04 4.85586179e-04 -3.93242220e-04] [ 8.80504993e-04 -4.85586180e-04 -3.93242219e-04] [ 8.36102691e-04 -6.41416429e-04 -1.65392098e-03] [-8.36102691e-04 6.41416429e-04 -1.65392098e-03] [-1.91262100e-04 4.81352847e-04 -8.73799224e-05] [ 1.91262099e-04 -4.81352848e-04 -8.73799238e-05] [ 3.18818347e-04 1.86554802e-03 2.30634278e-04] [-3.18818346e-04 -1.86554802e-03 2.30634278e-04] [ 2.73083001e-04 4.60026347e-04 2.75682323e-04] [-2.73083000e-04 -4.60026347e-04 2.75682323e-04] [ 7.20812450e-04 2.61005200e-04 -3.32960195e-04] [-7.20812451e-04 -2.61005200e-04 -3.32960193e-04] [-5.00065220e-04 1.38022815e-04 -1.19257765e-04] [ 5.00065219e-04 -1.38022812e-04 -1.19257764e-04] [-8.43746853e-04 -1.38316794e-03 1.76589135e-04] [ 8.43746853e-04 1.38316793e-03 1.76589134e-04] [ 1.34803627e-03 8.47203747e-04 -8.70887319e-04] [-1.34803627e-03 -8.47203746e-04 -8.70887319e-04] [-3.61947550e-04 -3.62571314e-04 -1.02856471e-04] [ 3.61947550e-04 3.62571314e-04 -1.02856470e-04] [-4.30369603e-05 1.25245838e-03 -2.31067840e-06] [ 4.30369591e-05 -1.25245838e-03 -2.31067752e-06] [ 2.84344892e-04 -1.83965681e-04 -6.24778244e-04] [-2.84344891e-04 1.83965682e-04 -6.24778245e-04] [ 9.74537457e-04 -2.00228335e-04 5.79038135e-05] [-9.74537457e-04 2.00228335e-04 5.79038130e-05] [-5.86655902e-04 9.10705669e-05 -1.97785770e-04] [ 5.86655901e-04 -9.10705670e-05 -1.97785770e-04]] Final stress: [ 4.42386633e-05 7.66813674e-05 2.06883550e-05 6.40522351e-16 -1.84508677e-15 2.15978465e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 7.12395313e-04 5.12295462e-04 3.94254936e-04] [-7.12395312e-04 -5.12295466e-04 3.94254936e-04] [ 1.10771155e-03 1.40348911e-03 5.09216964e-06] [-1.10771155e-03 -1.40348911e-03 5.09216865e-06] [ 3.49950669e-04 -9.42028623e-04 -9.32703724e-04] [-3.49950669e-04 9.42028624e-04 -9.32703724e-04] [-1.81757748e-03 -1.86178746e-03 -3.38154024e-04] [ 1.81757747e-03 1.86178747e-03 -3.38154023e-04] [-5.18961963e-05 9.24625757e-04 -8.30393159e-04] [ 5.18961962e-05 -9.24625758e-04 -8.30393157e-04] [ 3.15983546e-04 1.31762376e-04 1.31526355e-03] [-3.15983546e-04 -1.31762376e-04 1.31526355e-03] [-1.34583101e-03 6.00343339e-05 -1.31125176e-03] [ 1.34583101e-03 -6.00343358e-05 -1.31125177e-03] [-1.90494775e-03 -6.98797895e-04 -2.88465610e-03] [ 1.90494775e-03 6.98797896e-04 -2.88465610e-03] [-2.02292606e-04 1.72844514e-03 -1.76844507e-03] [ 2.02292606e-04 -1.72844514e-03 -1.76844507e-03] [ 6.11598386e-04 -2.20764380e-04 1.26133196e-03] [-6.11598387e-04 2.20764379e-04 1.26133195e-03] [ 2.61626802e-03 -1.08094945e-03 3.79570667e-04] [-2.61626802e-03 1.08094945e-03 3.79570667e-04] [-2.18332194e-03 5.60636669e-04 4.63442996e-04] [ 2.18332194e-03 -5.60636678e-04 4.63442999e-04] [ 7.90561838e-04 1.18524466e-03 -7.46973482e-04] [-7.90561837e-04 -1.18524466e-03 -7.46973479e-04] [-1.70514415e-04 5.62545362e-04 3.45837026e-03] [ 1.70514415e-04 -5.62545360e-04 3.45837026e-03] [ 1.26459380e-03 6.61243231e-04 -1.02119834e-03] [-1.26459380e-03 -6.61243232e-04 -1.02119834e-03] [ 8.81932570e-08 1.08010948e-03 7.67489818e-04] [-8.81937585e-08 -1.08010948e-03 7.67489817e-04] [-1.71341122e-03 -1.38798977e-03 -1.58035534e-04] [ 1.71341122e-03 1.38798977e-03 -1.58035536e-04] [-1.47529800e-03 2.52365353e-04 -1.74544713e-04] [ 1.47529800e-03 -2.52365352e-04 -1.74544714e-04] [ 3.35571824e-04 1.30567577e-03 8.92613867e-04] [-3.35571824e-04 -1.30567577e-03 8.92613868e-04] [-6.89236298e-04 1.13039690e-04 2.16549745e-03] [ 6.89236298e-04 -1.13039693e-04 2.16549745e-03] [ 6.83836133e-04 -1.06727723e-04 -9.02375055e-04] [-6.83836132e-04 1.06727721e-04 -9.02375052e-04] [-9.58762051e-04 -1.29433932e-03 -1.30335800e-03] [ 9.58762051e-04 1.29433932e-03 -1.30335799e-03] [-5.11542597e-05 -1.92644929e-03 1.35305346e-03] [ 5.11542599e-05 1.92644929e-03 1.35305346e-03] [-4.17697726e-04 1.98982382e-03 4.60772783e-04] [ 4.17697727e-04 -1.98982382e-03 4.60772785e-04] [ 5.06540600e-04 -1.58459069e-05 -1.26825238e-03] [-5.06540600e-04 1.58459047e-05 -1.26825239e-03] [ 9.10522245e-04 -7.02222009e-04 -5.42705361e-04] [-9.10522244e-04 7.02222011e-04 -5.42705362e-04] [-8.26794366e-04 -1.56922216e-04 -2.60257207e-04] [ 8.26794366e-04 1.56922216e-04 -2.60257209e-04] [ 1.04329092e-03 -3.30102889e-04 6.96045997e-04] [-1.04329092e-03 3.30102889e-04 6.96045997e-04] [-1.47242371e-03 6.08583454e-04 -1.05769937e-03] [ 1.47242371e-03 -6.08583455e-04 -1.05769937e-03] [ 1.19275698e-03 1.08262036e-03 -8.25758085e-04] [-1.19275698e-03 -1.08262036e-03 -8.25758083e-04] [-1.18500606e-03 -9.88466132e-04 9.27344743e-05] [ 1.18500606e-03 9.88466134e-04 9.27344735e-05] [ 1.11199470e-03 4.46137864e-04 1.62366005e-03] [-1.11199470e-03 -4.46137865e-04 1.62366005e-03] [-5.86527608e-04 1.01882884e-03 -3.90432080e-03] [ 5.86527608e-04 -1.01882884e-03 -3.90432080e-03] [-1.72770419e-03 -4.57662801e-04 9.01416650e-04] [ 1.72770419e-03 4.57662800e-04 9.01416649e-04] [-3.62525570e-04 1.12282760e-03 -1.58326642e-03] [ 3.62525571e-04 -1.12282760e-03 -1.58326642e-03] [ 2.43842533e-03 4.32243229e-04 -7.18830033e-05] [-2.43842533e-03 -4.32243228e-04 -7.18830051e-05] [-3.63071433e-03 -4.77829538e-04 1.17424892e-03] [ 3.63071433e-03 4.77829538e-04 1.17424892e-03] [ 1.10705090e-03 -6.50886885e-04 6.79372946e-04] [-1.10705090e-03 6.50886887e-04 6.79372946e-04] [-1.44082216e-03 1.15252422e-03 2.38408444e-03] [ 1.44082216e-03 -1.15252422e-03 2.38408444e-03] [ 4.14128269e-04 -6.91922691e-04 3.23728205e-04] [-4.14128268e-04 6.91922690e-04 3.23728205e-04] [ 4.21998802e-05 -2.80324985e-03 -1.20626670e-04] [-4.21998806e-05 2.80324985e-03 -1.20626670e-04] [-8.41530370e-05 -7.98949201e-04 -4.38126840e-04] [ 8.41530355e-05 7.98949202e-04 -4.38126838e-04] [-8.89317826e-04 -1.44206023e-04 2.40454668e-04] [ 8.89317826e-04 1.44206024e-04 2.40454667e-04] [ 3.67848753e-04 -2.48550024e-04 -1.38177875e-04] [-3.67848754e-04 2.48550028e-04 -1.38177874e-04] [ 8.09579874e-04 2.14176758e-03 -5.66696947e-04] [-8.09579874e-04 -2.14176758e-03 -5.66696949e-04] [-2.12693682e-03 -1.21548894e-03 1.01033090e-03] [ 2.12693682e-03 1.21548894e-03 1.01033090e-03] [ 3.85499705e-04 4.63331842e-04 2.88929416e-04] [-3.85499705e-04 -4.63331833e-04 2.88929415e-04] [ 2.09939411e-04 -1.35075679e-03 -8.31439132e-05] [-2.09939410e-04 1.35075679e-03 -8.31439152e-05] [-4.61201647e-04 4.87836652e-04 1.13272052e-03] [ 4.61201647e-04 -4.87836652e-04 1.13272052e-03] [-1.52609767e-03 1.26141216e-04 -2.54848961e-04] [ 1.52609767e-03 -1.26141215e-04 -2.54848964e-04] [ 9.85949067e-04 -6.94489421e-05 2.33717121e-05] [-9.85949067e-04 6.94489433e-05 2.33717143e-05]] Final stress: [-5.16441764e-05 -7.03905599e-05 -2.68801257e-05 -4.17132400e-16 -2.34263468e-16 -3.08323407e-05] Minimization converged after 115 steps. Minimization converged after 30 steps. Minimization converged after 26 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.16118581e-03 1.07084523e-03 -1.12987749e-03] [ 1.16118580e-03 -1.07084526e-03 -1.12987749e-03] [-4.05390036e-04 -2.53800478e-03 4.91336882e-04] [ 4.05390036e-04 2.53800478e-03 4.91336878e-04] [ 1.15837307e-03 2.30133827e-03 -4.93169267e-04] [-1.15837307e-03 -2.30133827e-03 -4.93169264e-04] [-5.37636586e-04 -4.87726010e-04 5.68703674e-05] [ 5.37636584e-04 4.87726024e-04 5.68703854e-05] [ 7.79596592e-04 1.00538069e-03 1.28847574e-03] [-7.79596591e-04 -1.00538070e-03 1.28847574e-03] [-7.29818191e-04 -6.10093157e-04 1.13314095e-03] [ 7.29818192e-04 6.10093158e-04 1.13314095e-03] [-1.11458094e-03 -1.25594751e-03 9.71434563e-05] [ 1.11458094e-03 1.25594752e-03 9.71434625e-05] [-4.15529747e-03 8.40644292e-04 4.21217993e-04] [ 4.15529747e-03 -8.40644288e-04 4.21218005e-04] [ 2.01897376e-03 1.86413126e-04 4.30718033e-04] [-2.01897376e-03 -1.86413126e-04 4.30718035e-04] [ 1.04192291e-03 1.01845136e-03 6.01712416e-04] [-1.04192291e-03 -1.01845136e-03 6.01712410e-04] [ 2.89073946e-04 8.46337598e-05 4.87484979e-04] [-2.89073946e-04 -8.46337644e-05 4.87484986e-04] [-2.22082828e-03 -3.38209259e-04 7.01775122e-04] [ 2.22082828e-03 3.38209241e-04 7.01775127e-04] [ 8.46177873e-05 9.10637491e-04 -2.84116029e-03] [-8.46177870e-05 -9.10637497e-04 -2.84116030e-03] [ 1.44177839e-03 3.21170106e-04 4.03270567e-04] [-1.44177839e-03 -3.21170104e-04 4.03270563e-04] [ 3.04259012e-04 2.88723467e-03 -3.81279186e-03] [-3.04259010e-04 -2.88723467e-03 -3.81279186e-03] [ 2.00305813e-03 -2.92736160e-03 5.33417731e-04] [-2.00305813e-03 2.92736160e-03 5.33417732e-04] [ 1.99353753e-03 8.95565295e-04 -9.90871751e-04] [-1.99353753e-03 -8.95565292e-04 -9.90871755e-04] [ 2.07270882e-03 -7.57030938e-06 -1.00105869e-03] [-2.07270882e-03 7.57031269e-06 -1.00105870e-03] [-1.99534922e-05 -1.40541251e-03 -6.11646823e-04] [ 1.99534932e-05 1.40541251e-03 -6.11646822e-04] [-1.71312131e-03 2.03778944e-03 -2.16191369e-03] [ 1.71312132e-03 -2.03778944e-03 -2.16191370e-03] [ 5.69202487e-05 -8.70224507e-04 6.06626035e-04] [-5.69202533e-05 8.70224502e-04 6.06626039e-04] [ 1.34463371e-04 -3.55928655e-04 1.88891899e-03] [-1.34463371e-04 3.55928655e-04 1.88891899e-03] [ 1.35128648e-04 -2.72539738e-03 1.42415207e-03] [-1.35128647e-04 2.72539738e-03 1.42415207e-03] [-2.39202377e-03 -5.28237774e-04 -3.01426195e-03] [ 2.39202377e-03 5.28237771e-04 -3.01426194e-03] [ 8.72451517e-04 -2.09779023e-03 3.25285048e-03] [-8.72451518e-04 2.09779022e-03 3.25285048e-03] [ 1.55454726e-03 1.51309860e-03 2.21087481e-03] [-1.55454726e-03 -1.51309859e-03 2.21087481e-03] [-1.20011420e-03 6.54719053e-04 -4.78535449e-04] [ 1.20011420e-03 -6.54719054e-04 -4.78535451e-04] [ 3.83181752e-04 1.36759265e-03 1.89925100e-03] [-3.83181758e-04 -1.36759265e-03 1.89925100e-03] [ 7.73055296e-04 -1.54250478e-03 7.37202931e-04] [-7.73055297e-04 1.54250478e-03 7.37202931e-04] [ 9.70202031e-04 -2.49375699e-03 -2.75556298e-03] [-9.70202031e-04 2.49375699e-03 -2.75556298e-03] [-1.26332227e-03 -3.78893878e-04 -1.16035458e-03] [ 1.26332227e-03 3.78893880e-04 -1.16035458e-03] [-2.99247560e-03 -5.18652416e-04 -1.21227896e-03] [ 2.99247560e-03 5.18652410e-04 -1.21227896e-03] [ 1.28874537e-03 2.25228832e-04 5.89890101e-04] [-1.28874536e-03 -2.25228835e-04 5.89890101e-04] [ 4.03875710e-03 -2.80722467e-03 1.08079549e-03] [-4.03875709e-03 2.80722467e-03 1.08079549e-03] [-2.18592311e-03 8.77878883e-04 -4.57472717e-04] [ 2.18592310e-03 -8.77878884e-04 -4.57472716e-04] [ 1.48742610e-03 -4.44958173e-03 1.94120099e-03] [-1.48742611e-03 4.44958173e-03 1.94120099e-03] [ 9.15085144e-04 -2.08379974e-03 -3.47177351e-03] [-9.15085145e-04 2.08379974e-03 -3.47177351e-03] [ 2.69019662e-03 1.98976276e-04 2.29646301e-03] [-2.69019662e-03 -1.98976275e-04 2.29646302e-03] [ 6.73602434e-04 -1.09227151e-03 5.69308159e-04] [-6.73602435e-04 1.09227152e-03 5.69308156e-04] [ 3.31346636e-03 -1.32680219e-03 1.08512052e-03] [-3.31346635e-03 1.32680219e-03 1.08512052e-03] [ 2.49239166e-03 -2.81877303e-05 -5.84594649e-04] [-2.49239166e-03 2.81877302e-05 -5.84594651e-04] [-1.03277113e-03 -1.78519465e-03 -1.47208369e-03] [ 1.03277113e-03 1.78519465e-03 -1.47208369e-03] [ 1.98920623e-03 4.10303553e-04 4.43636759e-04] [-1.98920623e-03 -4.10303558e-04 4.43636753e-04] [ 1.53870161e-03 -1.05555573e-03 -1.50089538e-03] [-1.53870161e-03 1.05555575e-03 -1.50089538e-03] [-3.19057645e-03 9.93257904e-05 -1.12522285e-03] [ 3.19057645e-03 -9.93257896e-05 -1.12522285e-03] [ 1.65391088e-03 -4.23678740e-04 -2.95957001e-04] [-1.65391088e-03 4.23678741e-04 -2.95956998e-04] [ 1.78553563e-03 -1.70156940e-03 5.67257753e-04] [-1.78553563e-03 1.70156941e-03 5.67257753e-04] [-3.24023417e-03 -6.94566496e-05 7.71837524e-04] [ 3.24023417e-03 6.94566531e-05 7.71837509e-04] [ 1.20457936e-03 2.40768005e-03 4.79784721e-04] [-1.20457936e-03 -2.40768004e-03 4.79784734e-04] [-1.30996267e-03 2.55563568e-03 -2.29535651e-04] [ 1.30996267e-03 -2.55563567e-03 -2.29535651e-04] [-2.35010190e-03 9.36884017e-04 2.30928363e-03] [ 2.35010189e-03 -9.36884016e-04 2.30928363e-03]] Final stress: [ 4.52603560e-05 1.71804811e-05 1.89398189e-04 -5.60935059e-15 1.31689483e-15 -1.19950119e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 3.81305463e-03 3.67032406e-03 -6.79694447e-03] [-3.81305463e-03 -3.67032406e-03 -6.79694446e-03] [ 1.82403344e-03 -1.14502253e-02 1.31781253e-03] [-1.82403344e-03 1.14502253e-02 1.31781253e-03] [-3.91153830e-03 6.93851139e-03 -3.53475048e-03] [ 3.91153830e-03 -6.93851139e-03 -3.53475049e-03] [ 1.83810541e-03 1.43354795e-03 -3.43722450e-03] [-1.83810542e-03 -1.43354797e-03 -3.43722453e-03] [-3.52368356e-03 4.89289960e-03 6.37827101e-03] [ 3.52368355e-03 -4.89289959e-03 6.37827101e-03] [ 4.32518310e-03 -1.21595708e-05 3.02361061e-03] [-4.32518310e-03 1.21595705e-05 3.02361061e-03] [ 4.32835162e-03 -5.62927397e-03 -1.57658444e-03] [-4.32835162e-03 5.62927399e-03 -1.57658441e-03] [ 1.47807847e-02 4.54895220e-03 2.32816315e-03] [-1.47807847e-02 -4.54895220e-03 2.32816315e-03] [-9.48082931e-03 1.45344970e-04 1.14097445e-03] [ 9.48082931e-03 -1.45344949e-04 1.14097447e-03] [-2.50656479e-03 2.65847090e-03 3.74103259e-03] [ 2.50656478e-03 -2.65847089e-03 3.74103260e-03] [ 7.63955651e-04 9.59195087e-04 8.50391695e-04] [-7.63955651e-04 -9.59195084e-04 8.50391692e-04] [ 8.25802806e-03 -6.23270703e-03 2.64550805e-03] [-8.25802807e-03 6.23270711e-03 2.64550803e-03] [ 1.34490482e-04 -5.57256015e-04 -1.16363284e-02] [-1.34490484e-04 5.57255962e-04 -1.16363285e-02] [-5.38508451e-03 3.24889610e-03 7.40958965e-04] [ 5.38508451e-03 -3.24889612e-03 7.40958944e-04] [ 5.01339385e-04 1.50252466e-02 -1.44412536e-02] [-5.01339398e-04 -1.50252466e-02 -1.44412536e-02] [-8.93002609e-03 -1.38537964e-02 5.73428831e-04] [ 8.93002609e-03 1.38537964e-02 5.73428837e-04] [-8.70351578e-03 1.76907977e-03 -5.13594226e-03] [ 8.70351578e-03 -1.76907977e-03 -5.13594227e-03] [-3.45114663e-03 5.03800910e-03 -1.87457818e-03] [ 3.45114663e-03 -5.03800910e-03 -1.87457817e-03] [ 5.99527107e-03 2.38871174e-03 -2.96001633e-03] [-5.99527107e-03 -2.38871175e-03 -2.96001633e-03] [ 9.13980548e-05 2.32368655e-03 4.38365619e-03] [-9.13980564e-05 -2.32368655e-03 4.38365620e-03] [-7.11886979e-03 -6.23722220e-03 -7.51292798e-03] [ 7.11886981e-03 6.23722220e-03 -7.51292799e-03] [ 1.09337909e-03 5.33177094e-03 7.65397944e-03] [-1.09337909e-03 -5.33177094e-03 7.65397944e-03] [-2.50517030e-04 1.36591504e-03 1.19804637e-02] [ 2.50517029e-04 -1.36591505e-03 1.19804637e-02] [ 4.86700609e-03 9.13328588e-03 1.30957480e-02] [-4.86700608e-03 -9.13328588e-03 1.30957480e-02] [-9.88624030e-03 1.45060423e-03 -1.20581807e-02] [ 9.88624031e-03 -1.45060423e-03 -1.20581807e-02] [-7.82222143e-03 9.58211359e-05 -1.68934896e-03] [ 7.82222143e-03 -9.58211294e-05 -1.68934898e-03] [ 2.92218103e-03 -7.76697933e-03 7.73979926e-03] [-2.92218104e-03 7.76697934e-03 7.73979928e-03] [ 4.22228748e-03 6.83414363e-03 3.86803108e-03] [-4.22228748e-03 -6.83414365e-03 3.86803109e-03] [ 5.07818565e-04 -6.83414817e-03 9.26075792e-03] [-5.07818566e-04 6.83414815e-03 9.26075790e-03] [-3.10809752e-03 3.10566967e-03 -6.34130337e-03] [ 3.10809752e-03 -3.10566968e-03 -6.34130336e-03] [ 4.12628393e-03 8.19537210e-03 -1.11601834e-02] [-4.12628393e-03 -8.19537210e-03 -1.11601834e-02] [ 4.55206064e-03 -1.14185340e-03 2.96208512e-03] [-4.55206062e-03 1.14185340e-03 2.96208513e-03] [-1.38737669e-02 3.93890056e-03 -6.33913585e-03] [ 1.38737669e-02 -3.93890055e-03 -6.33913586e-03] [-8.37582598e-03 -2.45548885e-03 2.74776581e-04] [ 8.37582597e-03 2.45548885e-03 2.74776570e-04] [ 1.80773030e-02 1.26769957e-02 1.76896419e-03] [-1.80773030e-02 -1.26769957e-02 1.76896421e-03] [ 6.33208248e-03 8.76338726e-03 -1.44423441e-02] [-6.33208246e-03 -8.76338728e-03 -1.44423441e-02] [ 4.44705831e-03 1.72767196e-02 8.45680389e-03] [-4.44705829e-03 -1.72767196e-02 8.45680389e-03] [ 4.81336241e-03 5.09681162e-03 2.81430798e-03] [-4.81336240e-03 -5.09681162e-03 2.81430797e-03] [ 1.04873037e-02 -8.45607736e-04 7.52346678e-03] [-1.04873037e-02 8.45607738e-04 7.52346679e-03] [-1.31152920e-02 -4.39461822e-03 6.07574230e-03] [ 1.31152920e-02 4.39461824e-03 6.07574232e-03] [-8.49502636e-03 7.94797307e-04 -1.64134155e-03] [ 8.49502636e-03 -7.94797310e-04 -1.64134155e-03] [ 5.32970387e-03 -6.66847491e-03 -7.69325235e-03] [-5.32970386e-03 6.66847490e-03 -7.69325235e-03] [-8.15372769e-03 2.23820123e-03 -1.00545163e-03] [ 8.15372769e-03 -2.23820121e-03 -1.00545161e-03] [-8.16114130e-03 -1.02738294e-02 -8.23976342e-03] [ 8.16114129e-03 1.02738294e-02 -8.23976342e-03] [ 1.33433518e-02 -1.85699947e-03 -6.21492210e-03] [-1.33433518e-02 1.85699947e-03 -6.21492210e-03] [-7.21786904e-03 -1.33551717e-03 -1.38516288e-03] [ 7.21786904e-03 1.33551718e-03 -1.38516290e-03] [-6.17651889e-03 -9.40465510e-05 3.99028077e-03] [ 6.17651887e-03 9.40465029e-05 3.99028078e-03] [ 4.92835693e-03 -5.96998562e-03 4.02871585e-03] [-4.92835693e-03 5.96998564e-03 4.02871587e-03] [-1.26840841e-02 -1.96300960e-03 7.41765254e-03] [ 1.26840841e-02 1.96300960e-03 7.41765253e-03] [-1.11262205e-02 -3.48501265e-03 1.13961638e-02] [ 1.11262205e-02 3.48501264e-03 1.13961638e-02] [-4.92279428e-03 -8.64849290e-03 -3.14606211e-04] [ 4.92279429e-03 8.64849289e-03 -3.14606259e-04]] Final stress: [-2.41397588e-05 -4.33614632e-06 5.30997585e-04 -5.70614595e-15 4.18251535e-15 4.45536897e-04] Minimization converged after 119 steps. Minimization converged after 118 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. Minimization converged after 142 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-5.00708246e-04 -4.67011124e-04 3.36562724e-05] [ 4.96168760e-04 -6.28076578e-05 -3.01519046e-04] [-6.87853803e-04 -8.64629210e-04 -5.70237622e-05] [ 7.11389998e-04 -8.93845491e-04 5.03188483e-05] [-1.02913440e-03 -2.84723480e-04 -2.08580235e-03] [ 1.06754385e-03 -1.70493288e-04 1.99578191e-03] [ 3.95362018e-04 -3.46822026e-04 1.05502425e-03] [-3.60004762e-04 -6.07686556e-04 -1.29498609e-03] [-3.55662021e-04 1.00522080e-03 1.27773547e-03] [ 3.68807709e-04 1.01626583e-03 -1.35061029e-03] [-4.87999809e-04 -1.79069873e-04 1.34933750e-03] [ 4.80694345e-04 -2.34434233e-04 -1.42130068e-03] [ 4.73602393e-04 7.83833074e-04 7.92894185e-04] [-4.66278928e-04 8.00052413e-04 -1.02524867e-03] [ 2.68041964e-03 7.50467655e-04 1.44590206e-03] [-2.66397485e-03 7.81724083e-04 -1.58381566e-03] [-5.00247371e-05 5.38574761e-05 3.38819965e-04] [ 3.90830746e-05 -1.38340445e-05 -4.65806384e-04] [-1.61464861e-04 -6.95194872e-04 -1.01192171e-03] [ 1.64765223e-04 -6.18771362e-04 1.16306100e-03] [-1.03052527e-03 -1.33470828e-03 -1.09225184e-03] [ 1.01256084e-03 -1.38412489e-03 1.15595049e-03] [ 5.21033577e-05 -8.82550812e-04 -1.22902918e-04] [-6.42650102e-05 -9.46222232e-04 3.00449350e-04] [ 5.00914211e-04 -1.66942933e-03 6.58560491e-04] [-5.27949736e-04 -1.32121295e-03 -5.64056250e-04] [-2.61948325e-04 -1.87921426e-04 -1.29363686e-03] [ 2.50433528e-04 -3.64517659e-04 1.44919982e-03] [-6.65121174e-04 1.44352254e-03 1.96362166e-03] [ 6.49137534e-04 1.34232360e-03 -1.76321301e-03] [-2.96058241e-04 -8.87697695e-04 2.74852814e-04] [ 2.80462422e-04 -8.19569383e-04 -4.22497222e-04] [ 1.07266289e-03 -7.60923973e-04 5.25641013e-05] [-1.08025202e-03 -6.66141314e-04 -9.64774179e-05] [ 9.40296801e-04 2.93169838e-04 5.39823106e-05] [-5.37049206e-04 2.26738688e-03 -6.31228031e-04] [-1.10558826e-03 3.94430968e-04 8.63953033e-05] [ 5.84873046e-04 2.20710291e-03 7.22400395e-04] [-8.16674381e-04 1.27546897e-04 8.16704656e-04] [ 1.09209042e-03 1.03966985e-03 -5.06847577e-04] [ 6.92848702e-04 1.16054861e-04 -7.48125193e-04] [-1.03043617e-03 1.01323708e-03 6.17137986e-04] [ 9.20497703e-04 5.14338765e-04 1.53560466e-03] [ 7.14521771e-04 5.27377086e-04 1.09629244e-03] [-9.03101974e-04 7.85414011e-04 -1.47554843e-03] [-7.16359340e-04 2.48429373e-04 -1.02564964e-03] [ 4.49000541e-04 -5.67478476e-04 -1.03663971e-03] [ 1.42948596e-03 -7.38005748e-04 1.38118200e-04] [-5.04348926e-04 -5.87827853e-04 1.06683502e-03] [-1.35114377e-03 -6.95649027e-04 -1.49828349e-04] [ 5.14040564e-04 2.85231433e-04 1.04582257e-03] [ 1.42013820e-03 3.77577364e-04 -1.17643294e-03] [-5.72443349e-04 2.26265683e-04 -1.10027817e-03] [-1.30896207e-03 4.52967104e-04 1.11225802e-03] [ 2.77231289e-05 1.22767092e-03 1.78816950e-05] [ 2.04333707e-03 1.64644399e-04 4.52543984e-04] [ 1.22243966e-04 1.12979937e-03 3.85446374e-05] [-2.21962316e-03 2.89172447e-04 -3.87990036e-04] [ 3.25288212e-04 -9.97583837e-04 8.80500241e-04] [ 2.89931730e-03 -2.62058956e-04 7.42423045e-04] [-3.13790438e-04 -1.19771796e-03 -8.77031175e-04] [-2.89404764e-03 -7.68258881e-05 -7.50347158e-04] [ 8.15569906e-05 -1.96009245e-03 2.89171652e-04] [ 1.77652535e-04 1.02220249e-03 2.33585996e-04] [-2.14262792e-04 -1.85905636e-03 -3.07428344e-04] [-3.28896979e-05 9.21582532e-04 -2.34248689e-04] [-1.24457062e-03 -5.48922524e-04 -1.06960887e-04] [ 3.75844188e-04 8.95320134e-04 -1.40699314e-03] [ 1.27979673e-03 -5.56413548e-04 9.62574166e-05] [-3.83792184e-04 9.05799052e-04 1.39055780e-03] [ 9.45790766e-04 -1.71109290e-03 8.57897534e-04] [ 1.80382819e-03 1.97182840e-05 7.86984946e-04] [-8.53054772e-04 -1.75305962e-03 -8.37946068e-04] [-1.89801734e-03 1.35572821e-04 -7.87289766e-04] [-4.22460852e-04 -2.41138710e-04 8.15127765e-04] [-2.85637890e-04 2.62349889e-04 -8.89510544e-05] [ 4.48695504e-04 -2.06257120e-04 -9.12734837e-04] [ 2.26734157e-04 2.31540171e-04 -2.43586875e-05] [-1.52791384e-03 1.05329294e-03 1.23141703e-03] [ 1.53199516e-03 1.04926084e-03 -1.10474653e-03] [-1.22624562e-03 8.62703226e-04 8.19261555e-04] [ 1.24961992e-03 8.41510646e-04 -7.41618395e-04] [-7.18486886e-04 -5.52070396e-04 -1.48787541e-03] [ 7.17763806e-04 -5.19691036e-04 1.47041599e-03] [ 2.40074647e-04 2.87482959e-04 -1.72990036e-03] [-2.21073794e-04 3.61466775e-04 1.70055635e-03] [ 2.29052116e-03 -2.73342157e-04 6.23667075e-04] [-2.33687908e-03 -4.09021922e-04 -7.36090695e-04] [ 8.36776688e-04 -1.10250582e-03 -9.65616587e-04] [-8.38159758e-04 -1.02913495e-03 9.03463888e-04] [ 9.22280104e-04 5.11199170e-04 1.29607568e-03] [-9.00336829e-04 4.79101303e-04 -1.37840600e-03] [-3.35609935e-04 7.61382315e-04 -1.53123920e-03] [ 3.61667569e-04 7.75853012e-04 1.63130881e-03] [ 5.38161427e-05 8.91983012e-04 1.26875803e-03] [-2.88554061e-04 2.11954084e-03 8.59623703e-04] [-4.29758338e-05 7.76214029e-04 -1.00997005e-03] [ 2.84165997e-04 2.22877674e-03 -6.26418233e-04] [ 8.28440800e-04 -1.01659338e-03 -4.38316117e-04] [-4.23946726e-04 -1.26046945e-03 1.06377892e-03] [-8.00971869e-04 -1.03754239e-03 3.09317229e-04] [ 4.29799016e-04 -1.23471225e-03 -1.15227712e-03]] Final stress: [-2.89600386e-06 -3.26308818e-08 -6.51415157e-06 5.00520428e-05 -8.45891223e-08 2.87011176e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 5.79150749e-04 -3.46909210e-04 -9.15193029e-04] [-6.79364063e-04 -7.10947962e-04 4.02768265e-04] [ 1.67465624e-03 1.35891028e-03 -3.46044209e-04] [-1.60047189e-03 1.19148062e-03 -1.63137953e-04] [ 1.93783520e-03 1.37003193e-04 2.99295951e-03] [-1.76914227e-03 7.63381557e-04 -3.20305797e-03] [-1.31914654e-03 -1.01120619e-04 -2.27953705e-03] [ 1.41942848e-03 -8.23149291e-04 1.58567788e-03] [ 5.17629851e-04 2.93025246e-04 -2.08233718e-03] [-5.09590295e-04 1.83146044e-04 2.02818287e-03] [ 1.23091322e-03 6.96565616e-04 -2.44288308e-03] [-1.24209766e-03 3.89144240e-04 2.22932517e-03] [-1.30064207e-03 -1.46570653e-03 -1.48269000e-03] [ 1.32840496e-03 -1.30285157e-03 1.07216167e-03] [-5.11598277e-03 -2.08622176e-04 -1.22779905e-03] [ 5.12732751e-03 1.35573180e-04 1.26784142e-03] [ 4.93930018e-04 2.36543821e-04 -1.36508504e-03] [-5.86379435e-04 2.84331424e-04 1.00102264e-03] [-1.08770196e-04 1.19156759e-03 1.37445261e-03] [ 8.74473916e-05 1.25942855e-03 -1.09357131e-03] [ 2.61056058e-03 8.52445214e-04 9.81806163e-04] [-2.63227431e-03 8.64453124e-04 -1.14322627e-03] [-1.27855127e-03 1.51361041e-03 9.87846996e-04] [ 1.28935794e-03 1.59092426e-03 -7.49437386e-04] [-4.83652557e-04 2.37556353e-03 7.54178948e-04] [ 4.08878667e-04 3.57546813e-03 -1.67110180e-04] [ 3.79435686e-04 3.23645122e-04 1.47211150e-03] [-3.83010649e-04 -4.11593502e-05 -1.62995867e-03] [ 1.05743791e-03 -3.21097823e-03 -4.12891711e-03] [-1.25251999e-03 -3.73914626e-03 4.57436472e-03] [ 1.00225146e-03 1.98859697e-03 -1.37383977e-03] [-1.04566920e-03 2.26079039e-03 8.82031672e-04] [-2.64582836e-03 1.35044586e-03 5.69241409e-04] [ 2.62380450e-03 2.04503184e-03 -6.21128712e-04] [-2.35579614e-03 -1.27307935e-03 1.73675753e-05] [ 1.46109258e-03 -3.68500477e-03 8.78602073e-04] [ 1.15134640e-03 -7.60340669e-04 3.31769302e-04] [-7.76909731e-04 -3.89919637e-03 -5.89904398e-04] [ 3.15339215e-04 -9.69776342e-04 -4.84215227e-04] [-1.56568841e-03 -2.04481409e-03 1.45203141e-03] [-4.41599485e-04 -8.88719697e-04 8.40902167e-04] [ 1.70117910e-03 -2.11631918e-03 -1.13838308e-03] [-2.32967965e-03 -1.89292790e-03 -3.81003000e-03] [-1.03456436e-03 9.30101388e-05 -2.20454266e-03] [ 2.28008143e-03 -8.92423671e-04 4.41611477e-03] [ 1.21832330e-03 -9.11712900e-04 2.80049572e-03] [-1.04785896e-03 1.60450515e-03 1.46817673e-03] [-1.10936896e-03 8.92774833e-04 4.49028280e-04] [ 1.32408676e-03 1.32845529e-03 -1.13758447e-03] [ 9.97227926e-04 1.19186058e-03 -1.70039708e-04] [-6.25111478e-04 -7.53231714e-05 -2.11867146e-03] [-2.02932606e-03 -7.42442139e-04 2.16524350e-03] [ 6.00133261e-05 -2.85805518e-04 1.91356397e-03] [ 2.88143131e-03 -4.30233440e-04 -2.27825706e-03] [-4.35611636e-05 -1.95961494e-03 3.82865659e-04] [-3.72572577e-03 -2.52001866e-04 -7.86374866e-04] [-1.54687611e-04 -1.85133157e-03 -2.57799570e-04] [ 3.68935497e-03 -3.57078799e-04 9.12215136e-04] [-2.58462162e-04 2.54913026e-03 -2.31766943e-03] [-5.54675437e-03 -3.78980774e-04 -1.93805823e-03] [ 2.68085561e-04 2.04381246e-03 2.22779744e-03] [ 5.59146079e-03 8.68640713e-05 1.78562259e-03] [-5.30451705e-04 3.10877823e-03 1.11170976e-03] [-3.11737246e-05 -1.56707368e-03 8.04222991e-04] [ 4.15301442e-04 3.17097704e-03 -1.58418976e-03] [ 1.50065830e-04 -1.56324831e-03 -1.29103194e-03] [ 2.44971513e-03 1.74691727e-03 4.10555291e-04] [-9.70357862e-04 -7.07161082e-04 1.97021870e-03] [-2.22264707e-03 1.77465214e-03 -3.94966823e-04] [ 8.32936595e-04 -6.90042547e-04 -1.93993711e-03] [ 1.99515062e-04 9.33905342e-04 -2.39179415e-03] [-4.65615052e-03 -8.98118635e-04 -1.11527445e-03] [-2.92772991e-04 5.52370296e-04 2.39778063e-03] [ 4.89431696e-03 -1.88838426e-04 1.05713812e-03] [ 8.31205281e-04 -2.08219098e-04 -2.15718614e-03] [-3.03018663e-04 -9.42394343e-04 -6.96657907e-04] [-7.43293552e-04 -1.83484490e-04 1.93720474e-03] [ 1.88421910e-04 -1.00621253e-03 4.66920239e-04] [ 3.42065504e-03 -4.22813704e-05 -1.68419093e-03] [-3.37125396e-03 1.92253972e-05 2.35367594e-03] [ 1.33637534e-03 -4.47376640e-04 -9.49907105e-04] [-1.25932159e-03 -7.15823933e-04 1.19735194e-03] [ 8.78597089e-04 4.71768327e-04 2.34707967e-03] [-8.77037344e-04 5.54239894e-04 -2.49954362e-03] [-8.15114214e-04 -1.48510635e-03 2.16470758e-03] [ 8.16067201e-04 -1.69628290e-03 -2.67959417e-03] [-2.58002166e-03 -5.55021270e-04 -1.58887390e-03] [ 2.36569998e-03 1.33476837e-03 9.82759948e-04] [-6.46686384e-04 1.33052866e-03 8.69690709e-04] [ 6.65605246e-04 1.73000793e-03 -1.05485103e-03] [-2.00689404e-03 -1.64976350e-03 -2.72936724e-03] [ 2.08982965e-03 -1.84128482e-03 2.66608543e-03] [ 8.70041849e-04 1.12530872e-03 3.61755034e-03] [-9.78781390e-04 4.28396595e-04 -3.24406561e-03] [-3.23501388e-04 -1.61429847e-03 -2.47333169e-03] [ 3.35488731e-04 -3.28003647e-03 -3.59165715e-04] [ 2.98516807e-04 -2.04705670e-03 3.15216362e-03] [-2.49580176e-04 -2.87304006e-03 8.75381433e-04] [-1.49129623e-03 1.95213273e-03 4.64814806e-04] [ 1.20883110e-03 2.46377092e-03 -2.49846593e-03] [ 1.51773110e-03 2.21468216e-03 -6.10287948e-04] [-1.12484809e-03 2.25596493e-03 2.52438561e-03]] Final stress: [-1.23747815e-05 7.60993748e-06 -1.04026289e-05 -5.64314566e-05 -2.17289529e-07 -7.61909138e-05] Minimization converged after 142 steps. Minimization converged after 37 steps. Minimization converged after 41 steps. Minimization converged after 150 steps. Minimization converged after 148 steps. Minimization converged after 149 steps. Minimization converged after 151 steps. Minimization converged after 112 steps. Minimization converged after 111 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 15 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 16 steps. Minimization converged after 22 steps. Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 22 steps. Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 3.52358849e-04 1.13139638e-04 -4.32523955e-06] [-3.52358849e-04 -1.13139631e-04 -4.32524061e-06] [ 3.19078285e-04 5.70617541e-05 -1.93400065e-05] [-3.19078285e-04 -5.70617535e-05 -1.93400062e-05] [ 2.65734076e-04 1.78879583e-04 -2.78369933e-04] [-2.65734076e-04 -1.78879582e-04 -2.78369934e-04] [-5.65028820e-04 -2.28668302e-04 1.25493274e-04] [ 5.65028819e-04 2.28668300e-04 1.25493271e-04] [ 1.98607536e-05 8.41229292e-04 -3.28420401e-04] [-1.98607531e-05 -8.41229292e-04 -3.28420400e-04] [ 7.95232623e-05 -2.94008706e-04 -5.71242422e-05] [-7.95232626e-05 2.94008706e-04 -5.71242429e-05] [-3.15737935e-04 1.93458818e-04 -6.16037070e-05] [ 3.15737936e-04 -1.93458818e-04 -6.16037059e-05] [-5.55204478e-04 -2.48518278e-04 7.14428997e-04] [ 5.55204478e-04 2.48518276e-04 7.14428995e-04] [ 1.00920277e-05 3.57158553e-04 -3.67481457e-04] [-1.00920277e-05 -3.57158553e-04 -3.67481457e-04] [-3.64508339e-05 -3.38389647e-04 5.61935534e-06] [ 3.64508346e-05 3.38389648e-04 5.61935658e-06] [ 6.71577326e-04 -5.40411117e-04 5.22121221e-04] [-6.71577326e-04 5.40411118e-04 5.22121222e-04] [-6.06787300e-04 1.24325669e-04 7.41790295e-05] [ 6.06787300e-04 -1.24325675e-04 7.41790304e-05] [ 1.01900152e-04 -2.45882671e-04 2.92262274e-05] [-1.01900152e-04 2.45882670e-04 2.92262266e-05] [-1.02983481e-04 3.41878364e-04 -4.06214660e-04] [ 1.02983481e-04 -3.41878362e-04 -4.06214660e-04] [ 3.66990492e-04 6.17466295e-04 -1.02806040e-04] [-3.66990491e-04 -6.17466295e-04 -1.02806040e-04] [-4.28670279e-05 -5.82639494e-04 3.06833216e-04] [ 4.28670282e-05 5.82639494e-04 3.06833215e-04] [-5.81954984e-04 -8.09552320e-05 -1.53315075e-04] [ 5.81954983e-04 8.09552315e-05 -1.53315075e-04] [-3.23670188e-04 3.34111629e-04 1.73280894e-04] [ 3.23670188e-04 -3.34111628e-04 1.73280893e-04] [ 1.65668700e-04 2.98144243e-04 5.56624557e-04] [-1.65668699e-04 -2.98144243e-04 5.56624557e-04] [-5.53610229e-05 1.35893969e-04 6.11019897e-04] [ 5.53610236e-05 -1.35893970e-04 6.11019897e-04] [-4.38603982e-05 -2.93700184e-04 -3.35568678e-04] [ 4.38603977e-05 2.93700182e-04 -3.35568677e-04] [-4.17015233e-04 -9.91088504e-04 -3.33791170e-04] [ 4.17015232e-04 9.91088504e-04 -3.33791170e-04] [-1.80942529e-04 3.91120669e-05 3.54450928e-04] [ 1.80942529e-04 -3.91120673e-05 3.54450928e-04] [-2.11601131e-04 3.86781888e-04 4.05499143e-04] [ 2.11601131e-04 -3.86781888e-04 4.05499142e-04] [-1.21676889e-04 1.55884395e-04 -6.00625811e-04] [ 1.21676889e-04 -1.55884395e-04 -6.00625811e-04] [ 9.58377302e-05 -1.50783639e-04 -6.72530848e-04] [-9.58377301e-05 1.50783640e-04 -6.72530848e-04] [-1.56471471e-04 -1.29757681e-04 -2.33885588e-04] [ 1.56471471e-04 1.29757681e-04 -2.33885588e-04] [ 9.40003984e-05 -9.34464348e-05 8.22890394e-04] [-9.40003995e-05 9.34464328e-05 8.22890394e-04] [-5.55410936e-04 3.88133066e-05 3.25387081e-04] [ 5.55410936e-04 -3.88133084e-05 3.25387080e-04] [ 1.33113881e-04 4.18912073e-04 -8.77455189e-05] [-1.33113882e-04 -4.18912072e-04 -8.77455188e-05] [-7.13427645e-04 -3.03488629e-04 -7.54564255e-05] [ 7.13427644e-04 3.03488629e-04 -7.54564252e-05] [-1.66891908e-06 9.51888359e-05 7.87727582e-04] [ 1.66891985e-06 -9.51888351e-05 7.87727583e-04] [-4.77360582e-04 4.87844239e-04 -7.22066338e-04] [ 4.77360581e-04 -4.87844238e-04 -7.22066339e-04] [-2.77785882e-04 -1.50137909e-04 3.29563017e-04] [ 2.77785882e-04 1.50137909e-04 3.29563017e-04] [-2.11410848e-04 6.65657898e-05 -2.41672979e-04] [ 2.11410847e-04 -6.65657902e-05 -2.41672979e-04] [ 4.29128385e-04 -3.70381276e-05 -5.05192987e-04] [-4.29128386e-04 3.70381278e-05 -5.05192988e-04] [-1.05059082e-03 3.97302275e-04 -2.14618148e-04] [ 1.05059082e-03 -3.97302274e-04 -2.14618148e-04] [ 7.54081635e-05 -9.56489587e-05 -2.51070943e-04] [-7.54081635e-05 9.56489590e-05 -2.51070943e-04] [-2.93764686e-04 1.92155648e-04 3.12727002e-04] [ 2.93764686e-04 -1.92155647e-04 3.12727003e-04] [ 2.80479227e-04 2.00974546e-04 2.01523028e-05] [-2.80479226e-04 -2.00974545e-04 2.01523038e-05] [-1.06062187e-05 5.64914770e-05 1.07660116e-04] [ 1.06062185e-05 -5.64914769e-05 1.07660116e-04] [-4.80189511e-05 2.18350866e-04 -2.35495744e-04] [ 4.80189512e-05 -2.18350866e-04 -2.35495744e-04] [-2.52862403e-04 -1.25346536e-04 -2.29873178e-04] [ 2.52862403e-04 1.25346538e-04 -2.29873177e-04] [-1.75169877e-04 3.66703114e-04 -2.00118404e-04] [ 1.75169877e-04 -3.66703119e-04 -2.00118404e-04] [ 2.53901236e-04 -1.02484510e-05 -9.21299475e-05] [-2.53901236e-04 1.02484515e-05 -9.21299475e-05] [-6.93207452e-04 -2.49502601e-04 5.74167384e-05] [ 6.93207453e-04 2.49502601e-04 5.74167383e-05] [ 9.99519273e-05 -6.52794613e-05 2.76598386e-04] [-9.99519267e-05 6.52794660e-05 2.76598386e-04] [ 4.88884316e-04 -3.92933556e-04 -3.84236365e-04] [-4.88884316e-04 3.92933555e-04 -3.84236363e-04] [ 1.99419488e-04 2.19363577e-04 -1.79552078e-05] [-1.99419489e-04 -2.19363578e-04 -1.79552094e-05] [-1.76310137e-04 2.77753567e-05 1.23147200e-04] [ 1.76310138e-04 -2.77753554e-05 1.23147200e-04] [ 7.25193934e-04 -2.31944901e-04 1.70988483e-04] [-7.25193934e-04 2.31944901e-04 1.70988484e-04]] Final stress: [ 5.02998186e-05 3.06776438e-05 2.26129626e-05 9.56036108e-18 9.24964934e-16 -1.04109393e-05] Minimization converged after 114 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 3.90635937e-04 -4.17751733e-05 2.70738950e-06] [-3.90635938e-04 4.17751564e-05 2.70739308e-06] [ 3.19357311e-04 -2.17616132e-05 2.41796325e-05] [-3.19357311e-04 2.17616157e-05 2.41796300e-05] [ 3.20047601e-04 -3.18270998e-04 3.45627214e-04] [-3.20047601e-04 3.18271000e-04 3.45627215e-04] [-5.20169327e-04 2.91675208e-04 -1.96093943e-04] [ 5.20169327e-04 -2.91675207e-04 -1.96093941e-04] [ 5.47366998e-05 -7.27308307e-04 3.72752219e-04] [-5.47366997e-05 7.27308308e-04 3.72752220e-04] [ 9.00527066e-05 3.70517852e-04 -4.01870218e-05] [-9.00527067e-05 -3.70517851e-04 -4.01870204e-05] [-3.34661378e-04 -2.12407502e-04 8.35823911e-05] [ 3.34661378e-04 2.12407500e-04 8.35823898e-05] [-7.04917527e-04 4.16351694e-04 -5.41805667e-04] [ 7.04917527e-04 -4.16351689e-04 -5.41805665e-04] [ 9.79993807e-05 -3.50830263e-04 4.00891063e-04] [-9.79993803e-05 3.50830263e-04 4.00891063e-04] [-5.18925476e-05 2.37684524e-04 5.15110502e-05] [ 5.18925473e-05 -2.37684525e-04 5.15110495e-05] [ 6.07843910e-04 4.37899328e-04 -5.55257340e-04] [-6.07843910e-04 -4.37899328e-04 -5.55257340e-04] [-4.98453471e-04 -1.43115449e-04 -8.58723378e-05] [ 4.98453472e-04 1.43115434e-04 -8.58723340e-05] [-7.61223064e-06 3.13745626e-04 -1.78708673e-04] [ 7.61223055e-06 -3.13745624e-04 -1.78708670e-04] [-1.12875964e-04 -5.02764805e-04 1.83065583e-04] [ 1.12875964e-04 5.02764808e-04 1.83065584e-04] [ 3.62094669e-04 -5.21348323e-04 2.87473233e-04] [-3.62094669e-04 5.21348322e-04 2.87473232e-04] [ 1.37135036e-05 5.18112856e-04 -4.11968821e-04] [-1.37135035e-05 -5.18112857e-04 -4.11968821e-04] [-5.38577890e-04 -1.47828782e-05 9.66005230e-05] [ 5.38577890e-04 1.47828810e-05 9.66005210e-05] [-2.83097381e-04 2.77966125e-04 -4.38128453e-04] [ 2.83097381e-04 -2.77966124e-04 -4.38128452e-04] [ 2.92820435e-04 4.10511126e-04 -1.35683210e-04] [-2.92820435e-04 -4.10511125e-04 -1.35683209e-04] [ 1.05463824e-04 -3.16875234e-04 3.80609761e-04] [-1.05463822e-04 3.16875232e-04 3.80609760e-04] [-1.32829981e-04 1.38141235e-04 -5.66099205e-04] [ 1.32829979e-04 -1.38141238e-04 -5.66099204e-04] [ 1.81417669e-04 -6.12591514e-05 -3.44643914e-04] [-1.81417669e-04 6.12591521e-05 -3.44643914e-04] [ 3.82755624e-04 -8.20419153e-04 3.11367524e-04] [-3.82755624e-04 8.20419154e-04 3.11367524e-04] [ 1.05202625e-04 1.80019524e-04 6.18764657e-04] [-1.05202626e-04 -1.80019528e-04 6.18764661e-04] [ 7.70768368e-05 2.74292565e-04 -3.55820002e-04] [-7.70768365e-05 -2.74292568e-04 -3.55820005e-04] [ 1.09509522e-04 -8.23502709e-05 1.71888874e-04] [-1.09509522e-04 8.23502720e-05 1.71888873e-04] [-1.03117818e-04 -1.74452806e-04 6.14086465e-04] [ 1.03117818e-04 1.74452807e-04 6.14086465e-04] [ 3.07850827e-04 -7.13637726e-05 -3.96817271e-04] [-3.07850827e-04 7.13637714e-05 -3.96817271e-04] [-7.98501454e-05 -2.66997302e-04 -7.45110719e-04] [ 7.98501457e-05 2.66997300e-04 -7.45110719e-04] [ 7.29017377e-04 -2.18320339e-04 3.98702630e-05] [-7.29017376e-04 2.18320339e-04 3.98702629e-05] [-1.80792948e-04 2.87561378e-04 8.78160913e-05] [ 1.80792948e-04 -2.87561377e-04 8.78160916e-05] [ 4.22333735e-04 5.72417943e-04 5.13013797e-04] [-4.22333736e-04 -5.72417946e-04 5.13013795e-04] [ 2.22776475e-05 1.07223414e-04 -7.29976057e-04] [-2.22776452e-05 -1.07223417e-04 -7.29976056e-04] [ 3.44557963e-04 3.73558630e-05 3.34596273e-04] [-3.44557963e-04 -3.73558625e-05 3.34596273e-04] [ 2.44700700e-04 -1.64453228e-04 -2.16339009e-04] [-2.44700701e-04 1.64453228e-04 -2.16339008e-04] [ 7.27709176e-04 5.13713130e-04 2.06912671e-04] [-7.27709175e-04 -5.13713132e-04 2.06912671e-04] [-2.46144674e-04 2.15912163e-04 3.53378661e-04] [ 2.46144673e-04 -2.15912165e-04 3.53378661e-04] [ 3.06821970e-04 2.11854152e-04 -3.55010729e-04] [-3.06821971e-04 -2.11854151e-04 -3.55010730e-04] [ 4.71212674e-05 -8.59811891e-05 1.10671218e-04] [-4.71212677e-05 8.59811893e-05 1.10671219e-04] [ 4.48769902e-04 -1.61802471e-04 -2.87275178e-05] [-4.48769902e-04 1.61802471e-04 -2.87275181e-05] [ 1.02617107e-04 -2.03964107e-05 -3.97537658e-05] [-1.02617108e-04 2.03964109e-05 -3.97537656e-05] [-2.39803490e-05 -1.36766197e-04 1.16500754e-04] [ 2.39803487e-05 1.36766197e-04 1.16500754e-04] [-7.17000444e-05 6.64757337e-05 2.51753794e-04] [ 7.17000446e-05 -6.64757331e-05 2.51753795e-04] [-3.37075881e-04 -4.90218876e-04 2.07557705e-04] [ 3.37075882e-04 4.90218889e-04 2.07557704e-04] [ 1.34266874e-04 -6.45227965e-05 -2.30954688e-05] [-1.34266874e-04 6.45227962e-05 -2.30954678e-05] [-6.34817358e-04 1.34493175e-04 7.81193242e-06] [ 6.34817358e-04 -1.34493176e-04 7.81193272e-06] [-3.51457960e-07 6.55475904e-05 -2.27703474e-04] [ 3.51458073e-07 -6.55475790e-05 -2.27703475e-04] [-1.83621991e-04 3.47665366e-04 4.16676013e-06] [ 1.83621989e-04 -3.47665363e-04 4.16675767e-06] [-3.52154451e-04 -2.67636314e-04 5.40037801e-04] [ 3.52154452e-04 2.67636316e-04 5.40037804e-04] [-7.10455853e-04 -3.15436795e-04 -7.56141609e-05] [ 7.10455853e-04 3.15436797e-04 -7.56141642e-05] [ 1.52953180e-04 -1.10374926e-05 -3.07785467e-05] [-1.52953181e-04 1.10374946e-05 -3.07785434e-05]] Final stress: [-5.36505402e-05 -3.34406811e-05 -3.32721976e-05 6.32250751e-16 1.05893037e-15 -1.08389129e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.09351110e-04 -5.97545789e-05 2.65065264e-05] [ 5.09351109e-04 5.97546023e-05 2.65065206e-05] [-4.34443696e-04 -3.07280845e-05 9.54737205e-05] [ 4.34443696e-04 3.07280821e-05 9.54737232e-05] [-4.63257909e-04 -3.89694935e-04 4.94523783e-04] [ 4.63257909e-04 3.89694934e-04 4.94523782e-04] [ 7.18296331e-04 4.94698564e-04 -3.72737523e-04] [-7.18296330e-04 -4.94698567e-04 -3.72737528e-04] [-7.46713810e-05 -9.67480512e-04 5.30253871e-04] [ 7.46713818e-05 9.67480511e-04 5.30253872e-04] [-3.80974271e-05 4.70191333e-04 -1.14582806e-04] [ 3.80974270e-05 -4.70191335e-04 -1.14582809e-04] [ 4.85135243e-04 -2.54287574e-04 1.33983838e-04] [-4.85135243e-04 2.54287576e-04 1.33983839e-04] [ 1.07056269e-03 5.47409318e-04 -6.31605387e-04] [-1.07056269e-03 -5.47409325e-04 -6.31605390e-04] [-1.67391706e-04 -4.81814900e-04 5.34652626e-04] [ 1.67391706e-04 4.81814900e-04 5.34652627e-04] [ 2.78499832e-05 2.79874667e-04 4.04821476e-05] [-2.78499827e-05 -2.79874665e-04 4.04821475e-05] [-8.27078394e-04 5.88126379e-04 -7.52736810e-04] [ 8.27078394e-04 -5.88126380e-04 -7.52736809e-04] [ 5.98957737e-04 -2.60193075e-04 -1.77309051e-04] [-5.98957737e-04 2.60193088e-04 -1.77309056e-04] [-6.62744172e-06 3.57532970e-04 -1.52869193e-04] [ 6.62744168e-06 -3.57532974e-04 -1.52869197e-04] [ 4.91104979e-05 -6.43820366e-04 1.38160614e-04] [-4.91104979e-05 6.43820364e-04 1.38160612e-04] [-4.78058805e-04 -7.09488236e-04 3.37573755e-04] [ 4.78058806e-04 7.09488237e-04 3.37573757e-04] [ 1.37413598e-05 7.02194483e-04 -5.24127598e-04] [-1.37413599e-05 -7.02194482e-04 -5.24127598e-04] [ 6.85619378e-04 -9.80190080e-06 7.74156223e-05] [-6.85619379e-04 9.80189672e-06 7.74156237e-05] [ 3.95955414e-04 -5.20820656e-04 -1.73120574e-04] [-3.95955413e-04 5.20820656e-04 -1.73120573e-04] [-3.72996560e-04 -3.22079584e-04 -5.70893093e-04] [ 3.72996560e-04 3.22079583e-04 -5.70893093e-04] [-1.98361479e-04 -2.29333412e-04 -7.29293191e-04] [ 1.98361475e-04 2.29333414e-04 -7.29293190e-04] [ 1.18826794e-04 3.86197210e-04 5.18591369e-04] [-1.18826792e-04 -3.86197208e-04 5.18591368e-04] [ 4.59562332e-04 9.82744261e-04 4.37531192e-04] [-4.59562332e-04 -9.82744262e-04 4.37531192e-04] [ 3.03961154e-04 6.04968161e-05 -4.89466498e-04] [-3.03961153e-04 -6.04968176e-05 -4.89466499e-04] [ 1.10430621e-04 -3.35304693e-04 -5.19418612e-04] [-1.10430621e-04 3.35304697e-04 -5.19418617e-04] [ 1.70936509e-04 -2.07484529e-04 8.47976288e-04] [-1.70936510e-04 2.07484532e-04 8.47976293e-04] [-1.40610694e-04 2.73137267e-04 7.46651533e-04] [ 1.40610694e-04 -2.73137267e-04 7.46651533e-04] [ 1.16775910e-04 8.58890992e-05 2.35247319e-04] [-1.16775910e-04 -8.58891000e-05 2.35247318e-04] [-1.33641853e-04 4.49952541e-04 -9.13696037e-04] [ 1.33641854e-04 -4.49952542e-04 -9.13696037e-04] [ 3.42140546e-04 5.44953566e-05 -4.44068593e-04] [-3.42140545e-04 -5.44953580e-05 -4.44068595e-04] [-1.63879154e-04 -3.78298093e-04 2.22284462e-04] [ 1.63879154e-04 3.78298092e-04 2.22284462e-04] [ 8.93719891e-04 2.41504529e-04 -4.63421082e-07] [-8.93719891e-04 -2.41504529e-04 -4.63421332e-07] [ 1.05184786e-05 -1.84743921e-04 -9.16105685e-04] [-1.05184754e-05 1.84743924e-04 -9.16105682e-04] [ 5.46198770e-04 -7.72686400e-04 6.53282475e-04] [-5.46198772e-04 7.72686403e-04 6.53282473e-04] [ 3.57611447e-04 2.79345053e-04 -2.01667081e-04] [-3.57611445e-04 -2.79345053e-04 -2.01667082e-04] [ 4.30286286e-04 -8.93169577e-06 4.45290490e-04] [-4.30286286e-04 8.93169551e-06 4.45290492e-04] [-2.52285553e-04 -3.78691371e-04 3.27827877e-04] [ 2.52285552e-04 3.78691373e-04 3.27827878e-04] [ 8.28483187e-04 -6.32756387e-04 2.51862790e-04] [-8.28483187e-04 6.32756388e-04 2.51862791e-04] [ 7.72561081e-05 1.80413126e-04 1.20121948e-04] [-7.72561079e-05 -1.80413125e-04 1.20121947e-04] [ 4.13484119e-04 -2.04374600e-04 -5.37865965e-04] [-4.13484119e-04 2.04374601e-04 -5.37865965e-04] [-7.55255665e-04 -1.65963933e-04 -9.02516564e-05] [ 7.55255665e-04 1.65963934e-04 -9.02516550e-05] [-1.83532103e-04 -6.42208923e-05 -2.17405820e-05] [ 1.83532104e-04 6.42208931e-05 -2.17405831e-05] [ 6.02933889e-05 -1.99714606e-04 1.33306218e-04] [-6.02933895e-05 1.99714606e-04 1.33306218e-04] [ 2.20025320e-04 -3.01842122e-05 3.91331014e-04] [-2.20025321e-04 3.01842141e-05 3.91331015e-04] [ 5.24908232e-04 -7.32980851e-04 3.10103018e-04] [-5.24908232e-04 7.32980833e-04 3.10103019e-04] [-1.46100218e-04 -5.70310091e-05 -5.09634467e-05] [ 1.46100219e-04 5.70310096e-05 -5.09634485e-05] [ 7.40345516e-04 1.94167760e-04 3.38921125e-05] [-7.40345516e-04 -1.94167759e-04 3.38921121e-05] [ 7.58438252e-06 1.95963750e-04 -3.28323012e-04] [-7.58438150e-06 -1.95963759e-04 -3.28323011e-04] [-4.52968230e-04 2.95631847e-04 7.74023172e-04] [ 4.52968231e-04 -2.95631852e-04 7.74023178e-04] [-2.61545733e-04 -4.46555783e-04 4.69725407e-05] [ 2.61545732e-04 4.46555779e-04 4.69725357e-05] [ 2.07719856e-04 4.99935956e-05 -5.67286681e-05] [-2.07719857e-04 -4.99935968e-05 -5.67286634e-05] [-9.21326048e-04 3.55371960e-04 -1.35287830e-04] [ 9.21326049e-04 -3.55371960e-04 -1.35287834e-04]] Final stress: [-5.52706642e-05 -3.26466547e-05 -3.50223584e-05 -3.19471882e-15 -1.05175928e-16 1.36837133e-05] Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 114 steps. Minimization converged after 117 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 7.04038345e-04 2.35805658e-04 1.35571202e-04] [-7.04038344e-04 -2.35805672e-04 1.35571207e-04] [ 9.90931108e-04 1.16277585e-03 1.37532059e-04] [-9.90931108e-04 -1.16277585e-03 1.37532057e-04] [ 4.19360584e-04 -7.20933454e-04 -7.44094661e-04] [-4.19360583e-04 7.20933454e-04 -7.44094661e-04] [-1.41196925e-03 -1.53046088e-03 -8.34083292e-05] [ 1.41196925e-03 1.53046089e-03 -8.34083233e-05] [ 1.60110569e-04 7.59973731e-04 -6.32673582e-04] [-1.60110569e-04 -7.59973728e-04 -6.32673585e-04] [ 2.50561301e-04 1.08666299e-04 9.83032543e-04] [-2.50561300e-04 -1.08666298e-04 9.83032545e-04] [-1.22976583e-03 8.69953235e-05 -1.05851871e-03] [ 1.22976583e-03 -8.69953249e-05 -1.05851872e-03] [-2.01157588e-03 -9.68789115e-04 -1.63074047e-03] [ 2.01157588e-03 9.68789121e-04 -1.63074047e-03] [ 9.37648853e-05 1.35355413e-03 -1.32080213e-03] [-9.37648832e-05 -1.35355413e-03 -1.32080213e-03] [ 3.72772708e-04 -2.17801013e-04 9.23766530e-04] [-3.72772708e-04 2.17801007e-04 9.23766528e-04] [ 1.92231007e-03 -1.02042523e-03 1.57679080e-04] [-1.92231007e-03 1.02042523e-03 1.57679079e-04] [-1.51130724e-03 1.68363972e-04 5.46467116e-04] [ 1.51130724e-03 -1.68363980e-04 5.46467117e-04] [ 3.03838493e-04 6.27704327e-04 -4.32187745e-04] [-3.03838493e-04 -6.27704326e-04 -4.32187740e-04] [-8.14320174e-05 9.00102984e-04 2.24695802e-03] [ 8.14320162e-05 -9.00102985e-04 2.24695802e-03] [ 9.84134255e-04 5.19945749e-04 -6.90835951e-04] [-9.84134254e-04 -5.19945751e-04 -6.90835952e-04] [ 1.45689605e-04 8.67637282e-04 5.30219331e-04] [-1.45689607e-04 -8.67637282e-04 5.30219330e-04] [-1.39262818e-03 -9.15937174e-04 -1.87667963e-04] [ 1.39262818e-03 9.15937176e-04 -1.87667964e-04] [-1.40037741e-03 2.29827581e-04 -2.90846731e-05] [ 1.40037741e-03 -2.29827582e-04 -2.90846725e-05] [ 3.95417859e-04 1.03813437e-03 7.33643470e-04] [-3.95417860e-04 -1.03813438e-03 7.33643470e-04] [-1.81735026e-04 1.47174319e-04 1.71393407e-03] [ 1.81735029e-04 -1.47174321e-04 1.71393407e-03] [ 3.61944856e-04 -1.50767050e-04 -8.11934312e-04] [-3.61944858e-04 1.50767047e-04 -8.11934309e-04] [-6.27126360e-04 -9.46118164e-04 -1.07122398e-03] [ 6.27126360e-04 9.46118164e-04 -1.07122398e-03] [-8.70256630e-06 -1.57138509e-03 1.06300733e-03] [ 8.70256551e-06 1.57138509e-03 1.06300733e-03] [-2.22862980e-04 1.43716702e-03 6.02929016e-04] [ 2.22862982e-04 -1.43716703e-03 6.02929018e-04] [ 2.62526527e-04 -6.12327737e-05 -1.32199119e-03] [-2.62526529e-04 6.12327707e-05 -1.32199119e-03] [ 6.10807095e-04 -7.00759875e-04 -5.44547917e-04] [-6.10807094e-04 7.00759876e-04 -5.44547916e-04] [-7.80275693e-04 -1.18831488e-04 -2.36073011e-04] [ 7.80275692e-04 1.18831489e-04 -2.36073011e-04] [ 4.43686751e-04 -3.75309741e-04 4.98883984e-04] [-4.43686752e-04 3.75309743e-04 4.98883983e-04] [-1.12150672e-03 -1.16057115e-04 -6.97242730e-04] [ 1.12150672e-03 1.16057116e-04 -6.97242729e-04] [ 1.23985437e-03 8.18410133e-04 -6.70522827e-04] [-1.23985438e-03 -8.18410131e-04 -6.70522826e-04] [-9.00713245e-04 -7.94464509e-04 1.47869900e-04] [ 9.00713246e-04 7.94464510e-04 1.47869900e-04] [ 6.74141054e-04 3.16396779e-04 1.20552185e-03] [-6.74141056e-04 -3.16396780e-04 1.20552185e-03] [-5.45819951e-04 1.30071895e-03 -2.74651304e-03] [ 5.45819953e-04 -1.30071895e-03 -2.74651304e-03] [-1.02137929e-03 -5.99776157e-04 7.30962174e-04] [ 1.02137929e-03 5.99776157e-04 7.30962174e-04] [-7.05955721e-04 6.15363760e-04 -1.11026278e-03] [ 7.05955722e-04 -6.15363758e-04 -1.11026278e-03] [ 1.30662786e-03 7.28565216e-04 1.61646952e-04] [-1.30662786e-03 -7.28565216e-04 1.61646950e-04] [-2.31444851e-03 1.11709242e-04 7.77395260e-04] [ 2.31444851e-03 -1.11709242e-04 7.77395260e-04] [ 7.03342046e-04 -5.88357070e-04 4.81116720e-04] [-7.03342046e-04 5.88357071e-04 4.81116723e-04] [-8.94547178e-04 8.86214729e-04 1.73889274e-03] [ 8.94547177e-04 -8.86214728e-04 1.73889274e-03] [ 7.84832936e-04 -3.70447608e-04 6.02566148e-05] [-7.84832938e-04 3.70447605e-04 6.02566130e-05] [ 3.97557236e-04 -2.17340206e-03 -1.10099944e-04] [-3.97557237e-04 2.17340206e-03 -1.10099945e-04] [-1.25841079e-04 -6.00620870e-04 -6.11596041e-04] [ 1.25841080e-04 6.00620871e-04 -6.11596038e-04] [-3.25394135e-04 -2.03561722e-04 3.05019393e-04] [ 3.25394135e-04 2.03561719e-04 3.05019390e-04] [-1.00754804e-04 4.36991667e-04 -1.50157031e-04] [ 1.00754805e-04 -4.36991656e-04 -1.50157029e-04] [ 3.05248440e-04 1.70177139e-03 -4.30040092e-04] [-3.05248439e-04 -1.70177139e-03 -4.30040092e-04] [-1.57141339e-03 -9.02774255e-04 9.56706076e-04] [ 1.57141339e-03 9.02774256e-04 9.56706075e-04] [ 5.89618727e-05 3.23524540e-04 2.86241547e-04] [-5.89618732e-05 -3.23524530e-04 2.86241548e-04] [ 7.29301607e-05 -8.39348792e-04 -3.80784854e-04] [-7.29301623e-05 8.39348793e-04 -3.80784859e-04] [-2.04667947e-04 5.47799379e-04 9.73925228e-04] [ 2.04667945e-04 -5.47799377e-04 9.73925231e-04] [-1.05350264e-03 -5.10853251e-05 -3.82275318e-04] [ 1.05350264e-03 5.10853255e-05 -3.82275322e-04] [ 1.01473211e-03 -3.21581161e-04 -1.38989353e-05] [-1.01473211e-03 3.21581161e-04 -1.38989322e-05]] Final stress: [-3.23770414e-05 -4.33174576e-05 -1.61344975e-05 -2.61147049e-15 -1.12347014e-15 -2.67549241e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-7.04180722e-04 2.36540720e-04 1.35115058e-04] [ 7.04180721e-04 -2.36540717e-04 1.35115058e-04] [-9.91814703e-04 1.16049967e-03 1.37702299e-04] [ 9.91814704e-04 -1.16049967e-03 1.37702301e-04] [-4.19537853e-04 -7.19696623e-04 -7.38127611e-04] [ 4.19537853e-04 7.19696626e-04 -7.38127606e-04] [ 1.41328584e-03 -1.52882772e-03 -7.49452120e-05] [-1.41328584e-03 1.52882772e-03 -7.49452114e-05] [-1.59896205e-04 7.62531934e-04 -6.32680374e-04] [ 1.59896203e-04 -7.62531933e-04 -6.32680375e-04] [-2.51000672e-04 1.09331980e-04 9.78649796e-04] [ 2.51000672e-04 -1.09331980e-04 9.78649795e-04] [ 1.22942461e-03 8.81574476e-05 -1.05774208e-03] [-1.22942461e-03 -8.81574496e-05 -1.05774209e-03] [ 2.01872033e-03 -9.68754366e-04 -1.61931279e-03] [-2.01872033e-03 9.68754365e-04 -1.61931279e-03] [-9.95778980e-05 1.35154607e-03 -1.31849419e-03] [ 9.95778987e-05 -1.35154607e-03 -1.31849420e-03] [-3.70200223e-04 -2.18690729e-04 9.22816886e-04] [ 3.70200222e-04 2.18690727e-04 9.22816885e-04] [-1.92007065e-03 -1.02457854e-03 1.54434710e-04] [ 1.92007065e-03 1.02457854e-03 1.54434709e-04] [ 1.51060016e-03 1.66249214e-04 5.47143296e-04] [-1.51060016e-03 -1.66249232e-04 5.47143298e-04] [-3.03353610e-04 6.23301861e-04 -4.30909587e-04] [ 3.03353610e-04 -6.23301859e-04 -4.30909583e-04] [ 7.64907632e-05 8.99748916e-04 2.23737403e-03] [-7.64907639e-05 -8.99748910e-04 2.23737403e-03] [-9.82304747e-04 5.23200355e-04 -6.86757189e-04] [ 9.82304748e-04 -5.23200355e-04 -6.86757189e-04] [-1.47152716e-04 8.64080303e-04 5.28333144e-04] [ 1.47152717e-04 -8.64080302e-04 5.28333144e-04] [ 1.39129682e-03 -9.12619367e-04 -1.89888122e-04] [-1.39129682e-03 9.12619368e-04 -1.89888120e-04] [ 3.90954832e-04 -1.03528206e-03 7.33785145e-04] [-3.90954834e-04 1.03528206e-03 7.33785143e-04] [-1.40041473e-03 -2.25968171e-04 -3.47786669e-05] [ 1.40041473e-03 2.25968170e-04 -3.47786683e-05] [ 3.65322290e-04 1.57127373e-04 -8.17575732e-04] [-3.65322288e-04 -1.57127376e-04 -8.17575738e-04] [-1.80979879e-04 -1.43362250e-04 1.71526427e-03] [ 1.80979875e-04 1.43362249e-04 1.71526428e-03] [-9.75639450e-06 1.57157551e-03 1.06206521e-03] [ 9.75639383e-06 -1.57157551e-03 1.06206521e-03] [-6.27186303e-04 9.48929861e-04 -1.06760045e-03] [ 6.27186304e-04 -9.48929860e-04 -1.06760045e-03] [ 2.63300887e-04 5.94406420e-05 -1.32383232e-03] [-2.63300886e-04 -5.94406445e-05 -1.32383231e-03] [-2.16027096e-04 -1.43566288e-03 6.05858172e-04] [ 2.16027096e-04 1.43566288e-03 6.05858169e-04] [-7.80359790e-04 1.18256029e-04 -2.32540779e-04] [ 7.80359789e-04 -1.18256029e-04 -2.32540780e-04] [ 6.05210968e-04 7.00312723e-04 -5.43822185e-04] [-6.05210967e-04 -7.00312723e-04 -5.43822187e-04] [-1.11952627e-03 1.24432527e-04 -6.91856543e-04] [ 1.11952627e-03 -1.24432528e-04 -6.91856541e-04] [ 4.32240681e-04 3.72855791e-04 4.97788034e-04] [-4.32240681e-04 -3.72855791e-04 4.97788033e-04] [-8.97402469e-04 7.97581821e-04 1.48181268e-04] [ 8.97402469e-04 -7.97581821e-04 1.48181268e-04] [ 1.23823753e-03 -8.14923121e-04 -6.71254464e-04] [-1.23823753e-03 8.14923123e-04 -6.71254465e-04] [-5.48896442e-04 -1.29683103e-03 -2.74387156e-03] [ 5.48896443e-04 1.29683103e-03 -2.74387156e-03] [ 6.76648958e-04 -3.12240827e-04 1.20537479e-03] [-6.76648957e-04 3.12240827e-04 1.20537479e-03] [-7.06670696e-04 -6.09044066e-04 -1.10348983e-03] [ 7.06670694e-04 6.09044066e-04 -1.10348983e-03] [-1.01676834e-03 6.03694118e-04 7.30797120e-04] [ 1.01676834e-03 -6.03694118e-04 7.30797118e-04] [-2.30773779e-03 -1.24989037e-04 7.67729545e-04] [ 2.30773780e-03 1.24989040e-04 7.67729545e-04] [ 1.29054860e-03 -7.30270659e-04 1.65101476e-04] [-1.29054860e-03 7.30270661e-04 1.65101477e-04] [-8.90926281e-04 -8.82204016e-04 1.73504340e-03] [ 8.90926281e-04 8.82204016e-04 1.73504340e-03] [ 7.00833652e-04 5.91872044e-04 4.75379342e-04] [-7.00833652e-04 -5.91872044e-04 4.75379342e-04] [-7.95483252e-04 -3.66219755e-04 5.53803001e-05] [ 7.95483251e-04 3.66219753e-04 5.53802975e-05] [-3.92614994e-04 -2.17072147e-03 -1.07601369e-04] [ 3.92614995e-04 2.17072147e-03 -1.07601370e-04] [ 1.29401773e-04 -5.98683004e-04 -6.17953001e-04] [-1.29401773e-04 5.98683004e-04 -6.17953002e-04] [ 3.24532211e-04 -2.03425099e-04 3.05929608e-04] [-3.24532211e-04 2.03425100e-04 3.05929609e-04] [ 1.07882808e-04 4.39336284e-04 -1.50094618e-04] [-1.07882808e-04 -4.39336287e-04 -1.50094620e-04] [-3.11458312e-04 1.70057888e-03 -4.29873523e-04] [ 3.11458311e-04 -1.70057888e-03 -4.29873521e-04] [ 1.56424627e-03 -9.01717587e-04 9.62904808e-04] [-1.56424627e-03 9.01717586e-04 9.62904806e-04] [-5.69514646e-05 3.20596981e-04 2.87286412e-04] [ 5.69514647e-05 -3.20596968e-04 2.87286411e-04] [-2.01786717e-04 -5.52223233e-04 9.72756031e-04] [ 2.01786718e-04 5.52223232e-04 9.72756030e-04] [ 6.99628594e-05 8.36212483e-04 -3.89860450e-04] [-6.99628613e-05 -8.36212483e-04 -3.89860447e-04] [ 1.01441550e-03 3.26403904e-04 -1.24516988e-05] [-1.01441549e-03 -3.26403903e-04 -1.24517022e-05] [-1.05026539e-03 5.11778673e-05 -3.80879799e-04] [ 1.05026539e-03 -5.11778667e-05 -3.80879796e-04]] Final stress: [-3.23692323e-05 -4.33765112e-05 -1.61363036e-05 -5.05561565e-16 -1.14737376e-15 2.67291997e-05] Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 111 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.44435027e-03 2.23663773e-03 -3.56398618e-03] [-2.44435027e-03 -2.23663773e-03 -3.56398618e-03] [ 1.13928943e-03 -6.66514119e-03 7.03872463e-04] [-1.13928943e-03 6.66514120e-03 7.03872465e-04] [-2.63216103e-03 5.06271201e-03 -2.39288005e-03] [ 2.63216103e-03 -5.06271201e-03 -2.39288005e-03] [ 1.82097722e-03 -1.41816213e-03 1.74591864e-04] [-1.82097722e-03 1.41816213e-03 1.74591874e-04] [-1.90681994e-03 2.09230705e-03 2.86628864e-03] [ 1.90681994e-03 -2.09230703e-03 2.86628863e-03] [ 2.54822635e-03 -6.95672895e-04 2.54547517e-03] [-2.54822635e-03 6.95672894e-04 2.54547518e-03] [ 2.25897667e-03 -3.55753606e-03 -1.02808426e-03] [-2.25897667e-03 3.55753606e-03 -1.02808426e-03] [ 9.53981525e-03 2.80891947e-03 -6.04980883e-04] [-9.53981525e-03 -2.80891947e-03 -6.04980880e-04] [-5.42806034e-03 5.84688209e-04 1.62799154e-04] [ 5.42806034e-03 -5.84688209e-04 1.62799156e-04] [-2.13323646e-03 2.47826165e-03 1.60093524e-03] [ 2.13323646e-03 -2.47826164e-03 1.60093524e-03] [-9.65742239e-04 6.07776449e-04 5.59536208e-04] [ 9.65742245e-04 -6.07776437e-04 5.59536206e-04] [ 5.45046706e-03 -2.39749589e-03 1.68098614e-03] [-5.45046705e-03 2.39749588e-03 1.68098615e-03] [-1.47621115e-03 2.44986053e-04 -5.17673087e-03] [ 1.47621115e-03 -2.44986045e-04 -5.17673085e-03] [-3.31430305e-03 5.39757712e-04 2.95995914e-03] [ 3.31430304e-03 -5.39757710e-04 2.95995913e-03] [-2.08736245e-04 8.62168344e-03 -9.93454407e-03] [ 2.08736244e-04 -8.62168344e-03 -9.93454408e-03] [-4.26713433e-03 -7.88073520e-03 1.48316778e-03] [ 4.26713434e-03 7.88073520e-03 1.48316778e-03] [-5.15140300e-03 1.88266643e-03 -2.89132549e-03] [ 5.15140300e-03 -1.88266643e-03 -2.89132549e-03] [-1.36035494e-03 3.06061078e-03 -1.53158094e-03] [ 1.36035494e-03 -3.06061077e-03 -1.53158094e-03] [ 4.89450978e-03 1.28505111e-03 -2.35653401e-03] [-4.89450977e-03 -1.28505111e-03 -2.35653401e-03] [ 1.11836999e-03 1.25449589e-03 2.12447254e-03] [-1.11836998e-03 -1.25449589e-03 2.12447254e-03] [-4.09751384e-03 -3.68077747e-03 -4.01956280e-03] [ 4.09751383e-03 3.68077747e-03 -4.01956280e-03] [ 2.24843256e-04 5.33319135e-03 4.76479461e-03] [-2.24843254e-04 -5.33319135e-03 4.76479461e-03] [ 5.48758562e-05 8.74887835e-04 6.53375041e-03] [-5.48758579e-05 -8.74887836e-04 6.53375041e-03] [ 2.61374948e-03 5.14909543e-03 8.59928618e-03] [-2.61374948e-03 -5.14909545e-03 8.59928616e-03] [-5.13922317e-03 1.17765807e-03 -7.95892321e-03] [ 5.13922317e-03 -1.17765807e-03 -7.95892320e-03] [-3.91486544e-03 -4.41210150e-04 -1.10156445e-03] [ 3.91486544e-03 4.41210153e-04 -1.10156445e-03] [ 3.05043183e-03 -4.17364080e-03 5.03370189e-03] [-3.05043183e-03 4.17364080e-03 5.03370189e-03] [ 2.35203636e-03 2.71975836e-03 1.47912001e-03] [-2.35203635e-03 -2.71975835e-03 1.47912000e-03] [ 2.14839719e-03 -2.56181750e-03 5.49786992e-03] [-2.14839718e-03 2.56181750e-03 5.49786992e-03] [-2.66801498e-03 1.19723956e-03 -3.22954904e-03] [ 2.66801498e-03 -1.19723956e-03 -3.22954904e-03] [ 2.88648651e-03 6.10174668e-03 -7.28270224e-03] [-2.88648651e-03 -6.10174669e-03 -7.28270225e-03] [ 1.22229125e-03 -6.18938528e-04 1.56777885e-03] [-1.22229127e-03 6.18938528e-04 1.56777886e-03] [-6.50445966e-03 1.09911952e-03 -4.14630628e-03] [ 6.50445965e-03 -1.09911952e-03 -4.14630629e-03] [-4.58757798e-03 -2.28789843e-03 -7.98584401e-04] [ 4.58757797e-03 2.28789843e-03 -7.98584395e-04] [ 1.03464520e-02 7.58044719e-03 1.34733744e-03] [-1.03464520e-02 -7.58044719e-03 1.34733744e-03] [ 1.95118815e-03 7.40314150e-03 -8.02947227e-03] [-1.95118815e-03 -7.40314150e-03 -8.02947227e-03] [ 4.78399855e-03 1.15947469e-02 5.85735412e-03] [-4.78399854e-03 -1.15947469e-02 5.85735412e-03] [ 1.86734880e-03 3.34927758e-03 2.89125585e-03] [-1.86734880e-03 -3.34927759e-03 2.89125586e-03] [ 6.88444774e-03 -6.76139798e-04 5.80779607e-03] [-6.88444774e-03 6.76139796e-04 5.80779607e-03] [-8.27869472e-03 -2.96803059e-03 3.60690670e-03] [ 8.27869473e-03 2.96803059e-03 3.60690669e-03] [-5.10542936e-03 3.67115911e-04 -1.41035146e-03] [ 5.10542936e-03 -3.67115909e-04 -1.41035146e-03] [ 2.86586663e-03 -4.41623661e-03 -3.59816229e-03] [-2.86586663e-03 4.41623661e-03 -3.59816229e-03] [-4.14339110e-03 2.51839657e-03 -8.67097222e-04] [ 4.14339109e-03 -2.51839658e-03 -8.67097234e-04] [-3.14650038e-03 -5.85300640e-03 -4.59464509e-03] [ 3.14650039e-03 5.85300640e-03 -4.59464508e-03] [ 6.93611337e-03 -2.72061190e-04 -2.91488757e-03] [-6.93611336e-03 2.72061185e-04 -2.91488757e-03] [-4.06487245e-03 -7.32791721e-04 -1.13512792e-03] [ 4.06487244e-03 7.32791716e-04 -1.13512791e-03] [-3.17701220e-03 -2.07957132e-04 1.84479283e-03] [ 3.17701220e-03 2.07957146e-04 1.84479283e-03] [ 2.51330105e-03 -3.80193695e-03 9.70583164e-04] [-2.51330105e-03 3.80193696e-03 9.70583164e-04] [-8.32817880e-03 -5.04502987e-04 3.44642748e-03] [ 8.32817879e-03 5.04502983e-04 3.44642748e-03] [-5.81395686e-03 -2.83472609e-03 5.26916925e-03] [ 5.81395685e-03 2.83472608e-03 5.26916924e-03] [-3.64349309e-03 -5.64280037e-03 -8.12426113e-04] [ 3.64349309e-03 5.64280037e-03 -8.12426110e-04]] Final stress: [ 1.00874616e-05 -1.73345314e-05 3.54782502e-04 6.97547845e-15 -8.30317360e-15 3.04630112e-04] Minimization converged after 119 steps. Minimization converged after 118 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 138 steps. Minimization converged after 134 steps. Minimization converged after 141 steps. Minimization converged after 145 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 145 steps. Minimization converged after 150 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-1.68850535e-03 -1.19353050e-03 -6.10107273e-04] [-2.92539454e-03 1.40459582e-03 -3.77172791e-04] [-6.66881663e-04 1.97937994e-04 -4.50323346e-04] [-3.44141702e-03 -2.62602301e-04 7.05113660e-06] [-4.05902830e-03 -4.57207683e-04 8.86078263e-06] [-2.23845720e-03 1.03425090e-03 -3.91436938e-05] [-1.83298476e-04 2.66205258e-04 -4.12925128e-04] [ 3.03340789e-03 3.92375503e-04 2.58555799e-04] [ 8.21099094e-05 -7.80564097e-07 -5.27380947e-05] [-3.58342948e-03 1.98332686e-04 -2.35421278e-04] [ 4.99470362e-03 7.08076752e-04 -4.52337552e-04] [ 7.63791127e-05 -3.50504028e-04 -1.77696467e-04] [-2.68712929e-03 6.60649789e-06 1.93898697e-05] [ 1.64528571e-03 2.00026596e-04 3.26694854e-04] [-4.17876069e-03 6.17089132e-04 1.60015434e-04] [ 3.32705962e-03 -6.40012034e-04 2.29647597e-04] [ 1.53651636e-03 -2.53975466e-04 6.40425644e-05] [-1.35525761e-04 -8.62493221e-06 -1.79191752e-04] [ 2.07769717e-03 -1.57772105e-04 -1.39259018e-04] [-2.03476491e-03 1.66799548e-04 -1.38877964e-04] [ 2.84414730e-03 3.31195522e-05 1.10326786e-04] [ 2.82019371e-04 1.18450424e-04 -9.10651896e-06] [ 1.94009774e-04 -2.37834896e-04 -3.48471319e-05] [ 5.27322905e-03 2.86931514e-05 -1.19019322e-04] [-2.34670355e-03 -1.67095399e-06 -3.54256678e-04] [-2.65703704e-03 3.44331163e-04 -6.43715259e-04] [-9.13352113e-04 -3.21160653e-04 -3.23147819e-04] [ 4.30042201e-04 3.48149210e-04 -8.21283609e-04] [ 2.18487414e-03 1.62188721e-04 3.96312538e-04] [-3.17370140e-03 -6.86186586e-04 3.67321910e-04] [-3.52153323e-04 -3.91560960e-04 -6.99888532e-04] [-1.71265527e-03 4.97678689e-05 -2.80670148e-04] [-6.94275346e-04 -3.33861436e-04 1.45924851e-04] [ 1.34121662e-03 3.97329540e-05 1.53469635e-04] [-3.34276846e-03 1.22373214e-03 4.69095645e-05] [ 2.51473155e-03 1.47094746e-04 -1.37944319e-03] [ 1.66891709e-03 5.05865419e-05 1.95741098e-03] [-3.59087351e-04 -1.82527157e-03 5.93132216e-04] [ 1.10047445e-04 4.76350470e-05 -9.36485387e-04] [-3.58466177e-04 -1.69468888e-03 2.84138300e-03] [-2.74349632e-04 2.11244219e-03 -1.86347211e-03] [-1.61636970e-05 -6.49077934e-04 1.91244289e-03] [ 2.10615222e-03 -5.75822517e-03 -3.03913279e-03] [ 3.59282004e-03 2.45911914e-03 2.47319631e-03] [ 3.12433594e-03 -7.14318775e-04 -9.84290211e-04] [ 2.02961415e-03 4.91852539e-03 3.07074340e-03] [-7.01997814e-04 1.49614722e-03 -1.78526620e-03] [ 8.90166959e-04 -9.77672806e-04 -2.66410940e-03] [ 7.95059886e-04 1.23271468e-03 2.20684211e-03] [-9.46138309e-04 -1.41343016e-03 1.94036309e-03] [ 1.82119622e-03 1.35684679e-04 1.06869343e-03] [-1.44956042e-03 -2.32675130e-04 -1.43542252e-03] [-3.16501151e-03 -1.23662386e-04 1.03614329e-03] [ 2.22577689e-03 -1.54068979e-04 -1.49528152e-03] [-1.51193427e-04 -9.50807306e-04 -1.84892622e-03] [-2.27791687e-03 -3.84889525e-04 1.05454120e-03] [-2.95492706e-03 1.24646306e-03 -1.58671338e-03] [ 1.32613060e-03 -9.52883681e-04 1.23445260e-03] [ 1.31759992e-03 -4.00839984e-03 -1.89842793e-03] [-3.28108966e-03 -8.93867930e-04 9.88230468e-04] [-3.20924538e-03 3.57987165e-04 -1.01419429e-03] [ 1.48034653e-03 4.88379358e-03 1.27011104e-03] [-1.45936574e-04 -9.30789501e-04 -1.43044850e-03] [ 1.48018423e-03 -3.53298853e-03 2.90842504e-03] [ 1.26256256e-03 3.89520886e-03 -2.99011989e-03] [-4.82130566e-04 7.73786949e-04 7.73269484e-04] [ 2.79020017e-03 2.19639731e-03 2.48345798e-03] [-1.14287471e-03 -1.14344322e-03 2.61534568e-03] [-9.46630886e-04 1.21559289e-03 -3.13033897e-03] [ 2.72792513e-03 -2.39188871e-03 -2.23624277e-03] [ 1.91227255e-03 4.10691373e-04 -1.74770866e-03] [-1.11601657e-03 -3.39256855e-03 1.36158578e-03] [-2.29665779e-03 7.87044141e-04 -8.79008096e-04] [ 2.72099645e-03 7.94057781e-04 2.01006227e-03] [-3.01349699e-04 1.70193523e-03 -7.00405235e-04] [-3.44819298e-03 -1.28255186e-03 1.35900959e-03] [-3.70924190e-03 1.12567594e-03 -1.69065566e-03] [-6.20673916e-04 -1.39714524e-03 9.19541041e-04] [ 1.48636135e-03 -3.13772401e-04 3.97491831e-04] [-1.44445432e-03 4.40331811e-04 1.19772077e-03] [ 4.66418805e-03 1.23968746e-04 1.35708889e-04] [-4.44727173e-03 -6.17445527e-05 4.75162140e-05] [ 1.65458004e-03 2.67991900e-04 -3.61250407e-04] [ 1.56519417e-03 -1.15281368e-04 -2.81047923e-04] [ 5.04548596e-04 5.92857920e-04 -7.32696052e-04] [-4.52257050e-03 -5.39331252e-04 -4.76841553e-04] [ 1.12831590e-04 -7.37024351e-04 -4.68795015e-04] [ 3.81788548e-03 -7.68874919e-04 -9.49839336e-05] [-1.48496000e-03 -1.51440139e-04 -2.13050004e-05] [ 6.20365865e-03 4.76558717e-04 -2.32044602e-04] [-1.20751879e-03 -2.33065147e-05 8.95484815e-06] [ 1.91599948e-03 -1.31790385e-06 2.29174794e-04] [ 2.07791700e-03 5.02536728e-04 1.51690972e-04] [-2.74548958e-03 -7.51389155e-04 3.05289742e-04] [-2.39494457e-03 -1.52590697e-04 6.01982919e-04] [ 8.09764177e-04 -5.13068109e-03 -2.19593400e-03] [ 4.50447458e-04 3.97357678e-03 2.66535860e-03] [-1.52949440e-03 2.01930788e-03 -1.74396968e-04] [-4.75397320e-05 -9.00022333e-04 1.94244838e-03] [ 2.36191130e-03 -1.90449868e-03 -7.04849703e-04] [ 1.23562876e-03 3.46396451e-03 2.65715936e-03] [ 1.13685213e-04 2.63735328e-04 -1.68203607e-03]] Final stress: [-1.35775127e-05 7.11859205e-06 -1.34250686e-05 5.47608154e-07 2.05346259e-05 -3.70211055e-05] Minimization converged after 147 steps. Minimization converged after 113 steps. Minimization converged after 113 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 14 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 11 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 21 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 120 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-6.75168153e-04 2.66810420e-04 5.55355973e-05] [ 6.75168152e-04 -2.66810410e-04 5.55355960e-05] [-6.55573558e-04 2.08076117e-04 -2.21391367e-04] [ 6.55573557e-04 -2.08076116e-04 -2.21391365e-04] [-5.60188227e-04 2.48050312e-04 -4.50119179e-04] [ 5.60188226e-04 -2.48050313e-04 -4.50119177e-04] [ 1.14805026e-03 -2.00829927e-04 -1.92813779e-04] [-1.14805026e-03 2.00829928e-04 -1.92813781e-04] [-6.49223601e-05 1.62713558e-03 -7.25447908e-04] [ 6.49223599e-05 -1.62713558e-03 -7.25447909e-04] [-1.01466736e-04 -6.30276186e-04 -1.12668034e-04] [ 1.01466736e-04 6.30276184e-04 -1.12668034e-04] [ 7.70104616e-04 1.92999852e-04 -8.73679050e-05] [-7.70104616e-04 -1.92999852e-04 -8.73679060e-05] [ 1.10281939e-03 -1.31595018e-04 1.14471078e-03] [-1.10281939e-03 1.31595013e-04 1.14471078e-03] [-9.66876033e-05 5.44899907e-04 -5.12207484e-04] [ 9.66876038e-05 -5.44899908e-04 -5.12207484e-04] [ 1.36701797e-04 -6.74629295e-04 1.67181458e-04] [-1.36701797e-04 6.74629296e-04 1.67181458e-04] [-1.48139151e-03 -1.24968682e-03 9.90347858e-04] [ 1.48139151e-03 1.24968681e-03 9.90347860e-04] [ 1.40140553e-03 3.44662585e-04 2.28660506e-05] [-1.40140553e-03 -3.44662587e-04 2.28660496e-05] [-3.02706203e-04 -2.27456198e-04 -3.33670424e-05] [ 3.02706202e-04 2.27456199e-04 -3.33670410e-05] [ 1.54193308e-04 3.47900696e-04 -6.76124703e-04] [-1.54193309e-04 -3.47900697e-04 -6.76124701e-04] [-6.83031144e-04 1.31150812e-03 -1.82978870e-04] [ 6.83031146e-04 -1.31150812e-03 -1.82978869e-04] [-5.33102485e-05 -1.21753868e-03 6.33891378e-04] [ 5.33102480e-05 1.21753868e-03 6.33891378e-04] [ 1.25384546e-03 -2.07256098e-04 -2.12567621e-04] [-1.25384546e-03 2.07256094e-04 -2.12567622e-04] [ 3.24777162e-04 -7.02091937e-04 1.22100261e-03] [-3.24777162e-04 7.02091938e-04 1.22100261e-03] [-7.10223657e-04 -4.62483056e-04 2.70661170e-04] [ 7.10223656e-04 4.62483055e-04 2.70661170e-04] [ 3.19822539e-05 4.91997395e-04 -6.33046405e-04] [-3.19822530e-05 -4.91997396e-04 -6.33046406e-04] [-2.37839919e-04 -2.58574272e-04 1.30291172e-03] [ 2.37839920e-04 2.58574271e-04 1.30291172e-03] [-2.56466276e-04 6.50059672e-05 7.36612058e-04] [ 2.56466277e-04 -6.50059680e-05 7.36612058e-04] [-8.80888699e-04 2.09241156e-03 -8.30138747e-04] [ 8.80888699e-04 -2.09241156e-03 -8.30138746e-04] [-3.59854588e-05 -2.71915870e-04 -1.04316339e-03] [ 3.59854579e-05 2.71915871e-04 -1.04316340e-03] [-4.75749054e-04 -8.68607961e-04 9.08904483e-04] [ 4.75749054e-04 8.68607963e-04 9.08904485e-04] [-3.32125196e-04 3.38732192e-04 -5.17424125e-04] [ 3.32125197e-04 -3.38732190e-04 -5.17424125e-04] [ 3.61699433e-04 5.81308714e-05 -1.31369203e-03] [-3.61699435e-04 -5.81308672e-05 -1.31369203e-03] [-1.14622680e-03 -2.31290480e-04 4.23632974e-04] [ 1.14622680e-03 2.31290481e-04 4.23632974e-04] [ 1.39279333e-04 2.72143857e-04 1.61484841e-03] [-1.39279333e-04 -2.72143856e-04 1.61484841e-03] [-1.42265700e-03 6.04737147e-04 -9.12425576e-05] [ 1.42265700e-03 -6.04737145e-04 -9.12425571e-05] [ 3.08991501e-04 -8.15278177e-04 -1.84296189e-04] [-3.08991501e-04 8.15278177e-04 -1.84296190e-04] [-6.85295214e-04 -7.74434003e-04 -1.92676135e-03] [ 6.85295214e-04 7.74434005e-04 -1.92676135e-03] [ 3.81959084e-05 -4.30982469e-04 1.60948071e-03] [-3.81959091e-05 4.30982471e-04 1.60948071e-03] [-4.09289655e-04 -1.41385120e-04 -4.10915155e-04] [ 4.09289655e-04 1.41385121e-04 -4.10915155e-04] [-3.15145674e-04 4.14985441e-04 7.34213384e-04] [ 3.15145674e-04 -4.14985439e-04 7.34213383e-04] [-2.40640733e-03 -3.77315727e-04 -4.50679234e-04] [ 2.40640733e-03 3.77315728e-04 -4.50679236e-04] [ 1.18824266e-03 1.60012977e-04 -1.04580370e-03] [-1.18824265e-03 -1.60012974e-04 -1.04580370e-03] [-4.78516071e-04 -3.39659839e-04 5.69157160e-04] [ 4.78516071e-04 3.39659839e-04 5.69157163e-04] [ 3.83941619e-04 1.28017162e-04 -6.27603526e-04] [-3.83941620e-04 -1.28017162e-04 -6.27603528e-04] [-5.34501758e-04 3.86266078e-04 3.02297260e-05] [ 5.34501758e-04 -3.86266078e-04 3.02297224e-05] [ 6.84758077e-05 2.17142795e-04 2.06455977e-04] [-6.84758085e-05 -2.17142795e-04 2.06455975e-04] [ 2.06752524e-04 5.36576280e-04 -5.67683791e-04] [-2.06752523e-04 -5.36576281e-04 -5.67683791e-04] [ 5.31370977e-04 -3.65101216e-04 -2.92715192e-04] [-5.31370978e-04 3.65101215e-04 -2.92715193e-04] [ 8.48198745e-05 2.54166374e-04 -3.88254529e-04] [-8.48198736e-05 -2.54166383e-04 -3.88254529e-04] [-5.22854805e-04 -1.94146571e-04 -1.87876536e-04] [ 5.22854805e-04 1.94146570e-04 -1.87876536e-04] [ 1.50936933e-03 -5.73288012e-04 2.57181321e-04] [-1.50936933e-03 5.73288011e-04 2.57181321e-04] [-2.91607828e-04 -1.12291859e-05 6.08062385e-04] [ 2.91607828e-04 1.12291879e-05 6.08062385e-04] [ 4.91378940e-04 -2.33622960e-04 1.01510013e-04] [-4.91378938e-04 2.33622959e-04 1.01510011e-04] [ 9.76275385e-04 8.47789352e-04 -5.81099812e-04] [-9.76275388e-04 -8.47789354e-04 -5.81099812e-04] [ 1.43767703e-03 3.09735034e-04 5.39944918e-04] [-1.43767703e-03 -3.09735033e-04 5.39944916e-04] [-3.48503177e-04 -5.18358854e-05 3.50108030e-04] [ 3.48503177e-04 5.18358843e-05 3.50108034e-04]] Final stress: [ 3.04569102e-05 2.28033978e-05 1.06769807e-05 -2.24673274e-15 -3.05938075e-16 2.63303715e-05] Minimization converged after 112 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-3.32564455e-04 -6.88512656e-05 -1.78530789e-05] [ 3.32564455e-04 6.88512610e-05 -1.78530795e-05] [-3.15917761e-04 -5.09976508e-05 7.52230548e-05] [ 3.15917761e-04 5.09976502e-05 7.52230555e-05] [-2.88484582e-04 -3.42323633e-04 2.78998938e-04] [ 2.88484582e-04 3.42323633e-04 2.78998936e-04] [ 5.02043654e-04 2.00335190e-04 -5.16954903e-05] [-5.02043654e-04 -2.00335187e-04 -5.16954866e-05] [-7.88967751e-05 -6.67772789e-04 3.35529732e-04] [ 7.88967743e-05 6.67772789e-04 3.35529732e-04] [-8.73939865e-05 3.77389436e-04 -5.32820488e-05] [ 8.73939864e-05 -3.77389436e-04 -5.32820478e-05] [ 3.10199681e-04 -2.21091050e-04 2.25660943e-05] [-3.10199681e-04 2.21091050e-04 2.25660943e-05] [ 7.24568960e-04 2.76797639e-04 -5.52235466e-04] [-7.24568961e-04 -2.76797638e-04 -5.52235464e-04] [-5.39879550e-05 -2.83225457e-04 3.35027997e-04] [ 5.39879555e-05 2.83225456e-04 3.35027997e-04] [ 4.49478038e-06 2.71071863e-04 1.39118795e-05] [-4.49478031e-06 -2.71071863e-04 1.39118784e-05] [-5.96062571e-04 4.47889270e-04 -5.27944133e-04] [ 5.96062570e-04 -4.47889270e-04 -5.27944133e-04] [ 5.04063190e-04 -1.07702516e-04 -6.59294712e-05] [-5.04063190e-04 1.07702526e-04 -6.59294717e-05] [-2.87162447e-05 2.15973051e-04 -6.02220652e-05] [ 2.87162443e-05 -2.15973049e-04 -6.02220638e-05] [ 4.33236729e-05 -3.92309707e-04 2.64869643e-04] [-4.33236730e-05 3.92309703e-04 2.64869643e-04] [-3.76259081e-04 -5.45421834e-04 3.22876341e-04] [ 3.76259081e-04 5.45421833e-04 3.22876340e-04] [ 5.45625568e-06 5.27458817e-04 -3.88225316e-04] [-5.45625620e-06 -5.27458816e-04 -3.88225316e-04] [ 5.22010226e-04 -3.43708096e-07 3.14683521e-05] [-5.22010226e-04 3.43707769e-07 3.14683523e-05] [ 3.02479444e-04 -4.17295554e-04 -1.23653991e-04] [-3.02479444e-04 4.17295554e-04 -1.23653990e-04] [-2.46282484e-04 -1.80341983e-04 -4.21521178e-04] [ 2.46282484e-04 1.80341983e-04 -4.21521179e-04] [-6.94854657e-05 -1.78566351e-04 -4.88724500e-04] [ 6.94854649e-05 1.78566353e-04 -4.88724499e-04] [ 1.41692433e-06 2.27593831e-04 3.03241990e-04] [-1.41692422e-06 -2.27593829e-04 3.03241989e-04] [ 4.11305981e-04 7.11253654e-04 3.65534928e-04] [-4.11305981e-04 -7.11253654e-04 3.65534928e-04] [ 1.83819963e-04 1.10846420e-04 -3.76136338e-04] [-1.83819964e-04 -1.10846420e-04 -3.76136338e-04] [ 8.83524287e-05 -2.32196588e-04 -3.01537731e-04] [-8.83524290e-05 2.32196589e-04 -3.01537731e-04] [ 2.12392378e-05 -1.70232646e-04 5.34350041e-04] [-2.12392363e-05 1.70232647e-04 5.34350041e-04] [-1.42281712e-04 1.96709369e-04 5.17614228e-04] [ 1.42281713e-04 -1.96709369e-04 5.17614228e-04] [ 1.30277940e-04 4.07690376e-05 1.91193545e-04] [-1.30277941e-04 -4.07690378e-05 1.91193545e-04] [-1.49934989e-04 2.21570614e-04 -6.82931989e-04] [ 1.49934990e-04 -2.21570612e-04 -6.82931990e-04] [ 5.07974556e-04 -6.06836559e-05 -3.00222016e-04] [-5.07974559e-04 6.06836593e-05 -3.00222015e-04] [-1.36171742e-04 -2.49032621e-04 1.70496653e-04] [ 1.36171743e-04 2.49032621e-04 1.70496653e-04] [ 7.39168067e-04 1.62754410e-04 -8.40471318e-06] [-7.39168068e-04 -1.62754411e-04 -8.40471262e-06] [-4.80341079e-05 -1.58998260e-04 -6.49333835e-04] [ 4.80341071e-05 1.58998258e-04 -6.49333837e-04] [ 3.14897222e-04 -4.83797336e-04 5.47203943e-04] [-3.14897222e-04 4.83797335e-04 5.47203944e-04] [ 1.90459384e-04 1.29530231e-04 -2.45904034e-04] [-1.90459385e-04 -1.29530231e-04 -2.45904034e-04] [ 3.36708926e-04 -1.11291348e-04 3.52013384e-04] [-3.36708925e-04 1.11291348e-04 3.52013382e-04] [-2.61455065e-04 -1.65446498e-04 3.75480985e-04] [ 2.61455064e-04 1.65446499e-04 3.75480985e-04] [ 7.90353986e-04 -3.66235017e-04 1.55801003e-04] [-7.90353985e-04 3.66235018e-04 1.55801004e-04] [-1.29564662e-05 6.79156811e-05 1.08965615e-04] [ 1.29564661e-05 -6.79156813e-05 1.08965616e-04] [ 2.88665231e-04 -1.43800631e-04 -3.41718177e-04] [-2.88665231e-04 1.43800631e-04 -3.41718178e-04] [-4.45229807e-04 -1.08203089e-04 -2.12274463e-05] [ 4.45229807e-04 1.08203088e-04 -2.12274454e-05] [-1.40847746e-04 8.21256599e-06 -2.42765029e-05] [ 1.40847746e-04 -8.21256593e-06 -2.42765020e-05] [ 1.21719104e-05 -1.91375421e-04 1.37671810e-04] [-1.21719100e-05 1.91375422e-04 1.37671810e-04] [ 2.01245394e-04 5.54187311e-05 1.35727156e-04] [-2.01245392e-04 -5.54187339e-05 1.35727154e-04] [ 3.32964058e-04 -3.32399724e-04 2.20708402e-04] [-3.32964058e-04 3.32399728e-04 2.20708401e-04] [-7.76930898e-05 -8.65979295e-05 -3.96975559e-05] [ 7.76930893e-05 8.65979290e-05 -3.96975558e-05] [ 5.59687835e-04 1.59380744e-04 -6.68460811e-06] [-5.59687835e-04 -1.59380744e-04 -6.68460765e-06] [-1.45500975e-04 -3.51654856e-05 -2.26141847e-04] [ 1.45500975e-04 3.51654779e-05 -2.26141848e-04] [-3.11749273e-04 2.43374088e-04 4.95348463e-04] [ 3.11749274e-04 -2.43374088e-04 4.95348461e-04] [-1.72568898e-04 -3.27945603e-04 1.02092117e-05] [ 1.72568898e-04 3.27945603e-04 1.02092145e-05] [ 1.63914894e-04 -3.95682064e-05 -1.06002055e-04] [-1.63914895e-04 3.95682039e-05 -1.06002056e-04] [-6.15261592e-04 1.63099666e-04 -2.20527800e-04] [ 6.15261594e-04 -1.63099667e-04 -2.20527800e-04]] Final stress: [-3.44635513e-05 -2.13667180e-05 -2.59844913e-05 6.11919628e-16 -3.27472613e-16 1.24552910e-05] Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 18 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 5.21203155e-04 3.42060226e-04 -9.31992039e-05] [-5.21203155e-04 -3.42060231e-04 -9.31992034e-05] [ 6.83387990e-04 -8.77705809e-04 -2.60071785e-05] [-6.83387991e-04 8.77705810e-04 -2.60071794e-05] [ 3.76193447e-04 2.10081217e-04 5.46066885e-04] [-3.76193448e-04 -2.10081216e-04 5.46066885e-04] [-9.90358211e-04 1.04511893e-03 1.87976477e-04] [ 9.90358210e-04 -1.04511893e-03 1.87976477e-04] [ 1.07567548e-04 -4.25077041e-04 4.48978579e-04] [-1.07567548e-04 4.25077040e-04 4.48978578e-04] [ 1.45572255e-04 4.01895666e-05 -8.20425516e-04] [-1.45572256e-04 -4.01895664e-05 -8.20425516e-04] [-8.49900918e-04 -4.34758488e-05 6.18248140e-04] [ 8.49900917e-04 4.34758494e-05 6.18248140e-04] [-1.58589089e-03 5.73785737e-04 1.27993652e-03] [ 1.58589089e-03 -5.73785734e-04 1.27993652e-03] [-2.42771761e-05 -8.47690097e-04 8.09075513e-04] [ 2.42771754e-05 8.47690097e-04 8.09075512e-04] [ 4.78214575e-04 -2.55135091e-05 -5.81781841e-04] [-4.78214575e-04 2.55135106e-05 -5.81781839e-04] [ 1.40646076e-03 6.63461436e-04 -1.95100517e-04] [-1.40646076e-03 -6.63461435e-04 -1.95100518e-04] [-1.05153214e-03 -3.44832239e-04 -3.46615402e-04] [ 1.05153214e-03 3.44832240e-04 -3.46615403e-04] [ 2.41103199e-04 -6.99553596e-04 3.02126154e-04] [-2.41103199e-04 6.99553594e-04 3.02126154e-04] [ 5.31272891e-05 -5.75081505e-04 -1.65898030e-03] [-5.31272885e-05 5.75081505e-04 -1.65898029e-03] [ 7.91797145e-04 -2.46064300e-04 9.81632668e-04] [-7.91797144e-04 2.46064298e-04 9.81632668e-04] [ 4.62679373e-05 -6.72257912e-04 -5.98263082e-04] [-4.62679374e-05 6.72257912e-04 -5.98263081e-04] [-9.00726568e-04 5.16255354e-04 -1.07235259e-04] [ 9.00726568e-04 -5.16255354e-04 -1.07235259e-04] [-3.65580264e-04 5.45649848e-04 -2.68661360e-04] [ 3.65580265e-04 -5.45649847e-04 -2.68661359e-04] [ 8.25551348e-04 4.94744138e-04 1.35450383e-04] [-8.25551349e-04 -4.94744139e-04 1.35450384e-04] [-1.04318983e-04 -6.99910810e-05 4.77050109e-04] [ 1.04318982e-04 6.99910811e-05 4.77050110e-04] [-3.73898599e-05 3.68327324e-04 -8.03061996e-04] [ 3.73898606e-05 -3.68327324e-04 -8.03061996e-04] [ 5.68065929e-05 -1.40983054e-03 -7.77290273e-04] [-5.68065933e-05 1.40983054e-03 -7.77290275e-04] [ 3.98646807e-04 -2.67042640e-04 7.83803086e-04] [-3.98646807e-04 2.67042641e-04 7.83803085e-04] [-1.48263848e-04 -3.27548454e-05 8.82876655e-04] [ 1.48263848e-04 3.27548454e-05 8.82876653e-04] [ 2.88706580e-04 7.14268262e-04 -1.92456532e-04] [-2.88706579e-04 -7.14268262e-04 -1.92456532e-04] [ 5.17059964e-04 1.70501518e-04 8.57662212e-05] [-5.17059965e-04 -1.70501518e-04 8.57662224e-05] [-4.31089386e-04 -5.92682709e-04 8.88172584e-05] [ 4.31089387e-04 5.92682709e-04 8.88172575e-05] [ 8.92338978e-04 9.30541587e-05 5.43610570e-04] [-8.92338978e-04 -9.30541589e-05 5.43610570e-04] [-3.76770237e-04 -3.57805929e-04 -3.44289283e-04] [ 3.76770237e-04 3.57805930e-04 -3.44289284e-04] [ 6.98355331e-04 -2.59172768e-04 -1.60741259e-04] [-6.98355331e-04 2.59172767e-04 -1.60741260e-04] [-8.27861592e-04 3.03928001e-04 5.38522354e-04] [ 8.27861593e-04 -3.03928002e-04 5.38522353e-04] [ 9.14827999e-05 1.10064179e-03 1.52572922e-03] [-9.14827983e-05 -1.10064179e-03 1.52572922e-03] [-3.15201397e-04 1.50719518e-04 -7.96699381e-04] [ 3.15201397e-04 -1.50719518e-04 -7.96699382e-04] [ 5.52936341e-04 6.05318374e-04 9.99916838e-04] [-5.52936341e-04 -6.05318373e-04 9.99916838e-04] [ 8.42844112e-04 -3.02830578e-04 -5.33720347e-04] [-8.42844113e-04 3.02830578e-04 -5.33720348e-04] [ 1.77594822e-03 -2.09739719e-04 -6.27349411e-04] [-1.77594822e-03 2.09739718e-04 -6.27349412e-04] [-1.11549073e-03 4.30561976e-04 -8.83043634e-05] [ 1.11549073e-03 -4.30561978e-04 -8.83043632e-05] [ 7.46266841e-04 6.13083521e-04 -1.25615289e-03] [-7.46266842e-04 -6.13083521e-04 -1.25615289e-03] [-5.82837142e-04 -4.01047787e-04 -5.29478662e-04] [ 5.82837143e-04 4.01047787e-04 -5.29478662e-04] [ 5.04512045e-04 3.82921986e-04 -2.82623134e-05] [-5.04512045e-04 -3.82921986e-04 -2.82623123e-05] [ 6.11454677e-04 1.64203492e-03 1.58267048e-04] [-6.11454678e-04 -1.64203492e-03 1.58267046e-04] [ 5.60075578e-05 5.09411887e-04 2.52413239e-04] [-5.60075579e-05 -5.09411886e-04 2.52413240e-04] [-2.39014875e-04 1.53441346e-04 -3.99915552e-04] [ 2.39014875e-04 -1.53441346e-04 -3.99915553e-04] [-1.53665718e-04 -9.35150903e-04 1.10427032e-07] [ 1.53665719e-04 9.35150910e-04 1.10427463e-07] [-1.45998790e-04 -1.33339352e-03 2.17398594e-04] [ 1.45998789e-04 1.33339352e-03 2.17398594e-04] [-1.09746252e-03 5.87473842e-04 -5.82386013e-04] [ 1.09746252e-03 -5.87473841e-04 -5.82386013e-04] [ 1.41702059e-04 1.58888940e-04 -4.85457845e-06] [-1.41702058e-04 -1.58888943e-04 -4.85457893e-06] [ 2.85900608e-04 5.16004183e-04 -5.40045918e-04] [-2.85900610e-04 -5.16004183e-04 -5.40045918e-04] [ 1.04620087e-04 -5.96761465e-04 3.25608484e-04] [-1.04620086e-04 5.96761466e-04 3.25608482e-04] [-6.51843026e-04 -8.55765056e-05 -9.10518618e-05] [ 6.51843026e-04 8.55765057e-05 -9.10518630e-05] [ 8.50210430e-04 1.46951732e-04 2.62948882e-04] [-8.50210430e-04 -1.46951732e-04 2.62948882e-04]] Final stress: [ 1.32404419e-05 2.91560698e-05 -1.04861560e-05 3.89593017e-16 1.62051574e-15 -2.14909260e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.97110649e-04 -5.84215805e-05 -5.95330051e-05] [ 2.97110651e-04 5.84216121e-05 -5.95330120e-05] [-3.43634450e-04 -4.94690881e-04 -3.77060019e-05] [ 3.43634450e-04 4.94690880e-04 -3.77060008e-05] [-2.32748338e-04 1.10415931e-04 2.82243343e-04] [ 2.32748337e-04 -1.10415930e-04 2.82243343e-04] [ 4.87648221e-04 6.29587619e-04 -4.91589688e-05] [-4.87648220e-04 -6.29587625e-04 -4.91589777e-05] [-8.84680462e-05 -2.32678514e-04 2.49221596e-04] [ 8.84680463e-05 2.32678514e-04 2.49221596e-04] [-6.56462892e-05 9.97602294e-06 -4.18628384e-04] [ 6.56462893e-05 -9.97602381e-06 -4.18628388e-04] [ 4.28651851e-04 -1.45896607e-05 2.56651540e-04] [-4.28651852e-04 1.45896614e-05 2.56651545e-04] [ 8.83474756e-04 4.97297562e-04 4.22751240e-04] [-8.83474757e-04 -4.97297570e-04 4.22751234e-04] [-2.98668621e-05 -4.43811210e-04 4.21503344e-04] [ 2.98668621e-05 4.43811212e-04 4.21503345e-04] [-2.05431775e-04 -5.99348705e-05 -2.20499721e-04] [ 2.05431774e-04 5.99348735e-05 -2.20499720e-04] [-6.55807817e-04 3.65584815e-04 -7.08615899e-05] [ 6.55807817e-04 -3.65584816e-04 -7.08615888e-05] [ 4.70151211e-04 -5.72158252e-05 -1.88391581e-04] [-4.70151212e-04 5.72158197e-05 -1.88391581e-04] [-4.16401870e-05 -3.09837251e-04 9.80264137e-05] [ 4.16401869e-05 3.09837244e-04 9.80264070e-05] [-3.78030265e-06 -4.49075315e-04 -6.68604679e-04] [ 3.78030169e-06 4.49075320e-04 -6.68604681e-04] [-4.22455045e-04 -1.27392800e-04 4.50473072e-04] [ 4.22455046e-04 1.27392801e-04 4.50473074e-04] [-2.72574021e-05 -3.17667802e-04 -2.82295657e-04] [ 2.72574016e-05 3.17667802e-04 -2.82295658e-04] [ 4.36722961e-04 3.11922387e-04 -1.15326770e-05] [-4.36722961e-04 -3.11922391e-04 -1.15326755e-05] [ 4.90609887e-04 -2.82066668e-04 4.45459026e-05] [-4.90609888e-04 2.82066668e-04 4.45459017e-05] [-1.72653775e-04 -2.98534715e-04 -1.36156447e-04] [ 1.72653776e-04 2.98534714e-04 -1.36156446e-04] [-1.06724419e-04 -1.92478353e-04 -4.26651813e-04] [ 1.06724418e-04 1.92478352e-04 -4.26651815e-04] [-4.73001844e-05 6.61374503e-05 2.99389565e-04] [ 4.73001847e-05 -6.61374517e-05 2.99389568e-04] [ 1.91657648e-04 1.50626796e-04 3.43927093e-04] [-1.91657649e-04 -1.50626798e-04 3.43927092e-04] [ 5.42702998e-05 6.87167328e-04 -3.88459779e-04] [-5.42703007e-05 -6.87167330e-04 -3.88459778e-04] [ 8.98429898e-05 -3.59785994e-04 -1.57751622e-04] [-8.98429869e-05 3.59785997e-04 -1.57751624e-04] [-1.15094051e-05 2.17207910e-05 4.56122547e-04] [ 1.15094027e-05 -2.17207883e-05 4.56122549e-04] [-1.49794663e-04 3.43811954e-04 9.98786083e-05] [ 1.49794662e-04 -3.43811954e-04 9.98786087e-05] [ 3.01089939e-04 -8.42359772e-05 3.40635987e-05] [-3.01089939e-04 8.42359789e-05 3.40636006e-05] [-1.22484433e-04 2.07348226e-04 -1.83563977e-04] [ 1.22484432e-04 -2.07348231e-04 -1.83563975e-04] [ 4.74661794e-04 4.81064324e-05 2.05777027e-04] [-4.74661791e-04 -4.81064373e-05 2.05777024e-04] [-4.57086089e-04 -1.46124125e-04 2.63150175e-04] [ 4.57086090e-04 1.46124125e-04 2.63150175e-04] [ 3.67680273e-04 1.58708963e-04 -6.04719639e-05] [-3.67680273e-04 -1.58708963e-04 -6.04719646e-05] [-1.93734252e-04 -1.05348240e-04 -3.41200678e-04] [ 1.93734258e-04 1.05348245e-04 -3.41200674e-04] [ 9.62777901e-05 -6.20969904e-04 7.09317146e-04] [-9.62777939e-05 6.20969910e-04 7.09317141e-04] [ 3.95978427e-04 1.79197286e-04 -3.09396081e-04] [-3.95978424e-04 -1.79197286e-04 -3.09396084e-04] [ 3.64302840e-04 -2.42858851e-04 4.59787040e-04] [-3.64302841e-04 2.42858852e-04 4.59787041e-04] [-3.11489785e-04 -3.67193708e-04 -9.75784736e-05] [ 3.11489786e-04 3.67193708e-04 -9.75784729e-05] [ 6.95459415e-04 -1.12605699e-04 -2.38064508e-04] [-6.95459415e-04 1.12605699e-04 -2.38064508e-04] [-1.93885587e-04 2.18635884e-04 -2.48422030e-04] [ 1.93885587e-04 -2.18635883e-04 -2.48422033e-04] [ 3.56020314e-04 -3.25034729e-04 -5.71328089e-04] [-3.56020314e-04 3.25034730e-04 -5.71328086e-04] [-3.98130009e-04 1.53705461e-04 5.02966280e-06] [ 3.98130008e-04 -1.53705458e-04 5.02966549e-06] [-3.59531974e-04 8.10382852e-04 4.55893381e-05] [ 3.59531974e-04 -8.10382851e-04 4.55893368e-05] [-2.25184153e-05 2.85194280e-04 1.49650104e-04] [ 2.25184156e-05 -2.85194280e-04 1.49650104e-04] [ 6.70920693e-05 2.18550982e-05 -1.59631910e-04] [-6.70920686e-05 -2.18550937e-05 -1.59631906e-04] [ 2.41191794e-04 -3.99777655e-04 6.72785262e-05] [-2.41191795e-04 3.99777631e-04 6.72785274e-05] [ 1.10857112e-04 -6.91470170e-04 1.30988876e-04] [-1.10857114e-04 6.91470170e-04 1.30988877e-04] [ 5.16425421e-04 2.38336165e-04 -2.90793268e-04] [-5.16425421e-04 -2.38336165e-04 -2.90793268e-04] [-5.49287921e-05 5.72227921e-05 -4.94078144e-05] [ 5.49287928e-05 -5.72227871e-05 -4.94078155e-05] [ 9.37475552e-05 2.17986112e-04 3.01117231e-04] [-9.37475540e-05 -2.17986115e-04 3.01117238e-04] [ 1.29094299e-04 -3.76899265e-04 -2.37358363e-04] [-1.29094301e-04 3.76899262e-04 -2.37358371e-04] [ 4.22507124e-04 -4.24937687e-05 1.23742234e-04] [-4.22507122e-04 4.24937702e-05 1.23742238e-04] [-3.30516470e-04 9.49442443e-05 -1.67761312e-05] [ 3.30516468e-04 -9.49442415e-05 -1.67761360e-05]] Final stress: [ 1.64548830e-05 2.89881564e-05 2.71804817e-06 3.05938075e-16 -1.05644242e-15 1.06154789e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.65148710e-04 4.85010143e-05 -1.47783197e-05] [-1.65148710e-04 -4.85010159e-05 -1.47783195e-05] [ 1.97307196e-04 2.09165496e-04 7.67176984e-05] [-1.97307196e-04 -2.09165498e-04 7.67176989e-05] [ 9.81812970e-05 -1.25298840e-04 -1.93057825e-04] [-9.81812971e-05 1.25298838e-04 -1.93057826e-04] [-2.66596201e-04 -3.97830224e-04 1.01283815e-04] [ 2.66596201e-04 3.97830225e-04 1.01283817e-04] [ 3.99922957e-05 1.70998319e-04 -1.45037386e-04] [-3.99922960e-05 -1.70998319e-04 -1.45037387e-04] [ 6.14229187e-05 3.58791856e-05 2.00637577e-04] [-6.14229184e-05 -3.58791859e-05 2.00637578e-04] [-2.14204158e-04 1.10457023e-05 -2.01358991e-04] [ 2.14204158e-04 -1.10457019e-05 -2.01358992e-04] [-4.44254061e-04 -3.47010331e-04 -2.48345410e-04] [ 4.44254061e-04 3.47010333e-04 -2.48345409e-04] [ 1.94602402e-05 3.08242276e-04 -3.06669547e-04] [-1.94602403e-05 -3.08242277e-04 -3.06669547e-04] [ 8.03886850e-05 6.39024475e-06 1.25919533e-04] [-8.03886852e-05 -6.39024522e-06 1.25919533e-04] [ 3.26796451e-04 -1.86862971e-04 5.85900867e-05] [-3.26796450e-04 1.86862971e-04 5.85900861e-05] [-2.20750639e-04 -4.12529180e-06 1.61340741e-04] [ 2.20750639e-04 4.12530298e-06 1.61340739e-04] [ 3.01452157e-06 7.28262395e-05 -3.29513174e-05] [-3.01452099e-06 -7.28262384e-05 -3.29513172e-05] [-3.85289194e-05 3.26171213e-04 4.25681746e-04] [ 3.85289195e-05 -3.26171217e-04 4.25681746e-04] [ 2.19220486e-04 7.53994688e-05 -7.93112738e-05] [-2.19220486e-04 -7.53994684e-05 -7.93112745e-05] [ 1.12742375e-06 1.57528529e-04 9.58848992e-05] [-1.12742314e-06 -1.57528528e-04 9.58848993e-05] [-2.49958561e-04 -1.67517258e-04 -6.40384373e-05] [ 2.49958561e-04 1.67517258e-04 -6.40384366e-05] [-2.71454509e-04 9.01503203e-05 4.88684546e-05] [ 2.71454509e-04 -9.01503206e-05 4.88684550e-05] [ 1.03471193e-04 2.11013654e-04 1.28537725e-04] [-1.03471193e-04 -2.11013654e-04 1.28537725e-04] [ 3.12698817e-05 3.14684718e-05 3.38221915e-04] [-3.12698836e-05 -3.14684693e-05 3.38221918e-04] [ 9.10605459e-07 -4.73394417e-05 -1.58666105e-04] [-9.10604987e-07 4.73394435e-05 -1.58666106e-04] [-7.66385807e-05 -1.69434491e-04 -1.99142470e-04] [ 7.66385807e-05 1.69434491e-04 -1.99142469e-04] [-1.61433808e-05 -2.41071789e-04 1.76423128e-04] [ 1.61433802e-05 2.41071789e-04 1.76423129e-04] [-6.28794291e-05 2.42078381e-04 1.29243402e-04] [ 6.28794287e-05 -2.42078380e-04 1.29243401e-04] [-6.95523889e-05 -1.17488099e-05 -2.99395844e-04] [ 6.95523901e-05 1.17488116e-05 -2.99395843e-04] [ 7.27133757e-05 -1.77210876e-04 -1.43345717e-04] [-7.27133758e-05 1.77210875e-04 -1.43345717e-04] [-1.41413489e-04 -3.65041580e-05 -5.52986092e-05] [ 1.41413489e-04 3.65041571e-05 -5.52986099e-05] [ 1.15802722e-04 -1.04641933e-04 7.89530051e-05] [-1.15802721e-04 1.04641935e-04 7.89530041e-05] [-1.47381040e-04 -8.90324497e-05 -7.82037787e-05] [ 1.47381039e-04 8.90324512e-05 -7.82037786e-05] [ 2.62913711e-04 1.72951515e-04 -1.20511080e-04] [-2.62913711e-04 -1.72951515e-04 -1.20511080e-04] [-1.72736609e-04 -1.60043780e-04 3.56855539e-05] [ 1.72736609e-04 1.60043780e-04 3.56855544e-05] [ 9.54516032e-05 4.30969655e-05 1.87817378e-04] [-9.54516048e-05 -4.30969661e-05 1.87817377e-04] [-2.00329570e-04 3.23627392e-04 -3.93420575e-04] [ 2.00329570e-04 -3.23627392e-04 -3.93420574e-04] [-2.48330263e-04 -9.96117310e-05 1.24909116e-04] [ 2.48330262e-04 9.96117311e-05 1.24909116e-04] [-1.70712599e-04 9.87241769e-05 -2.33212212e-04] [ 1.70712600e-04 -9.87241769e-05 -2.33212212e-04] [ 1.29593854e-04 2.47886440e-04 8.55331936e-05] [-1.29593853e-04 -2.47886440e-04 8.55331935e-05] [-2.63587481e-04 1.74104639e-04 1.56961951e-04] [ 2.63587481e-04 -1.74104638e-04 1.56961951e-04] [ 4.86163048e-05 -1.22245102e-04 1.11372041e-04] [-4.86163050e-05 1.22245101e-04 1.11372042e-04] [-1.97450428e-04 1.82468126e-04 3.15125682e-04] [ 1.97450428e-04 -1.82468126e-04 3.15125682e-04] [ 2.19550994e-04 -6.13951028e-05 2.03877737e-05] [-2.19550994e-04 6.13951022e-05 2.03877727e-05] [ 1.31280048e-04 -4.06815208e-04 1.90893134e-06] [-1.31280048e-04 4.06815208e-04 1.90893158e-06] [ 1.05141140e-05 -1.31511701e-04 -1.03114777e-04] [-1.05141141e-05 1.31511701e-04 -1.03114777e-04] [-1.31304554e-05 1.22190795e-05 -4.74891821e-06] [ 1.31304552e-05 -1.22190805e-05 -4.74891942e-06] [-1.41353302e-04 2.68113314e-04 -4.51747502e-05] [ 1.41353302e-04 -2.68113312e-04 -4.51747501e-05] [ 1.96273495e-05 3.41288380e-04 -9.08014609e-05] [-1.96273490e-05 -3.41288381e-04 -9.08014612e-05] [-2.69829332e-04 -1.45685048e-04 1.34171549e-04] [ 2.69829331e-04 1.45685048e-04 1.34171548e-04] [-3.68863787e-05 -3.74766396e-06 5.85569692e-05] [ 3.68863798e-05 3.74765476e-06 5.85569691e-05] [ 2.30474399e-05 -8.04527565e-05 -1.50464263e-04] [-2.30474403e-05 8.04527564e-05 -1.50464263e-04] [-2.83674305e-05 1.69151758e-04 1.73380212e-04] [ 2.83674303e-05 -1.69151758e-04 1.73380212e-04] [-1.91436055e-04 -3.21004187e-05 -1.17082967e-04] [ 1.91436053e-04 3.21004167e-05 -1.17082967e-04] [ 2.26661937e-04 -1.11195755e-04 -7.39820430e-05] [-2.26661936e-04 1.11195753e-04 -7.39820441e-05]] Final stress: [-1.99680247e-05 -3.25951742e-05 -1.89366328e-05 3.23887147e-16 3.82449768e-16 -3.74910835e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-4.36900847e-04 3.53453657e-04 1.24104929e-04] [ 4.36900847e-04 -3.53453661e-04 1.24104928e-04] [-7.60417659e-04 9.12067560e-04 1.03847600e-04] [ 7.60417659e-04 -9.12067559e-04 1.03847599e-04] [-2.46481674e-04 -6.33727836e-04 -6.55012267e-04] [ 2.46481674e-04 6.33727835e-04 -6.55012268e-04] [ 1.10972735e-03 -1.19591561e-03 -2.91307091e-04] [-1.10972735e-03 1.19591561e-03 -2.91307091e-04] [-1.00236215e-04 5.68529219e-04 -5.37091473e-04] [ 1.00236215e-04 -5.68529218e-04 -5.37091473e-04] [-2.09591168e-04 1.13872744e-04 8.81072976e-04] [ 2.09591168e-04 -1.13872744e-04 8.81072976e-04] [ 8.83818354e-04 -5.48367051e-05 -8.27401937e-04] [-8.83818354e-04 5.48367044e-05 -8.27401937e-04] [ 1.38122431e-03 -6.34756025e-04 -1.65789709e-03] [-1.38122431e-03 6.34756025e-04 -1.65789709e-03] [ 1.68020755e-04 1.09427046e-03 -1.05721430e-03] [-1.68020755e-04 -1.09427046e-03 -1.05721430e-03] [-4.34484762e-04 -1.00593682e-04 8.39648674e-04] [ 4.34484762e-04 1.00593682e-04 8.39648674e-04] [-1.60923274e-03 -7.03310999e-04 2.65474316e-04] [ 1.60923274e-03 7.03310999e-04 2.65474316e-04] [ 1.29464151e-03 3.11477036e-04 4.68132358e-04] [-1.29464151e-03 -3.11477032e-04 4.68132359e-04] [-3.88188466e-04 7.59102162e-04 -5.74283613e-04] [ 3.88188466e-04 -7.59102160e-04 -5.74283614e-04] [ 1.25545282e-05 5.02948227e-04 2.05567597e-03] [-1.25545282e-05 -5.02948228e-04 2.05567597e-03] [-8.17097863e-04 3.97511028e-04 -4.96070357e-04] [ 8.17097864e-04 -3.97511028e-04 -4.96070358e-04] [-1.75431528e-05 6.97375896e-04 4.00431003e-04] [ 1.75431533e-05 -6.97375895e-04 4.00431004e-04] [ 1.12051399e-03 -8.57168250e-04 -1.38485918e-04] [-1.12051399e-03 8.57168251e-04 -1.38485917e-04] [ 3.06060162e-04 -8.36427744e-04 6.63750656e-04] [-3.06060160e-04 8.36427743e-04 6.63750658e-04] [-1.00412366e-03 -1.64353253e-04 5.70193863e-05] [ 1.00412366e-03 1.64353254e-04 5.70193878e-05] [ 3.20269064e-04 -7.00955957e-05 -3.85053918e-04] [-3.20269064e-04 7.00955967e-05 -3.85053916e-04] [-3.87769470e-04 -2.16506874e-04 1.23351822e-03] [ 3.87769470e-04 2.16506876e-04 1.23351822e-03] [ 4.58917905e-05 1.26320895e-03 8.38958908e-04] [-4.58917909e-05 -1.26320894e-03 8.38958909e-04] [-5.13757947e-04 7.84392680e-04 -9.76071262e-04] [ 5.13757949e-04 -7.84392680e-04 -9.76071264e-04] [ 3.25452746e-04 1.33018930e-04 -8.68480940e-04] [-3.25452747e-04 -1.33018930e-04 -8.68480940e-04] [-3.44254945e-04 -1.23258913e-03 3.60126377e-04] [ 3.44254944e-04 1.23258913e-03 3.60126379e-04] [-5.94634041e-04 9.02682941e-05 -2.79848993e-04] [ 5.94634040e-04 -9.02682951e-05 -2.79848993e-04] [ 6.57370349e-04 4.97776891e-04 -3.79296875e-04] [-6.57370351e-04 -4.97776892e-04 -3.79296876e-04] [-1.13978413e-03 -3.96089875e-04 -8.08574860e-04] [ 1.13978412e-03 3.96089876e-04 -8.08574860e-04] [ 8.42148336e-04 2.35142117e-04 3.74473137e-04] [-8.42148336e-04 -2.35142115e-04 3.74473139e-04] [-7.55522079e-04 6.30163586e-04 1.34103513e-04] [ 7.55522079e-04 -6.30163587e-04 1.34103513e-04] [ 9.21902707e-04 -7.11728526e-04 -5.51447120e-04] [-9.21902706e-04 7.11728525e-04 -5.51447121e-04] [-3.09007844e-04 -8.63481036e-04 -2.37410998e-03] [ 3.09007842e-04 8.63481035e-04 -2.37410999e-03] [ 5.15732155e-04 -3.34117517e-04 8.75845051e-04] [-5.15732153e-04 3.34117516e-04 8.75845053e-04] [-4.86034199e-04 -7.63303697e-04 -1.04463192e-03] [ 4.86034199e-04 7.63303697e-04 -1.04463192e-03] [-8.87394232e-04 3.17605285e-04 6.25447101e-04] [ 8.87394231e-04 -3.17605285e-04 6.25447102e-04] [-2.24290203e-03 5.22358259e-04 9.35881105e-04] [ 2.24290203e-03 -5.22358258e-04 9.35881104e-04] [ 1.73776391e-03 -2.32291469e-04 -4.51616128e-05] [-1.73776391e-03 2.32291469e-04 -4.51616142e-05] [-8.23933497e-04 -6.94061620e-04 1.47491721e-03] [ 8.23933497e-04 6.94061619e-04 1.47491721e-03] [ 6.91826314e-04 4.08003118e-04 4.24896632e-04] [-6.91826312e-04 -4.08003121e-04 4.24896631e-04] [-2.03523867e-04 -4.82235289e-04 1.95272671e-04] [ 2.03523867e-04 4.82235290e-04 1.95272672e-04] [-3.17627971e-04 -1.78567700e-03 -1.04032530e-04] [ 3.17627971e-04 1.78567700e-03 -1.04032530e-04] [ 1.04896990e-05 -4.67176950e-04 -3.90507638e-04] [-1.04896992e-05 4.67176950e-04 -3.90507639e-04] [ 5.55734779e-04 -1.26414053e-04 1.96537423e-04] [-5.55734779e-04 1.26414052e-04 1.96537423e-04] [-1.39138542e-04 4.69183884e-05 -1.11991010e-04] [ 1.39138541e-04 -4.69183888e-05 -1.11991011e-04] [-2.00956454e-04 1.33630939e-03 -4.15791703e-04] [ 2.00956454e-04 -1.33630939e-03 -4.15791705e-04] [ 1.33148414e-03 -7.77514998e-04 6.62138737e-04] [-1.33148414e-03 7.77514997e-04 6.62138737e-04] [-3.31550242e-04 2.27896083e-04 2.02138927e-04] [ 3.31550242e-04 -2.27896087e-04 2.02138926e-04] [-1.87317754e-04 -2.10409737e-04 7.51712857e-04] [ 1.87317751e-04 2.10409739e-04 7.51712856e-04] [ 1.90691584e-04 8.42850416e-04 2.37861599e-05] [-1.90691584e-04 -8.42850414e-04 2.37861598e-05] [ 6.97885986e-04 -4.44122616e-05 1.00474540e-04] [-6.97885987e-04 4.44122615e-05 1.00474540e-04] [-9.21316605e-04 -6.00891378e-05 -2.99622032e-04] [ 9.21316606e-04 6.00891368e-05 -2.99622031e-04]] Final stress: [-2.01755019e-05 -2.50173015e-05 -1.26773737e-05 -3.10740436e-17 1.65648556e-15 2.13614065e-05] Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 119 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-0.00050657 0.00746763 -0.00178307] [ 0.00050657 -0.00746763 -0.00178307] [ 0.00103383 -0.00446836 -0.0008972 ] [-0.00103383 0.00446836 -0.0008972 ] [-0.00460566 0.00336465 0.0017005 ] [ 0.00460566 -0.00336465 0.0017005 ] [ 0.00072479 0.00062372 -0.00682531] [-0.00072479 -0.00062372 -0.00682531] [-0.00347672 0.00419246 0.00646294] [ 0.00347672 -0.00419246 0.00646294] [ 0.00209979 0.00066513 -0.00019957] [-0.00209979 -0.00066513 -0.00019957] [ 0.00329986 -0.00416235 0.00280186] [-0.00329986 0.00416235 0.00280186] [ 0.01472425 -0.00155043 0.01085269] [-0.01472425 0.00155043 0.01085269] [-0.00443473 -0.00154576 0.00155738] [ 0.00443473 0.00154576 0.00155738] [-0.00587014 0.00403526 -0.00229691] [ 0.00587014 -0.00403526 -0.00229691] [-0.00090245 -0.00397762 -0.00562545] [ 0.00090245 0.00397762 -0.00562545] [ 0.00229372 -0.00255968 -0.00036982] [-0.00229372 0.00255968 -0.00036982] [ 0.001965 -0.00398425 0.00875355] [-0.001965 0.00398425 0.00875355] [-0.00216875 0.00215396 -0.00823219] [ 0.00216875 -0.00215396 -0.00823219] [-0.00205417 0.00968036 -0.01178266] [ 0.00205417 -0.00968036 -0.01178266] [-0.00367502 -0.00715103 0.0030443 ] [ 0.00367502 0.00715103 0.0030443 ] [-0.00510608 -0.00012122 -0.00168867] [ 0.00510608 0.00012122 -0.00168867] [-0.00248331 -0.00015836 -0.00504082] [ 0.00248331 0.00015836 -0.00504082] [-0.00076235 -0.00318764 -0.00034639] [ 0.00076235 0.00318764 -0.00034639] [-0.0069269 0.00034291 0.00541278] [ 0.0069269 -0.00034291 0.00541278] [ 0.00107083 -0.00648884 -0.0053963 ] [-0.00107083 0.00648884 -0.0053963 ] [-0.0035745 0.00413598 0.00555938] [ 0.0035745 -0.00413598 0.00555938] [-0.00172333 -0.00267567 0.00792491] [ 0.00172333 0.00267567 0.00792491] [-0.00060855 0.00681075 0.00807529] [ 0.00060855 -0.00681075 0.00807529] [-0.00182038 0.00296902 -0.00711114] [ 0.00182038 -0.00296902 -0.00711114] [-0.00783854 -0.00165305 -0.00179509] [ 0.00783854 0.00165305 -0.00179509] [-0.00071118 -0.00236932 0.00479543] [ 0.00071118 0.00236932 0.00479543] [-0.00481931 0.00420047 0.00400807] [ 0.00481931 -0.00420047 0.00400807] [-0.00365338 0.00086472 0.00564069] [ 0.00365338 -0.00086472 0.00564069] [-0.00610942 -0.00164335 -0.0022638 ] [ 0.00610942 0.00164335 -0.0022638 ] [ 0.00439938 0.00794615 -0.00710745] [-0.00439938 -0.00794615 -0.00710745] [ 0.00244052 -0.00447827 0.00672219] [-0.00244052 0.00447827 0.00672219] [-0.01025585 -0.00150122 -0.01288688] [ 0.01025585 0.00150122 -0.01288688] [-0.00398389 -0.00465367 -0.00071095] [ 0.00398389 0.00465367 -0.00071095] [ 0.01182244 0.00362644 0.00781778] [-0.01182244 -0.00362644 0.00781778] [-0.00091552 0.00237767 -0.00792601] [ 0.00091552 -0.00237767 -0.00792601] [-0.00342796 0.00727678 0.00301127] [ 0.00342796 -0.00727678 0.00301127] [ 0.00130297 0.00198733 -0.00065025] [-0.00130297 -0.00198733 -0.00065025] [ 0.00720759 -0.00155539 0.00479471] [-0.00720759 0.00155539 0.00479471] [-0.00957938 0.0012041 -0.00312992] [ 0.00957938 -0.0012041 -0.00312992] [-0.01439084 0.00060508 -0.00048514] [ 0.01439084 -0.00060508 -0.00048514] [-0.00030555 -0.00322091 -0.00421199] [ 0.00030555 0.00322091 -0.00421199] [-0.00691638 0.00164626 0.00426396] [ 0.00691638 -0.00164626 0.00426396] [ 0.005575 -0.00919262 -0.00530077] [-0.005575 0.00919262 -0.00530077] [ 0.01524227 0.00080094 -0.00388868] [-0.01524227 -0.00080094 -0.00388868] [-0.00302674 -0.00079724 0.00059149] [ 0.00302674 0.00079724 0.00059149] [-0.00158242 -0.00037289 0.00168046] [ 0.00158242 0.00037289 0.00168046] [ 0.00365678 -0.00769698 0.00265239] [-0.00365678 0.00769698 0.00265239] [-0.00728248 -0.00434822 0.00137532] [ 0.00728248 0.00434822 0.00137532] [-0.0012698 -0.00316822 0.00229292] [ 0.0012698 0.00316822 0.00229292] [-0.00189083 -0.00369308 -0.00383979] [ 0.00189083 0.00369308 -0.00383979]] Final stress: [-5.05925342e-05 -1.12951154e-05 4.01854744e-04 -2.48335672e-15 -4.40742039e-15 3.65093385e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-3.83567634e-04 2.22039724e-03 9.94613151e-04] [ 3.83567634e-04 -2.22039728e-03 9.94613159e-04] [-1.88993713e-04 3.39979056e-04 -7.54618445e-04] [ 1.88993713e-04 -3.39979050e-04 -7.54618448e-04] [ 3.32678750e-04 -7.99675441e-04 3.48584526e-04] [-3.32678750e-04 7.99675443e-04 3.48584527e-04] [-1.50691972e-04 -1.59186582e-05 7.12804424e-04] [ 1.50691971e-04 1.59186608e-05 7.12804429e-04] [ 2.52225011e-04 -2.04267148e-04 -5.49294936e-04] [-2.52225011e-04 2.04267147e-04 -5.49294936e-04] [-3.14512738e-04 1.55273672e-04 -5.12370796e-05] [ 3.14512738e-04 -1.55273670e-04 -5.12370753e-05] [-3.23634268e-04 5.70067128e-04 1.24499148e-04] [ 3.23634267e-04 -5.70067132e-04 1.24499145e-04] [-1.33569351e-03 -7.71139058e-04 -9.24539343e-05] [ 1.33569350e-03 7.71139065e-04 -9.24539284e-05] [ 6.25147807e-04 -2.77306372e-05 -1.30049623e-04] [-6.25147807e-04 2.77306376e-05 -1.30049622e-04] [ 4.65140314e-04 -1.20890305e-04 8.29611739e-05] [-4.65140314e-04 1.20890302e-04 8.29611762e-05] [ 1.13888773e-04 1.59614037e-04 -2.10981565e-04] [-1.13888773e-04 -1.59614035e-04 -2.10981566e-04] [-4.37350403e-04 3.04824325e-03 2.83658889e-04] [ 4.37350402e-04 -3.04824327e-03 2.83658898e-04] [-1.65201933e-05 -1.82073117e-04 1.04550422e-03] [ 1.65201928e-05 1.82073129e-04 1.04550424e-03] [ 2.82664342e-04 -8.57782600e-04 1.31016726e-04] [-2.82664342e-04 8.57782602e-04 1.31016732e-04] [ 1.11758500e-04 -9.19371537e-04 1.20738589e-03] [-1.11758500e-04 9.19371536e-04 1.20738589e-03] [ 4.61039192e-04 7.85024615e-04 7.70288209e-05] [-4.61039192e-04 -7.85024615e-04 7.70288190e-05] [ 6.98359086e-04 -8.29976945e-04 1.79138648e-04] [-6.98359086e-04 8.29976952e-04 1.79138645e-04] [-1.79540069e-04 -4.70850843e-04 2.93563781e-04] [ 1.79540069e-04 4.70850844e-04 2.93563782e-04] [-7.51863992e-04 5.50990127e-05 2.10461481e-04] [ 7.51863993e-04 -5.50990120e-05 2.10461481e-04] [-8.96024189e-05 3.66600028e-04 -8.28410259e-04] [ 8.96024210e-05 -3.66600031e-04 -8.28410260e-04] [ 2.14916645e-04 -1.35848537e-04 -2.23407599e-04] [-2.14916648e-04 1.35848535e-04 -2.23407600e-04] [ 2.01616925e-05 -6.01329048e-04 -2.17800218e-04] [-2.01616911e-05 6.01329050e-04 -2.17800217e-04] [-3.75054787e-04 -2.41055505e-04 -6.27766374e-04] [ 3.75054786e-04 2.41055507e-04 -6.27766375e-04] [ 5.74693800e-05 -5.39564186e-06 -5.64825824e-05] [-5.74693817e-05 5.39563479e-06 -5.64825749e-05] [ 6.03236469e-04 -7.87651365e-04 1.57862393e-03] [-6.03236467e-04 7.87651359e-04 1.57862393e-03] [ 3.20097697e-04 -1.26932148e-05 1.73626694e-04] [-3.20097696e-04 1.26932158e-05 1.73626694e-04] [-4.53196179e-04 4.37900043e-04 -6.00473889e-04] [ 4.53196179e-04 -4.37900044e-04 -6.00473889e-04] [-5.61541376e-04 -1.22678143e-03 -2.72055244e-04] [ 5.61541379e-04 1.22678143e-03 -2.72055247e-04] [-2.44459924e-04 6.69784312e-04 -5.42063154e-04] [ 2.44459923e-04 -6.69784309e-04 -5.42063151e-04] [ 3.32441510e-04 -1.39740682e-04 3.09945835e-04] [-3.32441510e-04 1.39740682e-04 3.09945834e-04] [-2.43712950e-04 -8.40112361e-04 8.41534888e-04] [ 2.43712951e-04 8.40112362e-04 8.41534890e-04] [ 2.33481712e-04 5.49675308e-04 -1.04982442e-03] [-2.33481718e-04 -5.49675316e-04 -1.04982442e-03] [ 1.05440641e-03 -6.56165651e-04 -5.96104384e-05] [-1.05440640e-03 6.56165643e-04 -5.96104328e-05] [ 6.11734366e-04 1.62100331e-04 1.50038591e-04] [-6.11734368e-04 -1.62100332e-04 1.50038594e-04] [-9.92442837e-04 -8.90203590e-04 -2.47195665e-04] [ 9.92442838e-04 8.90203590e-04 -2.47195668e-04] [-3.01138852e-04 -8.29088271e-04 1.06933678e-03] [ 3.01138855e-04 8.29088269e-04 1.06933678e-03] [-1.66943941e-04 -1.18601862e-03 -8.73304427e-04] [ 1.66943940e-04 1.18601862e-03 -8.73304427e-04] [-3.13052613e-04 -4.33303128e-04 5.64107014e-05] [ 3.13052613e-04 4.33303128e-04 5.64107028e-05] [-9.80800632e-04 2.58313062e-05 -5.31623478e-04] [ 9.80800632e-04 -2.58313069e-05 -5.31623479e-04] [ 1.08530021e-03 3.38896539e-04 -4.01046931e-04] [-1.08530021e-03 -3.38896544e-04 -4.01046937e-04] [ 8.53842528e-04 -9.54624534e-08 3.73268063e-05] [-8.53842527e-04 9.54628267e-08 3.73268081e-05] [-3.10835216e-04 5.06069327e-04 5.21560221e-04] [ 3.10835215e-04 -5.06069325e-04 5.21560219e-04] [ 6.88432994e-04 3.25210422e-04 -6.17115607e-04] [-6.88432995e-04 -3.25210424e-04 -6.17115609e-04] [ 1.76603296e-04 -1.86671459e-03 2.45051045e-04] [-1.76603296e-04 1.86671462e-03 2.45051042e-04] [-8.50407959e-04 1.03424096e-04 3.18666355e-04] [ 8.50407957e-04 -1.03424096e-04 3.18666355e-04] [ 6.29340197e-04 2.05264261e-04 1.88234027e-04] [-6.29340198e-04 -2.05264262e-04 1.88234028e-04] [ 8.56852152e-05 -1.88731064e-03 -2.38569138e-04] [-8.56852155e-05 1.88731066e-03 -2.38569140e-04] [-3.70720185e-04 3.17373228e-04 -4.73537798e-04] [ 3.70720183e-04 -3.17373222e-04 -4.73537804e-04] [ 1.06720996e-03 3.57039189e-04 -5.69305765e-04] [-1.06720995e-03 -3.57039184e-04 -5.69305760e-04] [ 2.63236690e-04 -3.73043663e-04 -7.96979712e-04] [-2.63236690e-04 3.73043665e-04 -7.96979724e-04] [ 9.73948260e-05 1.04968812e-03 -1.66368493e-04] [-9.73948247e-05 -1.04968812e-03 -1.66368482e-04]] Final stress: [-1.92254477e-05 -1.21459320e-05 -5.93711547e-05 4.36709828e-15 1.52262814e-15 -3.37180387e-05] Minimization converged after 118 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 8.52290044e-04 -1.31503773e-03 6.67387995e-06] [-8.21332381e-04 6.44773498e-04 -8.66455266e-04] [ 9.45858187e-04 -1.12083625e-03 8.89133818e-05] [-9.74778874e-04 -1.17173647e-03 7.13422437e-05] [ 1.31765363e-03 -5.62467513e-04 -2.40133404e-03] [-1.37644307e-03 -2.08347336e-04 2.08329575e-03] [-6.11081427e-04 -4.65588647e-04 1.51994959e-03] [ 5.64265262e-04 -8.32026625e-04 -1.88349460e-03] [ 4.59841831e-04 9.79065930e-04 1.48535707e-03] [-4.63413526e-04 9.29755238e-04 -1.70397701e-03] [ 8.42316576e-04 -9.51372287e-05 1.35270623e-03] [-8.43651547e-04 -3.10301533e-04 -1.55684164e-03] [-9.52754519e-04 7.39389433e-04 5.88952801e-04] [ 9.46530379e-04 8.93309061e-04 -1.27435680e-03] [-3.71336776e-03 6.10514395e-04 7.23321148e-04] [ 3.70918712e-03 5.44976842e-04 -1.26203025e-03] [ 6.51796735e-04 1.62258039e-05 5.61418066e-04] [-6.18557709e-04 -1.97166347e-04 -8.91282611e-04] [-1.38534890e-05 -7.02443155e-04 -1.08527800e-03] [ 1.92552279e-05 -5.05116846e-04 1.45814309e-03] [ 1.46018861e-03 -1.71626076e-03 -1.28470785e-03] [-1.45965700e-03 -1.67099744e-03 1.52113010e-03] [-3.63541665e-04 -1.09872688e-03 -2.65120465e-04] [ 3.69569381e-04 -1.22372149e-03 7.60896663e-04] [-5.26052246e-04 -2.19263514e-03 5.95037498e-04] [ 5.61137560e-04 -1.52453162e-03 -8.06602782e-04] [ 1.00712456e-04 1.39615885e-04 -5.57024409e-04] [-9.99314262e-05 -4.09786187e-04 1.12077631e-03] [ 8.15173114e-04 2.20778652e-03 3.07874147e-03] [-7.45168785e-04 2.01810872e-03 -2.31876936e-03] [ 7.33675491e-04 -1.42909273e-03 1.95658271e-04] [-7.15680498e-04 -1.29590068e-03 -6.88814844e-04] [-1.52354097e-03 -8.74841641e-04 -8.87915881e-05] [ 1.53712927e-03 -8.63954118e-04 -2.59169951e-05] [-7.17290418e-04 2.72833749e-03 1.13608476e-03] [ 1.74517313e-03 7.50645322e-04 1.00009627e-04] [ 6.19315165e-04 2.90131619e-03 -7.39168045e-04] [-1.46848436e-03 4.69233107e-04 3.05437634e-04] [ 1.15357487e-03 1.18551228e-03 1.13651989e-03] [-9.39421699e-04 5.44416484e-04 -4.07682657e-04] [-1.39631833e-03 1.29242471e-03 -8.11571394e-04] [ 1.20432312e-03 4.37701282e-04 7.33238376e-04] [ 9.90394036e-04 1.72002430e-04 -1.37453949e-03] [ 1.30517601e-03 1.24704902e-03 -2.23162773e-03] [-8.81671418e-04 1.02775786e-03 1.42204699e-03] [-1.46113639e-03 3.90413509e-04 2.27672761e-03] [ 1.56437723e-03 -8.59843830e-04 -3.86627430e-04] [ 4.90592910e-04 -8.69003115e-04 1.15903731e-03] [-1.83376376e-03 -8.59354242e-04 2.69675287e-04] [-2.82661262e-04 -8.78554123e-04 -1.24472343e-03] [ 1.78954498e-03 6.79306136e-04 1.35368624e-03] [ 8.19203197e-04 7.16219507e-05 -1.47316291e-03] [-1.97763169e-03 4.88839595e-04 -1.56194665e-03] [-7.25378254e-04 2.30556708e-04 1.22919880e-03] [ 1.89104242e-03 3.28935941e-04 -5.92338908e-04] [-6.10733137e-05 1.83587163e-03 -3.17142968e-04] [-1.34533892e-03 9.95337145e-05 6.72907799e-04] [-3.97982304e-04 2.06472355e-03 3.92771547e-04] [ 3.91920328e-03 1.62816918e-04 -1.18404879e-03] [ 3.38319549e-04 -1.79869668e-03 -1.20548269e-03] [-3.85068181e-03 -4.32900180e-04 1.21980893e-03] [-4.28972958e-04 -1.19324967e-03 1.26605722e-03] [-1.72143697e-04 9.80283185e-04 1.19814337e-04] [ 2.96944750e-04 -2.40663715e-03 -1.87916793e-04] [-3.34670644e-04 1.40006697e-03 2.94546009e-05] [ 2.00752404e-04 -2.84016282e-03 3.31126608e-04] [ 4.63381680e-04 1.00777541e-03 1.76510402e-03] [-1.54475680e-03 -6.67866347e-04 -3.43334167e-04] [-5.16462872e-04 8.93201033e-04 -1.84380790e-03] [ 1.56554888e-03 -5.65964279e-04 2.56955050e-04] [ 1.82239897e-03 9.43487228e-04 -8.56455608e-04] [ 1.15908990e-03 -2.96471812e-03 -5.66953593e-04] [-1.56984237e-03 4.87450152e-04 9.39511463e-04] [-1.47263986e-03 -2.62224733e-03 6.66891248e-04] [-9.38170403e-05 3.83554045e-04 -3.47285890e-04] [-5.25136287e-04 -2.50464447e-04 -1.13326057e-03] [ 1.60906892e-04 5.37536334e-04 5.04760713e-05] [ 4.77725353e-04 -3.93292628e-04 8.43539527e-04] [ 2.85095385e-03 1.16068873e-03 1.40456889e-03] [-2.87300373e-03 1.26928219e-03 -9.42333588e-04] [ 1.41607999e-03 1.19779593e-03 1.18696845e-03] [-1.44502045e-03 1.02685385e-03 -8.54977560e-04] [ 7.13262265e-04 -7.50148376e-04 -1.55591849e-03] [-7.12878903e-04 -6.44710301e-04 1.47762725e-03] [ 1.86970832e-04 5.79846801e-04 -2.00191516e-03] [-1.83700090e-04 7.04802569e-04 1.79050318e-03] [-2.88646835e-03 4.57458690e-04 7.55810466e-04] [ 2.97510992e-03 -7.99721820e-04 -1.02739756e-03] [-9.03927223e-04 -1.62200867e-03 -1.20553803e-03] [ 8.91609887e-04 -1.26784902e-03 9.10679469e-04] [-1.26186310e-03 8.43779590e-04 1.44211534e-03] [ 1.22821688e-03 7.82118428e-04 -1.70560834e-03] [ 5.90103979e-05 5.88474937e-04 -1.93491072e-03] [-3.57714085e-05 6.59836972e-04 2.27380081e-03] [-6.33978402e-04 3.34964066e-03 -9.64534318e-04] [ 2.29576004e-04 4.69200618e-04 -1.36865941e-03] [ 5.91050592e-04 2.81001971e-03 1.65369144e-03] [-1.96984488e-04 1.03196007e-03 2.09808731e-03] [-6.13604885e-04 -1.74682404e-03 -1.48119714e-03] [ 1.01384400e-03 -1.20601712e-03 5.05423760e-04] [ 6.10926673e-04 -1.77546779e-03 1.24535273e-03] [-1.06289653e-03 -1.19529474e-03 -8.20157136e-04]] Final stress: [-4.59416968e-06 3.02043733e-06 -1.76816222e-05 2.44322166e-05 5.77837678e-08 -4.68751747e-05] Minimization converged after 142 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 9.03494229e-04 -7.48019493e-04 -9.39153001e-04] [-9.44353759e-04 1.44316768e-03 -4.53396084e-05] [ 1.08618671e-03 1.32485979e-03 9.08266633e-05] [-1.05101155e-03 1.26458235e-03 6.55463956e-05] [ 1.54051482e-03 2.12232488e-04 2.40969211e-03] [-1.46888741e-03 6.29763973e-04 -2.78100625e-03] [-6.31881928e-04 9.81621772e-04 -2.16180809e-03] [ 6.88669906e-04 5.36701898e-04 1.71674582e-03] [ 4.97055118e-04 -1.01131462e-03 -1.89999502e-03] [-4.93089442e-04 -1.08384551e-03 1.67001981e-03] [ 9.25536674e-04 3.55713800e-04 -1.85515174e-03] [-9.22817376e-04 1.00974185e-04 1.62374855e-03] [-1.04623281e-03 -1.03070875e-03 -1.45133856e-03] [ 1.05388720e-03 -8.67871394e-04 6.73872839e-04] [-4.17487316e-03 -6.00117981e-04 -1.47407603e-03] [ 4.17805388e-03 -6.76887271e-04 8.89466671e-04] [ 6.41236388e-04 2.15811968e-04 -1.00042675e-03] [-6.82683375e-04 -1.70325528e-05 6.13417378e-04] [ 3.39441276e-05 6.07144181e-04 1.67771811e-03] [-4.15407555e-05 8.42141723e-04 -1.25253443e-03] [ 1.66486727e-03 1.83073983e-03 1.67904286e-03] [-1.66382139e-03 1.88033242e-03 -1.42951240e-03] [-3.81140035e-04 1.30246173e-03 8.07531588e-04] [ 3.73845006e-04 1.16802385e-03 -2.46915063e-04] [-6.22539745e-04 1.74817599e-03 -9.18731848e-04] [ 5.79599664e-04 2.55679462e-03 7.12932945e-04] [ 1.31722582e-04 4.90700543e-04 1.33611245e-03] [-1.32182922e-04 -1.31855551e-04 -7.30089071e-04] [ 8.57648749e-04 -2.23314247e-03 -2.59599335e-03] [-9.46772273e-04 -2.48297509e-03 3.42907775e-03] [ 7.67020485e-04 1.43670222e-03 -7.56688094e-04] [-7.88708638e-04 1.60812677e-03 2.00527077e-04] [-1.70180794e-03 9.73745290e-04 -4.20685924e-05] [ 1.68530213e-03 1.01675297e-03 -8.63434944e-05] [-1.96371060e-03 -8.38240258e-04 1.42107991e-04] [ 8.64016545e-04 -3.08708669e-03 1.28202245e-03] [ 1.59930430e-03 -5.14048857e-04 3.15206789e-04] [-7.18623665e-04 -3.27667666e-03 -8.32023939e-04] [ 1.00064948e-03 -5.91019849e-04 -4.67704540e-04] [-1.32096986e-03 -1.36272628e-03 1.27772892e-03] [-1.30028814e-03 -4.70353160e-04 8.45477844e-04] [ 1.59803926e-03 -1.47966752e-03 -9.04789526e-04] [-1.49063780e-03 -1.41833967e-03 -2.46709883e-03] [-1.13468047e-03 -2.04336553e-04 -1.54729861e-03] [ 1.66124524e-03 -4.26557131e-04 2.55527617e-03] [ 1.02361476e-03 -1.19439277e-03 1.63910742e-03] [-5.22696633e-04 9.66832514e-04 1.26077881e-03] [-1.71597707e-03 9.35174106e-04 -4.29234348e-04] [ 3.03885056e-04 9.65959319e-04 -1.34688636e-03] [ 2.01275660e-03 9.45608183e-04 3.06471277e-04] [-9.47043374e-04 -1.00265438e-04 -1.65524036e-03] [-1.99217152e-03 -7.64068853e-04 1.56018187e-03] [ 8.09546879e-04 -2.82565509e-04 1.37840038e-03] [ 2.24545666e-03 -5.43981194e-04 -1.79096070e-03] [ 4.99145613e-05 -2.03865137e-03 -3.03141388e-04] [-2.22832188e-03 -3.49518725e-04 -6.89453703e-04] [ 4.40678635e-04 -2.29435054e-03 4.02054507e-04] [ 1.62764536e-03 -9.48694531e-05 7.94212591e-04] [-4.36795399e-04 2.04306007e-03 -1.38328697e-03] [-4.42206754e-03 -1.58131158e-04 -1.34106654e-03] [ 5.35041548e-04 1.35493284e-03 1.43817537e-03] [ 4.35072917e-03 5.18869553e-04 1.36561503e-03] [-3.56805587e-04 2.67409460e-03 -1.98683575e-04] [ 1.27751116e-04 -1.11004646e-03 8.72184646e-05] [-2.04203614e-04 3.16494775e-03 3.43554610e-04] [ 4.43656293e-04 -1.58390789e-03 6.44218791e-05] [ 1.68680535e-03 7.92191554e-04 -3.31344642e-04] [-4.69465121e-04 -1.16316861e-03 1.98139720e-03] [-1.69940520e-03 6.85334978e-04 2.35077121e-04] [ 5.21712578e-04 -1.04084911e-03 -2.06797322e-03] [-1.34174635e-03 3.31869429e-03 -6.98378645e-04] [-2.10531415e-03 -1.04923098e-03 -9.66102536e-04] [ 1.67937131e-03 2.92484297e-03 8.02121040e-04] [ 1.84754331e-03 -5.15676324e-04 1.05070947e-03] [ 6.28178459e-04 2.59390953e-04 -1.30177229e-03] [ 9.73957272e-05 -4.43184213e-04 -3.51103451e-04] [-5.71289370e-04 4.15390328e-04 9.74521493e-04] [-1.77410105e-04 -6.13507024e-04 1.60067291e-05] [ 3.18399444e-03 -1.43088028e-03 -1.07632734e-03] [-3.15696172e-03 -1.31151632e-03 1.61860614e-03] [ 1.63308086e-03 -1.15544773e-03 -9.21530338e-04] [-1.59814625e-03 -1.34701748e-03 1.29960885e-03] [ 8.34679720e-04 7.54671406e-04 1.69400249e-03] [-8.34939830e-04 8.74697207e-04 -1.79340191e-03] [ 1.44763601e-04 -8.42316067e-04 2.09299746e-03] [-1.50019554e-04 -7.10331726e-04 -2.34477164e-03] [-3.35583978e-03 9.29172538e-04 -1.17217356e-03] [ 3.24641412e-03 -3.94958681e-04 8.40338637e-04] [-9.91551972e-04 1.42085463e-03 9.99577696e-04] [ 1.00723899e-03 1.82102666e-03 -1.33675891e-03] [-1.36694358e-03 -8.84072754e-04 -1.95402190e-03] [ 1.40909040e-03 -9.58498582e-04 1.65879127e-03] [ 5.35457894e-05 -7.29959582e-04 2.57798365e-03] [-8.69869080e-05 -6.86042652e-04 -2.18708754e-03] [-2.48877731e-04 -5.33120136e-04 -1.52489571e-03] [ 6.94419467e-04 -3.76302329e-03 -1.05747214e-03] [ 2.03219640e-04 -1.18314929e-03 2.37167794e-03] [-6.35064499e-04 -3.14327492e-03 1.85392872e-03] [-1.14594886e-03 1.36112831e-03 5.83153778e-04] [ 6.86272181e-04 1.96463129e-03 -1.67428797e-03] [ 1.19691782e-03 1.36174034e-03 -9.38620360e-04] [-6.71911542e-04 1.98628004e-03 1.41727380e-03]] Final stress: [-5.45132117e-06 3.87824909e-06 -1.92535876e-05 -2.52256746e-05 -6.89184008e-08 -5.21739948e-05] Minimization converged after 139 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 150 steps. Minimization converged after 151 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-6.33278781e-04 -2.76507777e-05 -4.39392526e-05] [-9.05675913e-04 2.49868457e-05 -1.58880567e-05] [-2.19442272e-04 4.06111384e-05 -6.06937424e-05] [-1.12003729e-03 -4.23372525e-05 -1.87783268e-05] [-1.06741866e-03 -1.71454591e-04 5.21357244e-05] [-6.49354883e-04 2.36588728e-04 5.42467773e-05] [ 3.67763531e-04 -2.96549315e-04 3.86148770e-04] [ 7.65275525e-04 3.53864101e-04 4.48851449e-04] [ 5.78790162e-05 -1.14927886e-04 -2.08374894e-04] [-1.43161746e-03 1.40530077e-04 -2.26003370e-04] [ 1.63317449e-03 1.63734225e-04 -3.17965800e-05] [-1.09152949e-05 -1.28777144e-04 -6.90872102e-06] [-1.12020651e-03 -2.01824881e-05 1.74213764e-04] [ 5.60035501e-04 5.47476482e-05 2.42382335e-04] [-1.52409777e-03 1.70022165e-04 1.29222821e-04] [ 1.01834644e-03 -1.53513678e-04 1.35656939e-04] [ 5.54365021e-04 -1.28824103e-05 5.37866509e-05] [-3.05582999e-04 8.99546184e-07 4.27367096e-05] [ 1.08510372e-04 -7.51897221e-06 -8.74119526e-05] [-7.14584916e-04 7.03636763e-06 -8.14362778e-05] [ 6.35503950e-04 6.48866058e-05 1.25762429e-04] [ 4.36380162e-04 -4.16391696e-05 1.29424705e-04] [-4.31228041e-04 3.54722594e-04 8.69025038e-05] [ 7.66402492e-04 -4.12767991e-04 7.73040660e-05] [-6.07816109e-04 3.08854500e-04 -4.33699718e-04] [ 5.18006115e-05 -3.58744899e-04 -5.65866593e-04] [-1.37277396e-04 -3.17284081e-04 -1.72442425e-04] [ 1.72722096e-04 3.38820671e-04 -2.58972500e-04] [ 1.95633294e-04 -2.09907719e-05 3.01726563e-04] [-8.82935991e-04 -3.02313498e-05 3.01914208e-04] [-6.14904753e-04 -1.32573390e-05 -1.94457609e-04] [-1.80649056e-03 -1.51653129e-05 -1.45697725e-04] [-1.75924528e-04 -9.15180416e-05 -2.57294942e-05] [ 4.17104857e-04 6.75155539e-05 -2.99266196e-05] [-9.02604203e-04 3.58484544e-04 2.79171033e-05] [ 7.92117808e-04 1.24207084e-04 -2.99500627e-05] [ 6.03120664e-04 -9.25285080e-05 3.16995326e-04] [-4.95602666e-04 -4.17836313e-04 2.91857623e-04] [-3.19987922e-05 3.30118504e-04 -6.36681824e-04] [-5.12120481e-04 -5.09907396e-04 5.18875685e-04] [-4.47594217e-04 5.33270209e-04 -4.28654425e-04] [-1.09664766e-04 -3.95436849e-04 7.34721743e-04] [ 7.26559329e-04 -1.47424284e-03 -1.01336585e-03] [ 1.09172680e-03 5.24647896e-04 4.71146391e-04] [ 1.11146687e-03 -2.23610214e-04 -4.30516255e-04] [ 6.58601703e-04 1.26069325e-03 9.07949907e-04] [-4.72152261e-05 2.48174658e-04 -3.41827134e-04] [ 4.18918026e-04 -3.56045195e-04 -5.31522382e-04] [ 3.94229899e-04 2.52179289e-04 6.81728565e-04] [-5.61034057e-05 -1.29637503e-04 5.36382530e-04] [ 5.74847261e-04 -4.54292330e-05 1.97327229e-05] [-8.90502163e-04 -1.03987375e-04 -1.11326199e-04] [-1.06482310e-03 1.49954377e-04 -1.51901970e-04] [ 6.26528634e-04 -3.27899055e-05 -2.72560666e-04] [-1.37057613e-04 -1.17599448e-03 -1.10129786e-03] [-3.57855567e-04 -3.58862680e-04 3.23676636e-04] [-7.78142822e-04 1.12087939e-03 -7.74244797e-04] [ 4.03815393e-04 2.40486366e-04 6.03923606e-04] [ 8.07264200e-04 -1.15373151e-03 -5.37849874e-04] [-8.80334783e-04 -5.44955481e-04 3.32624177e-04] [-8.30591327e-04 3.26137854e-04 -3.02369778e-04] [ 7.83137582e-04 1.39914268e-03 5.00370931e-04] [-3.93225941e-04 -6.73028893e-06 -7.27401262e-04] [ 5.47688383e-04 -1.57093128e-03 5.34251581e-04] [ 6.74873222e-04 1.40319523e-03 -8.22836350e-04] [-6.15738641e-04 2.11063393e-04 3.67622816e-04] [ 1.04333730e-03 5.17738670e-04 5.47697330e-04] [-1.05298381e-03 -2.94023553e-05 6.80913511e-04] [-1.08913029e-03 1.04826919e-04 -7.78715200e-04] [ 1.06882604e-03 -6.12263790e-04 -5.13267106e-04] [ 2.81780951e-04 3.09885639e-04 -5.07293350e-04] [ 1.25505598e-04 -1.08012003e-03 5.11508405e-04] [-1.23410917e-04 4.07578285e-04 -2.57192721e-04] [ 4.80942948e-04 1.74352585e-04 7.35876800e-04] [-3.79407972e-04 6.38007703e-04 9.49657725e-06] [-7.87291621e-04 -3.88225387e-04 3.72233756e-04] [-8.81744482e-04 2.65902820e-04 -2.93674571e-04] [-3.32041209e-04 -4.97140966e-04 1.47702276e-04] [ 8.31835764e-04 -2.02654876e-04 1.57950647e-04] [-2.23353274e-04 2.60521327e-04 2.76638441e-04] [ 1.75243183e-03 5.18733300e-05 9.06026464e-06] [-1.52770534e-03 -4.23093713e-05 2.17573838e-06] [ 2.86899511e-04 1.13115966e-04 -9.43174362e-05] [ 4.00422737e-04 -1.00593778e-04 -8.35926008e-05] [ 8.28155892e-04 3.87300803e-04 -3.58011461e-04] [-1.52787829e-03 -3.60417597e-04 -3.18507965e-04] [ 2.42515864e-04 -1.51729571e-04 -3.85467401e-05] [ 1.08775198e-03 1.17536689e-05 -5.49520889e-06] [-9.18798784e-04 -4.48308660e-05 7.50466878e-06] [ 2.31093492e-03 8.50083385e-05 -1.50307396e-05] [-3.58075133e-04 -3.93476476e-05 5.69978090e-05] [ 4.54198877e-04 3.07285860e-05 8.60606053e-05] [ 8.04827913e-04 -2.17452973e-04 1.01797983e-05] [-5.07632776e-04 2.34612760e-04 2.21531194e-05] [-7.95583925e-04 -7.55354841e-05 -2.07701107e-04] [ 3.69133095e-04 -1.49361535e-03 -8.16141889e-04] [ 2.51486988e-04 1.15091068e-03 5.66309834e-04] [-6.19974402e-04 5.05106682e-04 -4.27827882e-05] [ 5.61777290e-04 -1.42902889e-04 8.66952559e-04] [ 1.23760382e-03 1.04261451e-04 -6.30919004e-04] [ 8.26562625e-04 5.68561253e-04 1.28574130e-03] [ 8.32252994e-04 -3.83909507e-04 -4.81826774e-04]] Final stress: [-1.22783445e-06 -1.22355747e-06 -1.00122683e-05 6.24815440e-09 -7.21180152e-08 -1.19844321e-05] Minimization converged after 153 steps. Minimization converged after 113 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.26055175e-04 -5.52045009e-04 -1.22715604e-04] [ 4.26055174e-04 5.52045012e-04 -1.22715603e-04] [-6.56651387e-04 7.58676291e-05 1.73288091e-05] [ 6.56651387e-04 -7.58676285e-05 1.73288101e-05] [-8.76326327e-04 -1.61024311e-04 1.14531646e-04] [ 8.76326327e-04 1.61024311e-04 1.14531647e-04] [ 1.41468102e-03 -2.69401701e-04 2.12678935e-04] [-1.41468102e-03 2.69401712e-04 2.12678948e-04] [ 5.95895064e-04 -1.47754456e-05 -2.67472033e-05] [-5.95895065e-04 1.47754424e-05 -2.67472040e-05] [-1.61606589e-04 1.81335159e-04 -1.16279721e-04] [ 1.61606589e-04 -1.81335160e-04 -1.16279723e-04] [-3.16600746e-04 7.55026360e-05 3.15246252e-04] [ 3.16600746e-04 -7.55026376e-05 3.15246249e-04] [ 1.30873109e-03 5.60079157e-04 4.62037333e-04] [-1.30873109e-03 -5.60079158e-04 4.62037336e-04] [ 4.55102092e-04 1.66333426e-05 5.17172154e-05] [-4.55102092e-04 -1.66333475e-05 5.17172108e-05] [ 5.24629464e-04 -1.83984599e-04 -1.38551387e-04] [-5.24629466e-04 1.83984597e-04 -1.38551393e-04] [-1.39749860e-03 8.68489338e-05 1.12625104e-04] [ 1.39749860e-03 -8.68489360e-05 1.12625104e-04] [ 6.20960766e-04 3.62367605e-04 1.58845423e-05] [-6.20960767e-04 -3.62367607e-04 1.58845426e-05] [ 3.26746633e-04 2.19810782e-04 -4.68508926e-04] [-3.26746634e-04 -2.19810774e-04 -4.68508917e-04] [ 5.19926040e-04 -5.52440723e-04 -6.22926138e-04] [-5.19926040e-04 5.52440723e-04 -6.22926136e-04] [-1.30428042e-03 1.47302954e-04 1.78165257e-04] [ 1.30428042e-03 -1.47302955e-04 1.78165256e-04] [ 2.96353475e-04 -9.53077561e-05 -1.59783199e-04] [-2.96353475e-04 9.53077570e-05 -1.59783201e-04] [ 1.10616874e-03 -1.28136892e-04 -8.56961043e-06] [-1.10616874e-03 1.28136890e-04 -8.56961067e-06] [ 6.14740885e-04 -1.20816795e-03 1.38372752e-04] [-6.14740884e-04 1.20816795e-03 1.38372754e-04] [-8.96052822e-04 -1.30115889e-03 1.69171291e-04] [ 8.96052822e-04 1.30115889e-03 1.69171289e-04] [-9.25635908e-05 3.51539161e-04 -1.09762166e-03] [ 9.25635924e-05 -3.51539159e-04 -1.09762166e-03] [-4.72456168e-05 4.18811549e-04 1.39582011e-03] [ 4.72456144e-05 -4.18811549e-04 1.39582011e-03] [ 6.82078678e-04 7.95018227e-04 1.05400291e-03] [-6.82078678e-04 -7.95018226e-04 1.05400291e-03] [-8.04824660e-04 1.19025261e-03 -1.03569838e-03] [ 8.04824660e-04 -1.19025261e-03 -1.03569838e-03] [ 1.19351559e-03 -7.10958920e-04 -9.58775977e-04] [-1.19351559e-03 7.10958921e-04 -9.58775977e-04] [-1.34924853e-03 -8.12034023e-04 9.25848499e-04] [ 1.34924853e-03 8.12034025e-04 9.25848499e-04] [ 5.79300589e-05 6.26316843e-04 5.99522471e-04] [-5.79300583e-05 -6.26316845e-04 5.99522473e-04] [-2.90801950e-04 7.33663176e-04 -9.12653580e-04] [ 2.90801950e-04 -7.33663178e-04 -9.12653582e-04] [-1.67365667e-03 7.09114004e-04 -5.51102129e-04] [ 1.67365667e-03 -7.09114000e-04 -5.51102129e-04] [ 6.62958179e-04 1.38643987e-03 3.02842068e-04] [-6.62958178e-04 -1.38643986e-03 3.02842068e-04] [-1.44187753e-03 -2.10399610e-06 -1.05406310e-04] [ 1.44187753e-03 2.10399542e-06 -1.05406310e-04] [ 1.32880487e-03 -2.13965234e-04 3.59818957e-05] [-1.32880487e-03 2.13965235e-04 3.59818967e-05] [-1.07333531e-03 -3.50743520e-04 -2.22158055e-03] [ 1.07333531e-03 3.50743519e-04 -2.22158055e-03] [ 9.64906911e-04 -2.61781650e-04 1.98068172e-03] [-9.64906908e-04 2.61781649e-04 1.98068172e-03] [-4.71374871e-06 -3.55495521e-04 -5.49703716e-04] [ 4.71374727e-06 3.55495522e-04 -5.49703714e-04] [ 2.67037161e-04 -1.18908348e-04 7.59818635e-04] [-2.67037159e-04 1.18908348e-04 7.59818631e-04] [-1.90734264e-03 -3.18750391e-04 9.14196230e-04] [ 1.90734264e-03 3.18750393e-04 9.14196229e-04] [ 1.29841356e-03 -6.42055265e-04 -9.60246046e-04] [-1.29841356e-03 6.42055270e-04 -9.60246043e-04] [ 1.02460377e-04 -2.01997146e-04 5.18076457e-04] [-1.02460376e-04 2.01997145e-04 5.18076461e-04] [ 1.40426217e-04 -4.03286685e-04 -5.13640668e-04] [-1.40426220e-04 4.03286685e-04 -5.13640672e-04] [-2.97215716e-05 -1.66775521e-04 7.67525585e-06] [ 2.97215701e-05 1.66775517e-04 7.67525181e-06] [ 1.23178547e-03 -1.57880635e-05 4.64479526e-06] [-1.23178547e-03 1.57880630e-05 4.64479608e-06] [-7.83987896e-04 1.53410509e-04 -2.15941082e-04] [ 7.83987896e-04 -1.53410510e-04 -2.15941082e-04] [ 1.55809137e-04 3.33178733e-04 -1.57595625e-04] [-1.55809137e-04 -3.33178740e-04 -1.57595632e-04] [-7.59094615e-04 2.49308534e-04 5.46434435e-06] [ 7.59094613e-04 -2.49308535e-04 5.46434456e-06] [-1.81417202e-03 -3.17363277e-05 -5.82196075e-05] [ 1.81417202e-03 3.17363291e-05 -5.82196080e-05] [ 1.88165594e-03 -1.92542423e-04 1.27534291e-04] [-1.88165594e-03 1.92542424e-04 1.27534291e-04] [-1.38303878e-04 -1.52789308e-04 1.57429881e-05] [ 1.38303879e-04 1.52789306e-04 1.57429874e-05] [-8.99627575e-04 6.87239828e-04 4.51017507e-04] [ 8.99627577e-04 -6.87239830e-04 4.51017502e-04] [ 7.40537142e-04 2.52162785e-04 -4.85953531e-04] [-7.40537146e-04 -2.52162787e-04 -4.85953524e-04] [ 9.41984088e-04 6.87169910e-04 6.18448701e-04] [-9.41984089e-04 -6.87169911e-04 6.18448696e-04] [-1.27743837e-03 1.28761331e-03 -1.68573745e-05] [ 1.27743837e-03 -1.28761331e-03 -1.68573690e-05]] Final stress: [-1.92322930e-06 -1.91756095e-06 -6.27286552e-06 -2.32927537e-15 -5.42581333e-16 2.93837622e-05] Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 10 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 9 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. Minimization converged after 20 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.57762033e-04 -1.62230790e-04 2.00894886e-05] [-1.57762033e-04 1.62230794e-04 2.00894868e-05] [ 1.73785233e-04 1.16590527e-04 -8.89205290e-05] [-1.73785232e-04 -1.16590528e-04 -8.89205291e-05] [ 1.24981046e-04 -8.86179884e-06 -5.81683034e-05] [-1.24981046e-04 8.86179969e-06 -5.81683041e-05] [-3.21393993e-04 3.57400093e-05 -2.17303017e-04] [ 3.21393992e-04 -3.57400109e-05 -2.17303018e-04] [-8.12245574e-06 4.34287686e-04 -1.34082978e-04] [ 8.12245588e-06 -4.34287685e-04 -1.34082979e-04] [ 2.96091212e-05 -1.38049530e-04 -8.09869531e-05] [-2.96091217e-05 1.38049530e-04 -8.09869533e-05] [-2.15906954e-04 9.12295716e-06 -1.42353093e-05] [ 2.15906954e-04 -9.12295665e-06 -1.42353093e-05] [-1.85234518e-04 2.34798973e-04 1.93017972e-04] [ 1.85234518e-04 -2.34798974e-04 1.93017971e-04] [ 4.66964353e-05 7.75550088e-05 -4.51584960e-05] [-4.66964355e-05 -7.75550089e-05 -4.51584962e-05] [-8.89298757e-05 -2.15769423e-04 6.65188022e-05] [ 8.89298757e-05 2.15769423e-04 6.65188028e-05] [ 4.17145769e-04 -3.96397221e-04 1.70795961e-04] [-4.17145770e-04 3.96397222e-04 1.70795961e-04] [-4.62073413e-04 6.70185213e-05 -8.85801330e-05] [ 4.62073413e-04 -6.70185192e-05 -8.85801327e-05] [ 1.46485023e-04 4.97080533e-05 1.54491081e-05] [-1.46485023e-04 -4.97080528e-05 1.54491094e-05] [-7.45868239e-05 -1.02758399e-04 -1.51594313e-04] [ 7.45868241e-05 1.02758398e-04 -1.51594312e-04] [ 1.38885174e-04 3.40025951e-04 -2.97198899e-05] [-1.38885174e-04 -3.40025951e-04 -2.97198898e-05] [ 3.93458936e-05 -2.87633816e-04 1.57975517e-04] [-3.93458931e-05 2.87633817e-04 1.57975517e-04] [-3.54971535e-04 -5.29141135e-05 -2.35715430e-05] [ 3.54971536e-04 5.29141128e-05 -2.35715429e-05] [-1.39898044e-04 2.91350757e-05 2.40802807e-05] [ 1.39898044e-04 -2.91350765e-05 2.40802809e-05] [ 5.10593949e-05 1.93424081e-04 3.08569281e-04] [-5.10593954e-05 -1.93424082e-04 3.08569281e-04] [-1.55922335e-04 -1.19143909e-05 4.12161596e-04] [ 1.55922336e-04 1.19143905e-05 4.12161596e-04] [ 7.02991609e-05 -1.13477402e-04 -1.53921519e-04] [-7.02991599e-05 1.13477403e-04 -1.53921520e-04] [-2.38845472e-04 -5.56490673e-04 -2.57869895e-04] [ 2.38845471e-04 5.56490673e-04 -2.57869894e-04] [-6.28486840e-05 -1.75057383e-05 1.74960488e-04] [ 6.28486838e-05 1.75057382e-05 1.74960488e-04] [-1.85244239e-04 2.40140966e-04 2.40960674e-04] [ 1.85244239e-04 -2.40140965e-04 2.40960673e-04] [-1.31927127e-05 9.63961301e-05 -2.73298452e-04] [ 1.31927122e-05 -9.63961302e-05 -2.73298451e-04] [ 1.33247632e-04 4.80051629e-05 -3.29754779e-04] [-1.33247631e-04 -4.80051624e-05 -3.29754779e-04] [-8.16977749e-05 -1.37763687e-04 -1.17447192e-04] [ 8.16977751e-05 1.37763687e-04 -1.17447191e-04] [-3.85214314e-05 7.03523476e-06 4.23462419e-04] [ 3.85214315e-05 -7.03523486e-06 4.23462419e-04] [-3.09114166e-04 9.34740539e-05 5.48904243e-05] [ 3.09114166e-04 -9.34740549e-05 5.48904235e-05] [ 7.01692641e-05 2.36730297e-04 -1.79810815e-05] [-7.01692639e-05 -2.36730296e-04 -1.79810816e-05] [-3.47928636e-04 -1.20385304e-04 -1.20647610e-05] [ 3.47928636e-04 1.20385304e-04 -1.20647609e-05] [ 5.57480546e-05 1.25714509e-04 4.99408277e-04] [-5.57480547e-05 -1.25714509e-04 4.99408278e-04] [-1.78188778e-04 1.34460356e-04 -6.31372775e-04] [ 1.78188777e-04 -1.34460355e-04 -6.31372776e-04] [-4.88046914e-05 -1.46381740e-04 2.11540813e-04] [ 4.88046910e-05 1.46381740e-04 2.11540813e-04] [ 1.30735966e-05 -4.91970301e-06 3.90087190e-06] [-1.30735975e-05 4.91970309e-06 3.90087123e-06] [ 3.56364866e-04 -1.36983970e-04 -2.97419308e-04] [-3.56364866e-04 1.36983971e-04 -2.97419309e-04] [-7.75692855e-04 2.97424838e-05 -1.74492872e-04] [ 7.75692854e-04 -2.97424835e-05 -1.74492873e-04] [ 2.19402035e-04 -1.50643180e-05 -2.67430155e-04] [-2.19402035e-04 1.50643178e-05 -2.67430156e-04] [-6.20416178e-05 8.19785321e-05 1.16049182e-04] [ 6.20416181e-05 -8.19785324e-05 1.16049183e-04] [ 1.05310776e-04 1.57748778e-04 -4.98006064e-05] [-1.05310775e-04 -1.57748779e-04 -4.98006063e-05] [-1.45515327e-04 1.10003871e-04 7.58772039e-05] [ 1.45515326e-04 -1.10003872e-04 7.58772042e-05] [-1.03642715e-04 1.74710014e-04 -1.71455379e-04] [ 1.03642715e-04 -1.74710015e-04 -1.71455379e-04] [-1.47663785e-04 -1.86258251e-04 2.73753695e-05] [ 1.47663785e-04 1.86258251e-04 2.73753701e-05] [ 1.49841673e-04 8.88773978e-05 -9.59355651e-06] [-1.49841673e-04 -8.88774011e-05 -9.59355563e-06] [ 2.37756766e-04 -1.31763787e-04 -8.86263657e-05] [-2.37756765e-04 1.31763786e-04 -8.86263654e-05] [-4.38471728e-04 -2.27860897e-04 1.32916963e-04] [ 4.38471728e-04 2.27860898e-04 1.32916963e-04] [ 5.35835352e-05 6.84592934e-05 1.28735347e-04] [-5.35835363e-05 -6.84592947e-05 1.28735347e-04] [ 2.75151804e-04 -2.45609589e-04 -2.24533307e-05] [-2.75151804e-04 2.45609588e-04 -2.24533299e-05] [ 1.32650064e-04 -4.49908645e-05 8.86214927e-05] [-1.32650064e-04 4.49908642e-05 8.86214908e-05] [-8.28041787e-05 2.82970563e-05 1.10421033e-04] [ 8.28041783e-05 -2.82970562e-05 1.10421034e-04] [ 3.91958324e-04 -7.63193339e-05 1.49524930e-04] [-3.91958324e-04 7.63193342e-05 1.49524930e-04]] Final stress: [ 1.89459938e-05 1.15924571e-05 4.82513250e-06 -8.61657385e-16 1.10904030e-15 -6.36755116e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-1.54716333e-04 -1.79484080e-04 1.42790761e-05] [ 1.54716332e-04 1.79484074e-04 1.42790773e-05] [-1.70946497e-04 1.16423647e-04 -8.26495218e-05] [ 1.70946497e-04 -1.16423646e-04 -8.26495227e-05] [-1.22544305e-04 -6.56414555e-06 -5.63558388e-05] [ 1.22544306e-04 6.56414562e-06 -5.63558390e-05] [ 3.19441032e-04 4.32379422e-05 -2.24326017e-04] [-3.19441031e-04 -4.32379452e-05 -2.24326020e-04] [ 9.81442220e-06 4.35042086e-04 -1.28235407e-04] [-9.81442210e-06 -4.35042084e-04 -1.28235406e-04] [-3.04711495e-05 -1.34188168e-04 -8.47498665e-05] [ 3.04711493e-05 1.34188169e-04 -8.47498664e-05] [ 2.11895203e-04 1.50866894e-05 -1.62045329e-05] [-2.11895203e-04 -1.50866898e-05 -1.62045332e-05] [ 1.83834536e-04 2.41341796e-04 2.01797879e-04] [-1.83834535e-04 -2.41341793e-04 2.01797879e-04] [-4.07946732e-05 7.90769843e-05 -4.83252453e-05] [ 4.07946738e-05 -7.90769840e-05 -4.83252459e-05] [ 8.02191746e-05 -2.22299241e-04 6.89017907e-05] [-8.02191745e-05 2.22299241e-04 6.89017919e-05] [-4.16381391e-04 -3.96684045e-04 1.70686461e-04] [ 4.16381391e-04 3.96684046e-04 1.70686461e-04] [ 4.58609974e-04 5.22121105e-05 -8.56484384e-05] [-4.58609975e-04 -5.22121140e-05 -8.56484376e-05] [-1.48242419e-04 4.20954108e-05 6.38811195e-06] [ 1.48242418e-04 -4.20954108e-05 6.38811169e-06] [ 7.31835238e-05 -9.87551967e-05 -1.62609215e-04] [-7.31835244e-05 9.87551985e-05 -1.62609215e-04] [-1.42286194e-04 3.42442027e-04 -2.91025096e-05] [ 1.42286194e-04 -3.42442027e-04 -2.91025098e-05] [-3.52415013e-05 -2.88485058e-04 1.53653897e-04] [ 3.52415009e-05 2.88485058e-04 1.53653897e-04] [ 3.49598937e-04 -4.99035842e-05 -2.27347295e-05] [-3.49598938e-04 4.99035845e-05 -2.27347307e-05] [ 4.77457530e-05 -1.87895445e-04 3.08317324e-04] [-4.77457518e-05 1.87895445e-04 3.08317324e-04] [-1.40659483e-04 -3.81813380e-05 2.85067469e-05] [ 1.40659483e-04 3.81813386e-05 2.85067474e-05] [ 6.97144821e-05 1.06662998e-04 -1.45365031e-04] [-6.97144836e-05 -1.06662998e-04 -1.45365031e-04] [-1.54588010e-04 9.70444100e-06 4.07276842e-04] [ 1.54588011e-04 -9.70444134e-06 4.07276843e-04] [-6.44383670e-05 1.48011748e-05 1.74568393e-04] [ 6.44383663e-05 -1.48011744e-05 1.74568393e-04] [-2.38321455e-04 5.55455088e-04 -2.54716249e-04] [ 2.38321456e-04 -5.55455089e-04 -2.54716249e-04] [-1.53738895e-05 -9.96685311e-05 -2.68853164e-04] [ 1.53738892e-05 9.96685295e-05 -2.68853163e-04] [-1.89358134e-04 -2.34618844e-04 2.24643495e-04] [ 1.89358134e-04 2.34618842e-04 2.24643494e-04] [-8.40529050e-05 1.31261334e-04 -1.20382280e-04] [ 8.40529051e-05 -1.31261333e-04 -1.20382280e-04] [ 1.30550637e-04 -4.48319459e-05 -3.26491108e-04] [-1.30550637e-04 4.48319469e-05 -3.26491108e-04] [-3.15826641e-04 -9.52825617e-05 5.69097623e-05] [ 3.15826641e-04 9.52825598e-05 5.69097628e-05] [-3.35942334e-05 -1.34579270e-05 4.23180584e-04] [ 3.35942346e-05 1.34579249e-05 4.23180583e-04] [-3.48247867e-04 1.23363617e-04 -1.33079045e-05] [ 3.48247867e-04 -1.23363616e-04 -1.33079046e-05] [ 6.56667668e-05 -2.36270622e-04 -2.10133315e-05] [-6.56667667e-05 2.36270622e-04 -2.10133311e-05] [-1.77110456e-04 -1.38397394e-04 -6.18158217e-04] [ 1.77110455e-04 1.38397392e-04 -6.18158217e-04] [ 5.12114052e-05 -1.17968569e-04 4.97006049e-04] [-5.12114048e-05 1.17968567e-04 4.97006050e-04] [ 1.56689410e-05 -3.72418552e-06 -1.32661340e-06] [-1.56689404e-05 3.72418535e-06 -1.32661397e-06] [-5.60818175e-05 1.36198464e-04 2.14770608e-04] [ 5.60818170e-05 -1.36198464e-04 2.14770609e-04] [-7.79014256e-04 -2.49704509e-05 -1.71035445e-04] [ 7.79014257e-04 2.49704497e-05 -1.71035444e-04] [ 3.59033451e-04 1.40436880e-04 -3.01847275e-04] [-3.59033453e-04 -1.40436883e-04 -3.01847276e-04] [-6.68634335e-05 -8.21029230e-05 1.12671452e-04] [ 6.68634325e-05 8.21029225e-05 1.12671451e-04] [ 2.21727551e-04 1.25165634e-05 -2.65247248e-04] [-2.21727551e-04 -1.25165641e-05 -2.65247246e-04] [-9.93516694e-05 1.54631791e-04 -4.76115413e-05] [ 9.93516700e-05 -1.54631791e-04 -4.76115406e-05] [ 1.39614872e-04 1.03428369e-04 8.06324486e-05] [-1.39614873e-04 -1.03428369e-04 8.06324483e-05] [ 9.79051626e-05 1.76747895e-04 -1.73182600e-04] [-9.79051632e-05 -1.76747895e-04 -1.73182599e-04] [ 1.51358139e-04 -1.87688061e-04 3.07750213e-05] [-1.51358139e-04 1.87688063e-04 3.07750230e-05] [-1.47173590e-04 1.04497408e-04 -1.24072873e-05] [ 1.47173591e-04 -1.04497403e-04 -1.24072867e-05] [-2.31793907e-04 -1.25776860e-04 -9.18060656e-05] [ 2.31793907e-04 1.25776860e-04 -9.18060654e-05] [ 4.35562914e-04 -2.29632678e-04 1.27512352e-04] [-4.35562915e-04 2.29632677e-04 1.27512351e-04] [-5.97964100e-05 7.91744583e-05 1.30337939e-04] [ 5.97964116e-05 -7.91744561e-05 1.30337938e-04] [ 1.28997151e-04 4.41664411e-05 9.07167149e-05] [-1.28997152e-04 -4.41664395e-05 9.07167167e-05] [ 2.72491816e-04 2.41438526e-04 -1.57451159e-05] [-2.72491816e-04 -2.41438524e-04 -1.57451162e-05] [ 3.87188618e-04 7.20242570e-05 1.51628349e-04] [-3.87188617e-04 -7.20242555e-05 1.51628349e-04] [-8.33213783e-05 -3.42891591e-05 1.14276499e-04] [ 8.33213778e-05 3.42891603e-05 1.14276500e-04]] Final stress: [1.89427680e-05 1.15552376e-05 4.84956001e-06 7.75611155e-16 6.45346724e-16 6.29406381e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 2.55562977e-03 -1.30312579e-03 -2.19693846e-03] [-2.55562976e-03 1.30312578e-03 -2.19693844e-03] [ 2.94947511e-03 -3.45772545e-04 5.55659733e-04] [-2.94947510e-03 3.45772521e-04 5.55659725e-04] [ 3.40641988e-03 -5.01973999e-03 7.03655649e-05] [-3.40641988e-03 5.01974000e-03 7.03655380e-05] [-6.56015882e-03 5.39270453e-05 -4.41063763e-05] [ 6.56015881e-03 -5.39271007e-05 -4.41064360e-05] [-3.60754596e-04 -9.84863720e-03 2.73184259e-03] [ 3.60754594e-04 9.84863721e-03 2.73184260e-03] [-9.71851640e-04 5.22412883e-03 8.54345556e-04] [ 9.71851644e-04 -5.22412883e-03 8.54345562e-04] [-2.03655011e-03 -4.05236878e-03 -2.37410139e-03] [ 2.03655013e-03 4.05236877e-03 -2.37410142e-03] [-4.12590138e-03 -1.21012364e-03 -1.01226509e-02] [ 4.12590138e-03 1.21012365e-03 -1.01226509e-02] [-3.29945605e-03 -2.91100670e-03 1.97701154e-03] [ 3.29945607e-03 2.91100669e-03 1.97701154e-03] [ 1.57241428e-03 5.71422931e-03 -3.11200993e-04] [-1.57241427e-03 -5.71422931e-03 -3.11200975e-04] [ 1.03491897e-02 7.70409183e-03 -5.92524196e-03] [-1.03491897e-02 -7.70409183e-03 -5.92524198e-03] [-8.90974085e-03 -6.11165916e-03 -7.36579521e-04] [ 8.90974086e-03 6.11165920e-03 -7.36579542e-04] [ 4.17947705e-03 -2.07358861e-03 5.08926663e-03] [-4.17947704e-03 2.07358862e-03 5.08926667e-03] [ 4.28957408e-04 5.54834537e-04 7.93053586e-03] [-4.28957406e-04 -5.54834529e-04 7.93053585e-03] [ 5.50373506e-03 -7.12612008e-03 4.30393768e-03] [-5.50373504e-03 7.12612009e-03 4.30393768e-03] [-2.33380516e-03 7.11241305e-03 -5.34052634e-03] [ 2.33380516e-03 -7.11241307e-03 -5.34052635e-03] [-6.49938547e-03 -3.63144757e-04 4.55698283e-04] [ 6.49938547e-03 3.63144729e-04 4.55698285e-04] [-2.36803467e-03 1.25357054e-03 -6.31210136e-03] [ 2.36803469e-03 -1.25357055e-03 -6.31210136e-03] [ 1.00652191e-03 7.25665854e-03 -6.43663442e-06] [-1.00652193e-03 -7.25665856e-03 -6.43663679e-06] [-2.64657566e-03 -2.73183738e-03 4.16853107e-03] [ 2.64657565e-03 2.73183740e-03 4.16853109e-03] [ 2.65726114e-03 4.74553630e-03 -2.43501352e-03] [-2.65726113e-03 -4.74553627e-03 -2.43501352e-03] [ 2.14026370e-03 -4.85389858e-03 -3.65916872e-03] [-2.14026370e-03 4.85389857e-03 -3.65916871e-03] [ 6.33290373e-03 -9.64862759e-03 5.46108956e-03] [-6.33290374e-03 9.64862758e-03 5.46108954e-03] [ 4.26788005e-05 2.24021857e-03 3.68883747e-03] [-4.26788119e-05 -2.24021856e-03 3.68883747e-03] [ 5.11893475e-03 3.53847102e-03 -1.87023599e-03] [-5.11893475e-03 -3.53847100e-03 -1.87023599e-03] [ 5.07830501e-04 1.97416760e-03 2.82979917e-03] [-5.07830505e-04 -1.97416759e-03 2.82979917e-03] [-3.21961057e-03 -1.77614149e-03 5.57085358e-03] [ 3.21961057e-03 1.77614150e-03 5.57085359e-03] [ 1.33355989e-02 5.19526258e-03 -9.91363518e-04] [-1.33355989e-02 -5.19526262e-03 -9.91363513e-04] [-3.49397329e-03 1.72925429e-03 -1.17172455e-02] [ 3.49397325e-03 -1.72925429e-03 -1.17172455e-02] [ 8.92133031e-03 -2.93492501e-03 1.25998162e-03] [-8.92133031e-03 2.93492502e-03 1.25998162e-03] [ 1.12163419e-03 2.23980471e-03 1.76551239e-03] [-1.12163419e-03 -2.23980472e-03 1.76551240e-03] [ 7.99338575e-04 1.97785431e-03 1.04839429e-02] [-7.99338600e-04 -1.97785432e-03 1.04839429e-02] [-2.27673288e-03 2.03945629e-03 -1.08874779e-02] [ 2.27673288e-03 -2.03945629e-03 -1.08874779e-02] [ 1.59697244e-03 3.76914691e-03 4.78356827e-03] [-1.59697245e-03 -3.76914690e-03 4.78356825e-03] [ 5.20464334e-03 1.55026510e-03 -7.03601516e-03] [-5.20464333e-03 -1.55026508e-03 -7.03601514e-03] [ 2.08596554e-02 -1.03029584e-03 2.33100293e-03] [-2.08596554e-02 1.03029582e-03 2.33100294e-03] [-1.25745894e-02 -8.77630448e-03 9.77365852e-03] [ 1.25745894e-02 8.77630447e-03 9.77365852e-03] [ 5.61388034e-03 2.01122519e-03 -3.23415494e-03] [-5.61388036e-03 -2.01122519e-03 -3.23415496e-03] [-3.28812118e-03 -6.37386647e-04 2.22815528e-03] [ 3.28812120e-03 6.37386644e-04 2.22815530e-03] [-2.03992538e-03 -8.04818744e-04 1.26544089e-03] [ 2.03992539e-03 8.04818726e-04 1.26544092e-03] [-6.67257499e-04 1.46306087e-03 -1.39287733e-03] [ 6.67257477e-04 -1.46306088e-03 -1.39287732e-03] [ 6.24882917e-04 -4.09089117e-03 1.97751668e-03] [-6.24882901e-04 4.09089118e-03 1.97751669e-03] [-8.02131796e-03 3.03202538e-03 -1.08669879e-03] [ 8.02131799e-03 -3.03202534e-03 -1.08669875e-03] [-7.32445807e-04 -4.13720614e-03 1.09987400e-03] [ 7.32445818e-04 4.13720616e-03 1.09987402e-03] [ 2.64952479e-03 -2.33379309e-03 9.78411246e-04] [-2.64952479e-03 2.33379310e-03 9.78411243e-04] [-9.38997084e-03 4.23029035e-03 -4.53541475e-04] [ 9.38997085e-03 -4.23029036e-03 -4.53541483e-04] [ 6.40653474e-03 4.73903635e-03 -2.09507756e-03] [-6.40653473e-03 -4.73903641e-03 -2.09507756e-03] [-1.53441192e-03 3.20736077e-03 2.99621214e-03] [ 1.53441190e-03 -3.20736075e-03 2.99621215e-03] [-5.39835796e-03 -8.81097349e-03 3.50968317e-03] [ 5.39835796e-03 8.81097351e-03 3.50968316e-03] [-6.28462992e-03 1.87060300e-03 -5.45043519e-03] [ 6.28462993e-03 -1.87060298e-03 -5.45043519e-03] [ 3.03384052e-03 4.07109463e-03 -4.46154482e-03] [-3.03384052e-03 -4.07109463e-03 -4.46154481e-03]] Final stress: [-8.58940763e-05 3.38512297e-05 -1.39488520e-04 2.02337134e-15 2.92737494e-14 -1.50374309e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-9.02576060e-04 -8.06922707e-04 -1.07026929e-03] [ 9.02576056e-04 8.06922734e-04 -1.07026929e-03] [-1.25085209e-03 -7.41680796e-04 9.67913798e-04] [ 1.25085209e-03 7.41680789e-04 9.67913800e-04] [-1.08282741e-03 -1.94053592e-03 3.49638247e-04] [ 1.08282741e-03 1.94053592e-03 3.49638248e-04] [ 3.01168744e-03 1.97680824e-05 3.85064146e-04] [-3.01168744e-03 -1.97680600e-05 3.85064167e-04] [ 1.51350094e-04 -4.62084866e-03 1.20349069e-03] [-1.51350095e-04 4.62084866e-03 1.20349069e-03] [-8.59190096e-05 2.30115791e-03 1.11009694e-04] [ 8.59190075e-05 -2.30115791e-03 1.11009684e-04] [ 1.53654249e-03 -1.69943910e-03 -1.19038544e-03] [-1.53654248e-03 1.69943910e-03 -1.19038544e-03] [ 1.68059498e-03 -9.94007483e-04 -4.53696887e-03] [-1.68059498e-03 9.94007468e-04 -4.53696887e-03] [ 8.91910394e-04 -9.37426802e-04 8.24671086e-04] [-8.91910396e-04 9.37426792e-04 8.24671075e-04] [-5.40349800e-04 2.59837009e-03 -1.53597534e-04] [ 5.40349800e-04 -2.59837008e-03 -1.53597533e-04] [-4.50103785e-03 3.59469750e-03 -2.45424641e-03] [ 4.50103785e-03 -3.59469749e-03 -2.45424641e-03] [ 4.00405043e-03 -2.32781997e-03 1.95370484e-04] [-4.00405043e-03 2.32781998e-03 1.95370477e-04] [-1.60186685e-03 -9.01769957e-04 1.76589747e-03] [ 1.60186686e-03 9.01769947e-04 1.76589746e-03] [ 1.23172695e-04 6.74957631e-04 3.87133427e-03] [-1.23172697e-04 -6.74957622e-04 3.87133427e-03] [-1.89184735e-03 -3.55122463e-03 2.03856743e-03] [ 1.89184735e-03 3.55122463e-03 2.03856743e-03] [ 5.41949701e-04 3.30388826e-03 -2.22706548e-03] [-5.41949701e-04 -3.30388827e-03 -2.22706547e-03] [ 2.86816954e-03 6.09551706e-04 -8.95707776e-06] [-2.86816954e-03 -6.09551721e-04 -8.95707160e-06] [ 1.24316430e-03 -2.51870257e-03 1.65030879e-04] [-1.24316430e-03 2.51870257e-03 1.65030880e-04] [-5.64052601e-04 -3.05592901e-04 -2.86624336e-03] [ 5.64052603e-04 3.05592896e-04 -2.86624336e-03] [ 1.22547350e-03 -1.63979029e-03 -2.10854445e-03] [-1.22547350e-03 1.63979029e-03 -2.10854445e-03] [-1.16900062e-03 1.32797435e-03 1.99061530e-03] [ 1.16900062e-03 -1.32797435e-03 1.99061530e-03] [ 3.07972502e-03 4.34194037e-03 2.24945370e-03] [-3.07972502e-03 -4.34194037e-03 2.24945370e-03] [ 9.81029430e-04 1.71578460e-03 -2.22123492e-03] [-9.81029427e-04 -1.71578461e-03 -2.22123491e-03] [ 2.05273037e-03 -2.20626215e-03 -1.20511107e-03] [-2.05273037e-03 2.20626216e-03 -1.20511107e-03] [-3.84630863e-04 -1.38449804e-03 1.69185804e-03] [ 3.84630873e-04 1.38449805e-03 1.69185804e-03] [-1.24197102e-03 9.86633997e-04 2.62875199e-03] [ 1.24197102e-03 -9.86633993e-04 2.62875199e-03] [ 8.72843716e-04 -4.05722080e-04 1.07027878e-03] [-8.72843713e-04 4.05722074e-04 1.07027877e-03] [-3.92930888e-04 -2.50872470e-04 -4.61540541e-03] [ 3.92930880e-04 2.50872470e-04 -4.61540540e-03] [ 5.87332622e-03 -1.91491387e-03 -8.04111654e-04] [-5.87332620e-03 1.91491389e-03 -8.04111650e-04] [ 2.61251729e-04 -1.33379107e-03 1.12765084e-03] [-2.61251732e-04 1.33379108e-03 1.12765084e-03] [ 4.10335841e-03 9.50918798e-04 4.88413759e-04] [-4.10335842e-03 -9.50918801e-04 4.88413760e-04] [-1.15070515e-03 -1.01642757e-03 -4.87701278e-03] [ 1.15070517e-03 1.01642758e-03 -4.87701277e-03] [ 4.36011313e-04 -6.86389224e-04 5.73230581e-03] [-4.36011311e-04 6.86389226e-04 5.73230580e-03] [ 1.89546227e-03 -2.47649621e-04 -2.81094104e-03] [-1.89546227e-03 2.47649624e-04 -2.81094103e-03] [ 6.46924389e-04 -1.35833214e-03 1.30391041e-03] [-6.46924391e-04 1.35833215e-03 1.30391040e-03] [-4.96258021e-03 3.89309791e-03 4.48971637e-03] [ 4.96258022e-03 -3.89309790e-03 4.48971637e-03] [ 9.84758715e-03 7.97940111e-04 8.24232786e-04] [-9.84758715e-03 -7.97940105e-04 8.24232786e-04] [-1.34362426e-03 4.39588551e-04 1.64779944e-03] [ 1.34362427e-03 -4.39588547e-04 1.64779945e-03] [ 2.09551540e-03 -7.41792970e-04 -1.68592017e-03] [-2.09551540e-03 7.41792970e-04 -1.68592018e-03] [ 2.11588119e-04 -7.82158610e-04 3.88283570e-04] [-2.11588125e-04 7.82158612e-04 3.88283560e-04] [ 6.02839606e-04 3.86669407e-04 -3.54937095e-04] [-6.02839603e-04 -3.86669412e-04 -3.54937089e-04] [ 3.64661796e-04 -1.95642163e-03 9.70334352e-04] [-3.64661803e-04 1.95642163e-03 9.70334350e-04] [ 3.63048785e-03 1.24242745e-03 -3.26158741e-04] [-3.63048785e-03 -1.24242746e-03 -3.26158753e-04] [-2.58344685e-04 -4.90800807e-04 5.24141305e-04] [ 2.58344670e-04 4.90800779e-04 5.24141302e-04] [-1.65514159e-03 -6.22348068e-04 2.38587929e-04] [ 1.65514158e-03 6.22348069e-04 2.38587926e-04] [ 3.77355299e-03 1.81565471e-03 -4.80611480e-04] [-3.77355299e-03 -1.81565472e-03 -4.80611489e-04] [-2.47634996e-03 1.16171462e-03 -9.37948420e-04] [ 2.47634996e-03 -1.16171462e-03 -9.37948420e-04] [-2.43935259e-03 4.13930722e-03 1.57694732e-03] [ 2.43935260e-03 -4.13930723e-03 1.57694732e-03] [-5.26230796e-04 -4.60747454e-04 1.47277019e-03] [ 5.26230788e-04 4.60747448e-04 1.47277019e-03] [ 1.45641357e-03 -7.87679988e-04 -2.40823242e-03] [-1.45641357e-03 7.87679991e-04 -2.40823241e-03] [-2.79867647e-03 -2.92884081e-04 -2.95013696e-03] [ 2.79867647e-03 2.92884075e-04 -2.95013697e-03]] Final stress: [-3.34966079e-05 -1.59108242e-06 -7.61111821e-05 -1.78123606e-14 5.68647421e-15 7.48821544e-05] Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 5.62246264e-05 -8.68527443e-04 -4.56935269e-04] [-5.62246258e-05 8.68527446e-04 -4.56935271e-04] [ 6.50630435e-04 -5.99576492e-04 1.65592479e-04] [-6.50630434e-04 5.99576489e-04 1.65592476e-04] [ 1.71881902e-04 1.66361888e-04 6.58596955e-04] [-1.71881902e-04 -1.66361888e-04 6.58596957e-04] [-8.03526303e-04 1.14938113e-03 1.06918906e-04] [ 8.03526304e-04 -1.14938113e-03 1.06918907e-04] [ 4.57981389e-05 -3.46678546e-04 5.39768146e-04] [-4.57981388e-05 3.46678549e-04 5.39768146e-04] [ 1.29442974e-04 1.75682412e-04 -1.10286642e-03] [-1.29442974e-04 -1.75682411e-04 -1.10286642e-03] [-3.82654951e-04 1.35848361e-04 2.90112486e-04] [ 3.82654951e-04 -1.35848360e-04 2.90112489e-04] [-8.48040326e-04 7.64986011e-04 2.17026070e-03] [ 8.48040328e-04 -7.64986010e-04 2.17026070e-03] [-5.50342375e-04 -8.01379332e-04 8.19038464e-04] [ 5.50342377e-04 8.01379331e-04 8.19038463e-04] [ 3.93538949e-04 -3.11559644e-04 -4.23304544e-04] [-3.93538948e-04 3.11559642e-04 -4.23304544e-04] [ 1.35564098e-03 3.32111347e-04 -4.40889759e-04] [-1.35564098e-03 -3.32111347e-04 -4.40889759e-04] [-1.08893640e-03 -8.56827151e-04 -2.11509164e-04] [ 1.08893640e-03 8.56827151e-04 -2.11509163e-04] [ 4.49092354e-04 -1.32724049e-03 7.23292336e-04] [-4.49092356e-04 1.32724048e-03 7.23292332e-04] [ 1.38871551e-04 -2.62340531e-04 -2.37359679e-03] [-1.38871551e-04 2.62340532e-04 -2.37359679e-03] [ 7.02134701e-04 -1.60575537e-04 1.05308649e-03] [-7.02134699e-04 1.60575535e-04 1.05308649e-03] [-1.20026016e-04 -6.55275571e-04 -6.62543197e-04] [ 1.20026012e-04 6.55275571e-04 -6.62543197e-04] [-9.96262958e-04 7.01561011e-04 -5.81030841e-05] [ 9.96262956e-04 -7.01561016e-04 -5.81030856e-05] [-2.11377705e-04 5.25922597e-04 -4.17424734e-04] [ 2.11377703e-04 -5.25922595e-04 -4.17424735e-04] [ 4.59089271e-04 2.65340622e-04 3.21796053e-04] [-4.59089268e-04 -2.65340618e-04 3.21796054e-04] [-5.72365308e-04 -5.39351493e-05 3.77080369e-04] [ 5.72365303e-04 5.39351523e-05 3.77080373e-04] [ 4.89421818e-04 1.98888446e-04 -7.92047414e-04] [-4.89421822e-04 -1.98888449e-04 -7.92047412e-04] [-1.08818176e-04 -1.63176180e-03 -8.34230702e-04] [ 1.08818176e-04 1.63176180e-03 -8.34230704e-04] [ 5.56922395e-04 -3.44848032e-04 9.32206844e-04] [-5.56922396e-04 3.44848033e-04 9.32206846e-04] [-6.26414739e-04 -1.65888787e-04 5.84769141e-04] [ 6.26414744e-04 1.65888788e-04 5.84769138e-04] [ 2.01408153e-04 8.87525754e-04 -3.18130668e-04] [-2.01408155e-04 -8.87525752e-04 -3.18130668e-04] [ 3.49723786e-04 8.07657631e-05 8.75502367e-05] [-3.49723787e-04 -8.07657632e-05 8.75502386e-05] [-6.59985398e-04 -4.10274432e-04 1.80032183e-05] [ 6.59985400e-04 4.10274430e-04 1.80032174e-05] [ 1.28221051e-03 9.07166901e-04 9.83070527e-04] [-1.28221051e-03 -9.07166903e-04 9.83070527e-04] [-1.06506819e-03 -4.56245960e-04 -2.09842260e-04] [ 1.06506819e-03 4.56245960e-04 -2.09842260e-04] [ 6.68449358e-04 -2.71053823e-04 -2.27106860e-04] [-6.68449357e-04 2.71053824e-04 -2.27106862e-04] [-6.12070257e-04 1.23167445e-04 5.70167142e-04] [ 6.12070258e-04 -1.23167445e-04 5.70167142e-04] [-1.25963070e-04 2.46308159e-05 2.29045995e-03] [ 1.25963074e-04 -2.46308133e-05 2.29045996e-03] [-8.01727981e-04 2.80770585e-04 -7.27500654e-04] [ 8.01727982e-04 -2.80770586e-04 -7.27500655e-04] [ 5.48440282e-04 9.26796641e-04 1.47327596e-03] [-5.48440281e-04 -9.26796641e-04 1.47327596e-03] [ 8.06219130e-04 3.33019125e-06 -4.54256539e-04] [-8.06219132e-04 -3.33019182e-06 -4.54256539e-04] [ 2.58873433e-03 -1.35034059e-03 -1.17884337e-03] [-2.58873434e-03 1.35034059e-03 -1.17884337e-03] [-2.12423473e-03 -3.41170386e-04 1.49278099e-04] [ 2.12423472e-03 3.41170385e-04 1.49278100e-04] [ 9.19400967e-04 5.77283908e-04 -1.54031452e-03] [-9.19400966e-04 -5.77283908e-04 -1.54031452e-03] [-4.75791085e-04 -4.18337625e-04 -8.40254040e-04] [ 4.75791084e-04 4.18337625e-04 -8.40254039e-04] [-4.35998488e-04 7.88498953e-04 -5.39966671e-04] [ 4.35998491e-04 -7.88498952e-04 -5.39966668e-04] [-1.41300071e-05 1.63120307e-03 4.09536452e-04] [ 1.41300069e-05 -1.63120307e-03 4.09536451e-04] [ 1.21148513e-04 5.98433834e-04 -1.43927134e-04] [-1.21148515e-04 -5.98433832e-04 -1.43927133e-04] [-8.07809190e-04 -1.26761150e-04 7.21352039e-05] [ 8.07809189e-04 1.26761150e-04 7.21352052e-05] [ 2.52796868e-04 7.25710736e-04 -5.36062247e-05] [-2.52796872e-04 -7.25710737e-04 -5.36062248e-05] [ 4.21295865e-04 -1.24321098e-03 -1.57964543e-05] [-4.21295865e-04 1.24321098e-03 -1.57964535e-05] [-9.82671057e-04 3.85961583e-04 -4.91561669e-04] [ 9.82671058e-04 -3.85961583e-04 -4.91561668e-04] [ 6.76250862e-04 1.26039813e-04 1.19832057e-04] [-6.76250853e-04 -1.26039813e-04 1.19832059e-04] [ 3.21323764e-04 1.35313004e-04 -2.63717807e-04] [-3.21323762e-04 -1.35313006e-04 -2.63717807e-04] [-3.80084126e-05 -1.02751200e-03 1.11158398e-04] [ 3.80084107e-05 1.02751200e-03 1.11158398e-04] [-1.86307667e-04 4.68273722e-04 -4.07565804e-04] [ 1.86307668e-04 -4.68273719e-04 -4.07565804e-04] [ 8.51802077e-04 2.18529058e-04 1.58855131e-04] [-8.51802075e-04 -2.18529057e-04 1.58855131e-04]] Final stress: [ 6.75528845e-06 1.46452405e-05 -1.84795014e-05 -1.93604017e-15 2.20373955e-15 -1.84886377e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-2.43502424e-04 4.94341038e-04 -3.26199035e-04] [ 2.43502428e-04 -4.94341060e-04 -3.26199029e-04] [-7.62911876e-04 -1.23455506e-03 1.09148496e-04] [ 7.62911879e-04 1.23455506e-03 1.09148495e-04] [-3.71715922e-04 2.41566824e-04 6.38227706e-04] [ 3.71715920e-04 -2.41566826e-04 6.38227707e-04] [ 1.17262302e-03 1.26072520e-03 5.82219544e-04] [-1.17262303e-03 -1.26072520e-03 5.82219549e-04] [ 6.10577110e-05 -4.74607703e-04 6.16458807e-04] [-6.10577138e-05 4.74607705e-04 6.16458807e-04] [-1.05981110e-04 9.28733815e-05 -1.03457386e-03] [ 1.05981110e-04 -9.28733806e-05 -1.03457386e-03] [ 8.46383690e-04 1.17252882e-04 7.72976551e-04] [-8.46383693e-04 -1.17252886e-04 7.72976549e-04] [ 1.38454242e-03 4.14669240e-05 2.83610396e-03] [-1.38454242e-03 -4.14669188e-05 2.83610397e-03] [ 3.98835097e-04 -1.06955301e-03 1.12117486e-03] [-3.98835097e-04 1.06955301e-03 1.12117485e-03] [-6.35250185e-04 -1.37196075e-04 -7.79785454e-04] [ 6.35250186e-04 1.37196069e-04 -7.79785457e-04] [-2.12311127e-03 6.79640383e-04 -4.91368220e-04] [ 2.12311127e-03 -6.79640381e-04 -4.91368219e-04] [ 1.69146867e-03 1.61529149e-04 3.20223592e-05] [-1.69146867e-03 -1.61529161e-04 3.20223570e-05] [-7.69986435e-04 -1.48245968e-03 9.83205544e-04] [ 7.69986435e-04 1.48245968e-03 9.83205550e-04] [ 6.75640123e-05 -2.70523933e-04 -2.97744403e-03] [-6.75640096e-05 2.70523939e-04 -2.97744403e-03] [-1.05771489e-03 -4.67339091e-04 1.56237651e-03] [ 1.05771489e-03 4.67339091e-04 1.56237650e-03] [-2.99977482e-05 -8.46012029e-04 -8.22025650e-04] [ 2.99977508e-05 8.46012030e-04 -8.22025652e-04] [ 1.18998454e-03 8.29781378e-04 -3.70925737e-04] [-1.18998455e-03 -8.29781376e-04 -3.70925732e-04] [ 6.78460339e-04 -5.85579603e-04 4.91811687e-04] [-6.78460342e-04 5.85579603e-04 4.91811684e-04] [-3.94254422e-04 -6.54730403e-04 -3.29910569e-04] [ 3.94254423e-04 6.54730405e-04 -3.29910570e-04] [ 5.87163482e-04 -2.05737887e-05 -1.53649649e-03] [-5.87163483e-04 2.05737870e-05 -1.53649649e-03] [-7.73150971e-04 -1.64949203e-04 5.20018189e-04] [ 7.73150971e-04 1.64949205e-04 5.20018188e-04] [ 8.93727042e-04 4.92403885e-04 1.13704208e-03] [-8.93727041e-04 -4.92403885e-04 1.13704208e-03] [ 6.96181506e-05 2.10337313e-03 -1.25065758e-03] [-6.96181533e-05 -2.10337313e-03 -1.25065758e-03] [ 3.62794106e-04 -9.66086676e-04 3.74264481e-04] [-3.62794110e-04 9.66086671e-04 3.74264485e-04] [-6.30481722e-04 -1.44758099e-04 7.80690410e-04] [ 6.30481727e-04 1.44758098e-04 7.80690408e-04] [-8.79416540e-04 5.12181939e-04 -2.24939369e-04] [ 8.79416540e-04 -5.12181937e-04 -2.24939371e-04] [ 5.77418430e-04 -3.08845010e-04 6.93062133e-05] [-5.77418428e-04 3.08845010e-04 6.93062164e-05] [-1.07149612e-03 3.52967621e-04 -4.60811714e-04] [ 1.07149612e-03 -3.52967624e-04 -4.60811713e-04] [ 1.10807975e-03 -5.81415972e-04 9.76538034e-04] [-1.10807975e-03 5.81415969e-04 9.76538033e-04] [-6.75198775e-04 -1.88811674e-04 9.31771141e-04] [ 6.75198770e-04 1.88811674e-04 9.31771141e-04] [ 1.09919421e-03 3.53785959e-04 -2.95118542e-04] [-1.09919421e-03 -3.53785954e-04 -2.95118540e-04] [-9.28616993e-04 -1.28606923e-04 -1.46956486e-03] [ 9.28616992e-04 1.28606924e-04 -1.46956486e-03] [ 7.44155692e-05 -6.02215179e-04 2.77828347e-03] [-7.44155665e-05 6.02215177e-04 2.77828347e-03] [ 1.33536878e-03 7.35752340e-05 -9.15081141e-04] [-1.33536878e-03 -7.35752335e-05 -9.15081143e-04] [ 2.97433919e-04 -1.26235171e-03 1.64929171e-03] [-2.97433924e-04 1.26235171e-03 1.64929171e-03] [-2.44452481e-03 1.77540247e-04 2.49968562e-05] [ 2.44452482e-03 -1.77540252e-04 2.49968579e-05] [ 3.18705370e-03 1.23114976e-03 -1.04413284e-03] [-3.18705370e-03 -1.23114976e-03 -1.04413284e-03] [-1.09126203e-03 3.88283853e-04 -8.04257897e-04] [ 1.09126203e-03 -3.88283854e-04 -8.04257899e-04] [ 1.28933729e-03 -8.68919136e-04 -1.60868657e-03] [-1.28933729e-03 8.68919134e-04 -1.60868657e-03] [-1.06816105e-04 8.48699704e-04 -4.10819808e-04] [ 1.06816102e-04 -8.48699703e-04 -4.10819803e-04] [-6.04980720e-05 2.40174836e-03 4.14625424e-04] [ 6.04980753e-05 -2.40174836e-03 4.14625426e-04] [-8.85360247e-05 7.18831388e-04 -9.26513656e-05] [ 8.85360244e-05 -7.18831387e-04 -9.26513660e-05] [ 7.46790760e-04 1.78689096e-04 -4.60663704e-04] [-7.46790758e-04 -1.78689091e-04 -4.60663697e-04] [-3.71943525e-04 -3.45399078e-04 -1.38035034e-04] [ 3.71943525e-04 3.45399091e-04 -1.38035038e-04] [-5.35776301e-04 -1.83680843e-03 8.85093615e-05] [ 5.35776298e-04 1.83680843e-03 8.85093593e-05] [ 1.47299445e-03 8.15037073e-04 -5.86607752e-04] [-1.47299445e-03 -8.15037073e-04 -5.86607749e-04] [-6.20033318e-04 -8.04134523e-04 1.20739186e-04] [ 6.20033317e-04 8.04134525e-04 1.20739180e-04] [ 2.72672360e-04 1.04029026e-03 9.46359741e-05] [-2.72672365e-04 -1.04029025e-03 9.46359675e-05] [ 4.40558367e-04 -5.19203787e-04 -7.50440643e-04] [-4.40558359e-04 5.19203790e-04 -7.50440642e-04] [ 1.11318279e-03 -7.34603472e-04 -1.01321419e-04] [-1.11318279e-03 7.34603475e-04 -1.01321427e-04] [-3.85462912e-04 -1.50462314e-04 -4.23919268e-04] [ 3.85462913e-04 1.50462313e-04 -4.23919262e-04]] Final stress: [ 4.59195572e-06 1.61559238e-05 -3.04664179e-05 5.80095000e-15 -5.36832867e-15 3.14928089e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.86253448e-04 1.01161963e-04 1.05067201e-06] [-1.86253448e-04 -1.01161964e-04 1.05067204e-06] [ 2.82375163e-04 3.24686813e-04 8.61355195e-05] [-2.82375163e-04 -3.24686812e-04 8.61355186e-05] [ 9.93597260e-05 -2.19348421e-04 -2.39816259e-04] [-9.93597263e-05 2.19348421e-04 -2.39816261e-04] [-3.84113989e-04 -4.66896286e-04 -9.57810943e-06] [ 3.84113988e-04 4.66896287e-04 -9.57810924e-06] [ 5.76541681e-05 2.17417666e-04 -2.02740378e-04] [-5.76541684e-05 -2.17417667e-04 -2.02740376e-04] [ 9.60038806e-05 5.58095753e-05 2.93625052e-04] [-9.60038807e-05 -5.58095749e-05 2.93625051e-04] [-3.28653998e-04 -1.23656736e-05 -3.08807108e-04] [ 3.28653998e-04 1.23656732e-05 -3.08807109e-04] [-5.72757358e-04 -3.11187867e-04 -4.40680366e-04] [ 5.72757358e-04 3.11187867e-04 -4.40680367e-04] [-1.60828606e-05 4.13053885e-04 -3.87185953e-04] [ 1.60828616e-05 -4.13053886e-04 -3.87185953e-04] [ 1.49899956e-04 -3.62532910e-05 2.90883771e-04] [-1.49899956e-04 3.62532904e-05 2.90883770e-04] [ 5.27365165e-04 -2.72714591e-04 9.36425344e-05] [-5.27365165e-04 2.72714591e-04 9.36425338e-05] [-3.99424188e-04 7.35093522e-05 2.23558622e-04] [ 3.99424189e-04 -7.35093549e-05 2.23558623e-04] [ 8.13807167e-05 1.98643367e-04 -1.80600737e-04] [-8.13807171e-05 -1.98643365e-04 -1.80600733e-04] [-1.36096982e-05 2.73201552e-04 6.36222210e-04] [ 1.36096981e-05 -2.73201549e-04 6.36222213e-04] [ 2.97248993e-04 1.31131544e-04 -8.21527053e-05] [-2.97248993e-04 -1.31131545e-04 -8.21527046e-05] [ 1.71883113e-05 2.32232842e-04 1.07156807e-04] [-1.71883108e-05 -2.32232841e-04 1.07156807e-04] [-3.85131592e-04 -2.88383826e-04 -7.95928630e-05] [ 3.85131592e-04 2.88383827e-04 -7.95928635e-05] [-3.81545873e-04 7.81544531e-05 8.33182544e-05] [ 3.81545873e-04 -7.81544540e-05 8.33182549e-05] [ 1.40710826e-04 2.90066910e-04 2.40391534e-04] [-1.40710826e-04 -2.90066911e-04 2.40391533e-04] [-7.70466935e-05 8.80477147e-05 4.33357599e-04] [ 7.70466945e-05 -8.80477163e-05 4.33357598e-04] [ 4.52069843e-05 1.16562157e-05 -1.41960873e-04] [-4.52069847e-05 -1.16562179e-05 -1.41960872e-04] [-1.39613762e-04 -2.66474159e-04 -3.63692123e-04] [ 1.39613762e-04 2.66474158e-04 -3.63692122e-04] [ 1.43315261e-05 -3.80051146e-04 2.66707581e-04] [-1.43315261e-05 3.80051145e-04 2.66707581e-04] [-1.37023990e-04 4.10594579e-04 1.47620404e-04] [ 1.37023991e-04 -4.10594580e-04 1.47620404e-04] [ 1.77973294e-05 -5.09642139e-05 -3.35844565e-04] [-1.77973286e-05 5.09642136e-05 -3.35844566e-04] [ 2.00893866e-04 -2.08672196e-04 -1.70191483e-04] [-2.00893867e-04 2.08672196e-04 -1.70191482e-04] [-2.18182163e-04 -3.30532808e-05 -1.24962638e-04] [ 2.18182163e-04 3.30532823e-05 -1.24962639e-04] [ 2.54153357e-04 -9.45828835e-05 1.06309243e-04] [-2.54153356e-04 9.45828843e-05 1.06309242e-04] [-3.45263768e-04 3.75670340e-05 -2.22657164e-04] [ 3.45263766e-04 -3.75670341e-05 -2.22657163e-04] [ 3.60921952e-04 2.84725523e-04 -1.95326519e-04] [-3.60921951e-04 -2.84725523e-04 -1.95326519e-04] [-2.56030611e-04 -2.38569192e-04 6.93731625e-05] [ 2.56030611e-04 2.38569191e-04 6.93731624e-05] [ 1.22301615e-04 1.11317905e-04 2.64767722e-04] [-1.22301615e-04 -1.11317905e-04 2.64767721e-04] [-1.77260902e-04 3.95697497e-04 -7.26568047e-04] [ 1.77260902e-04 -3.95697497e-04 -7.26568047e-04] [-3.05135408e-04 -1.25284901e-04 2.18023390e-04] [ 3.05135408e-04 1.25284901e-04 2.18023391e-04] [-2.06544632e-04 2.36150621e-04 -3.28384567e-04] [ 2.06544631e-04 -2.36150622e-04 -3.28384567e-04] [ 4.67965556e-04 1.82750862e-04 2.43253118e-05] [-4.67965557e-04 -1.82750860e-04 2.43253116e-05] [-6.06658561e-04 -9.77953816e-06 3.03737970e-04] [ 6.06658561e-04 9.77953979e-06 3.03737970e-04] [ 2.00851142e-04 -1.41756927e-04 1.24470649e-04] [-2.00851142e-04 1.41756928e-04 1.24470649e-04] [-2.66918633e-04 2.41673192e-04 4.75132019e-04] [ 2.66918634e-04 -2.41673192e-04 4.75132020e-04] [ 1.78375727e-04 -1.27815437e-04 2.19360164e-05] [-1.78375726e-04 1.27815434e-04 2.19360158e-05] [ 1.79190872e-04 -6.08581681e-04 -7.73133665e-06] [-1.79190872e-04 6.08581682e-04 -7.73133721e-06] [ 7.05636859e-06 -1.46423722e-04 -1.80503214e-04] [-7.05636843e-06 1.46423722e-04 -1.80503215e-04] [-1.20877880e-04 -3.83302126e-05 6.79200347e-05] [ 1.20877881e-04 3.83302121e-05 6.79200343e-05] [-4.91860887e-05 1.99139949e-04 -4.60025448e-05] [ 4.91860883e-05 -1.99139950e-04 -4.60025450e-05] [ 9.92270016e-06 4.72577755e-04 -1.68111619e-04] [-9.92270031e-06 -4.72577755e-04 -1.68111621e-04] [-4.37348156e-04 -2.79752888e-04 2.21467948e-04] [ 4.37348156e-04 2.79752889e-04 2.21467947e-04] [ 5.79745700e-05 2.10313652e-05 7.78862631e-05] [-5.79745700e-05 -2.10313617e-05 7.78862637e-05] [ 7.32347520e-05 -2.18812162e-04 -6.68522135e-05] [-7.32347512e-05 2.18812162e-04 -6.68522138e-05] [-2.47078928e-05 1.30836263e-04 2.75412077e-04] [ 2.47078926e-05 -1.30836263e-04 2.75412077e-04] [-2.95440085e-04 -7.31102995e-06 -1.38074550e-04] [ 2.95440083e-04 7.31102886e-06 -1.38074552e-04] [ 2.86659833e-04 -4.07196714e-05 -6.41443001e-06] [-2.86659832e-04 4.07196709e-05 -6.41442779e-06]] Final stress: [-1.27387846e-05 -1.91108854e-05 -1.34094459e-05 2.35920557e-15 -1.40309389e-15 -6.74741560e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.94289358e-04 7.50147307e-05 1.77527675e-05] [ 1.94289358e-04 -7.50147402e-05 1.77527698e-05] [-2.72975503e-04 3.07227174e-04 8.67847088e-05] [ 2.72975504e-04 -3.07227174e-04 8.67847073e-05] [-1.08740093e-04 -2.18655172e-04 -2.07644086e-04] [ 1.08740093e-04 2.18655173e-04 -2.07644086e-04] [ 3.62538010e-04 -4.32755075e-04 -2.58119506e-07] [-3.62538009e-04 4.32755074e-04 -2.58121099e-07] [-6.27641587e-05 1.99363649e-04 -1.76434515e-04] [ 6.27641585e-05 -1.99363649e-04 -1.76434514e-04] [-8.88036476e-05 4.92563289e-05 2.54553403e-04] [ 8.88036471e-05 -4.92563284e-05 2.54553404e-04] [ 3.31490375e-04 6.18929807e-06 -2.92543347e-04] [-3.31490375e-04 -6.18929887e-06 -2.92543347e-04] [ 5.49161389e-04 -2.70000650e-04 -3.80013148e-04] [-5.49161389e-04 2.70000654e-04 -3.80013147e-04] [-3.46415998e-05 3.80493713e-04 -3.48011681e-04] [ 3.46415997e-05 -3.80493713e-04 -3.48011681e-04] [-8.86261883e-05 -6.61450777e-05 2.57898635e-04] [ 8.86261875e-05 6.61450769e-05 2.57898636e-04] [-4.86643331e-04 -2.70462764e-04 4.94727246e-05] [ 4.86643332e-04 2.70462765e-04 4.94727247e-05] [ 3.86384362e-04 2.88239545e-05 1.84624638e-04] [-3.86384362e-04 -2.88239529e-05 1.84624638e-04] [-5.21929636e-05 1.60174188e-04 -1.40945760e-04] [ 5.21929641e-05 -1.60174188e-04 -1.40945759e-04] [ 3.47678949e-05 2.45344835e-04 5.66396632e-04] [-3.47678952e-05 -2.45344837e-04 5.66396631e-04] [-2.61502822e-04 1.25164996e-04 -7.45478393e-05] [ 2.61502822e-04 -1.25164996e-04 -7.45478395e-05] [-5.24294407e-05 2.31665398e-04 1.00010645e-04] [ 5.24294404e-05 -2.31665396e-04 1.00010645e-04] [ 3.74080051e-04 -2.36659381e-04 -8.19124072e-05] [-3.74080051e-04 2.36659383e-04 -8.19124080e-05] [ 1.50911101e-04 -2.93187418e-04 2.31334307e-04] [-1.50911101e-04 2.93187417e-04 2.31334308e-04] [-3.55382814e-04 -4.44723170e-05 5.32699915e-05] [ 3.55382813e-04 4.44723179e-05 5.32699920e-05] [ 5.26569281e-05 2.30788586e-05 -1.84163660e-04] [-5.26569290e-05 -2.30788579e-05 -1.84163659e-04] [-4.64185016e-05 -3.40326143e-05 4.62094282e-04] [ 4.64185030e-05 3.40326152e-05 4.62094280e-04] [ 2.41827454e-05 3.85311987e-04 2.38228899e-04] [-2.41827457e-05 -3.85311987e-04 2.38228898e-04] [-1.35481328e-04 2.68424027e-04 -3.33848689e-04] [ 1.35481328e-04 -2.68424027e-04 -3.33848689e-04] [ 3.94762004e-05 3.86364264e-05 -3.60455457e-04] [-3.94762021e-05 -3.86364275e-05 -3.60455457e-04] [-7.79485054e-05 -3.92537499e-04 1.73262315e-04] [ 7.79485077e-05 3.92537498e-04 1.73262315e-04] [-1.90908279e-04 4.75479174e-05 -1.00907704e-04] [ 1.90908279e-04 -4.75479175e-05 -1.00907703e-04] [ 1.92272754e-04 1.85091839e-04 -1.88818889e-04] [-1.92272754e-04 -1.85091839e-04 -1.88818889e-04] [-2.79457720e-04 5.44250829e-05 -1.88167613e-04] [ 2.79457720e-04 -5.44250822e-05 -1.88167613e-04] [ 1.33599254e-04 9.89978552e-05 1.03588953e-04] [-1.33599253e-04 -9.89978551e-05 1.03588954e-04] [-2.33956451e-04 2.37387671e-04 5.63288084e-05] [ 2.33956451e-04 -2.37387671e-04 5.63288086e-05] [ 3.71595169e-04 -2.55982316e-04 -1.58197171e-04] [-3.71595170e-04 2.55982316e-04 -1.58197171e-04] [-1.79910923e-04 -3.77327367e-04 -7.11727671e-04] [ 1.79910922e-04 3.77327365e-04 -7.11727673e-04] [ 1.26939675e-04 -9.85216247e-05 2.88104927e-04] [-1.26939675e-04 9.85216231e-05 2.88104929e-04] [-2.09388643e-04 -1.57290388e-04 -2.68403859e-04] [ 2.09388642e-04 1.57290389e-04 -2.68403860e-04] [-2.32856540e-04 1.68175566e-04 2.05400907e-04] [ 2.32856540e-04 -1.68175566e-04 2.05400907e-04] [-5.38783351e-04 -6.81306394e-05 2.23427689e-04] [ 5.38783352e-04 6.81306386e-05 2.23427689e-04] [ 3.50144273e-04 -2.07169472e-04 5.42109294e-05] [-3.50144274e-04 2.07169470e-04 5.42109291e-05] [-2.08391336e-04 -2.35672473e-04 4.34422038e-04] [ 2.08391336e-04 2.35672473e-04 4.34422037e-04] [ 1.81501913e-04 1.40465108e-04 1.08874152e-04] [-1.81501912e-04 -1.40465109e-04 1.08874151e-04] [-2.17762878e-04 -8.46019801e-05 -1.67754768e-05] [ 2.17762878e-04 8.46019810e-05 -1.67754764e-05] [-1.37621901e-04 -5.57032501e-04 -1.64507543e-05] [ 1.37621900e-04 5.57032501e-04 -1.64507526e-05] [ 2.79686032e-05 -1.33168410e-04 -1.97736700e-04] [-2.79686034e-05 1.33168410e-04 -1.97736700e-04] [ 4.06484581e-05 -6.39287131e-05 8.72936137e-05] [-4.06484581e-05 6.39287143e-05 8.72936138e-05] [ 4.20132119e-05 1.91104926e-04 -4.09458460e-05] [-4.20132118e-05 -1.91104917e-04 -4.09458463e-05] [-4.15668564e-05 4.34653343e-04 -1.40914330e-04] [ 4.15668566e-05 -4.34653343e-04 -1.40914330e-04] [ 4.18156491e-04 -2.66605140e-04 2.51517862e-04] [-4.18156491e-04 2.66605139e-04 2.51517862e-04] [-5.10418195e-07 7.32826531e-05 9.21885679e-05] [ 5.10417154e-07 -7.32826558e-05 9.21885679e-05] [-8.80956007e-06 -1.36120696e-04 2.82269538e-04] [ 8.80955890e-06 1.36120697e-04 2.82269537e-04] [ 5.02210203e-05 1.95821615e-04 -9.29053069e-05] [-5.02210191e-05 -1.95821613e-04 -9.29053061e-05] [ 2.95193737e-04 8.98862342e-05 -2.39734956e-05] [-2.95193737e-04 -8.98862348e-05 -2.39734956e-05] [-2.58780189e-04 3.73546277e-05 -1.36608409e-04] [ 2.58780190e-04 -3.73546285e-05 -1.36608407e-04]] Final stress: [-1.29672392e-05 -1.91443083e-05 -1.33929195e-05 -3.96786347e-16 1.08279648e-15 6.72026034e-06] Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 20 steps. Minimization converged after 19 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 116 steps. Minimization converged after 117 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-4.07901069e-04 1.99046179e-03 1.38099951e-03] [ 4.07901071e-04 -1.99046183e-03 1.38099952e-03] [-4.02220958e-04 7.76490109e-04 -1.36565546e-03] [ 4.02220958e-04 -7.76490109e-04 -1.36565546e-03] [ 9.16598806e-04 -1.75742352e-03 1.05374682e-04] [-9.16598806e-04 1.75742352e-03 1.05374684e-04] [-3.10532002e-04 3.94599724e-04 8.29809425e-04] [ 3.10531995e-04 -3.94599712e-04 8.29809440e-04] [ 6.86686561e-04 -7.19287456e-04 -1.39347292e-03] [-6.86686560e-04 7.19287457e-04 -1.39347292e-03] [-5.63477952e-04 4.51070638e-04 -2.11468801e-04] [ 5.63477952e-04 -4.51070637e-04 -2.11468796e-04] [-8.10475061e-04 8.58428527e-04 -5.11872689e-04] [ 8.10475058e-04 -8.58428525e-04 -5.11872697e-04] [-3.59965931e-03 -1.10272290e-03 -2.07943135e-03] [ 3.59965931e-03 1.10272291e-03 -2.07943136e-03] [ 1.56563905e-03 -8.15800035e-05 -4.09126905e-04] [-1.56563906e-03 8.15800037e-05 -4.09126905e-04] [ 1.19369393e-03 -3.07111929e-04 4.92094565e-04] [-1.19369393e-03 3.07111926e-04 4.92094567e-04] [ 2.62863404e-04 7.46072051e-04 2.59062406e-04] [-2.62863408e-04 -7.46072053e-04 2.59062406e-04] [-8.17425330e-04 3.82420742e-03 2.09702240e-04] [ 8.17425333e-04 -3.82420742e-03 2.09702236e-04] [-2.69696501e-04 9.58015669e-05 4.33679914e-04] [ 2.69696501e-04 -9.58015654e-05 4.33679918e-04] [ 4.26946654e-04 -7.05780272e-04 1.71034103e-03] [-4.26946657e-04 7.05780267e-04 1.71034103e-03] [ 4.13684293e-04 -2.00872124e-03 2.63347586e-03] [-4.13684298e-04 2.00872124e-03 2.63347586e-03] [ 9.89468156e-04 1.82884674e-03 -1.87492394e-04] [-9.89468158e-04 -1.82884674e-03 -1.87492393e-04] [ 1.44944488e-03 -1.23705437e-03 6.29210583e-04] [-1.44944488e-03 1.23705438e-03 6.29210585e-04] [-3.01688582e-04 -9.33796388e-04 9.17683421e-04] [ 3.01688581e-04 9.33796391e-04 9.17683420e-04] [-1.23303260e-03 4.85756981e-04 3.85631151e-04] [ 1.23303260e-03 -4.85756984e-04 3.85631150e-04] [ 5.96621745e-04 -1.12932713e-04 -1.14387516e-03] [-5.96621742e-04 1.12932715e-04 -1.14387515e-03] [ 1.57516196e-04 3.06503239e-04 3.20578731e-07] [-1.57516193e-04 -3.06503235e-04 3.20575516e-07] [ 3.54251063e-04 -1.47426709e-03 -3.04697592e-04] [-3.54251064e-04 1.47426709e-03 -3.04697594e-04] [-6.46459451e-04 -1.70919864e-04 -1.35888196e-03] [ 6.46459452e-04 1.70919865e-04 -1.35888196e-03] [ 7.00921271e-04 -6.90684553e-04 -6.11961998e-04] [-7.00921271e-04 6.90684547e-04 -6.11962001e-04] [ 8.45681225e-04 -1.37468404e-03 2.54331141e-03] [-8.45681224e-04 1.37468403e-03 2.54331141e-03] [ 7.26286967e-04 4.18359673e-04 4.28718841e-04] [-7.26286965e-04 -4.18359670e-04 4.28718839e-04] [-6.75590171e-04 5.10667284e-04 -1.16398506e-03] [ 6.75590172e-04 -5.10667285e-04 -1.16398506e-03] [-4.19278340e-04 -2.62855964e-03 -8.90235561e-04] [ 4.19278346e-04 2.62855965e-03 -8.90235562e-04] [ 9.24975399e-04 4.87407123e-04 -9.68626908e-04] [-9.24975402e-04 -4.87407124e-04 -9.68626909e-04] [ 1.07409182e-03 -1.89861139e-04 6.47640447e-04] [-1.07409182e-03 1.89861136e-04 6.47640446e-04] [-7.44638114e-04 -2.02841231e-03 1.89094049e-03] [ 7.44638112e-04 2.02841230e-03 1.89094049e-03] [ 5.60043222e-04 9.05526260e-04 -2.14594939e-03] [-5.60043228e-04 -9.05526268e-04 -2.14594939e-03] [ 2.17931276e-03 -8.26400844e-04 1.23513671e-03] [-2.17931276e-03 8.26400837e-04 1.23513671e-03] [ 1.09424964e-03 4.95008262e-04 -9.72116868e-05] [-1.09424964e-03 -4.95008264e-04 -9.72116906e-05] [-2.53337809e-03 -1.95803780e-03 -1.40563053e-03] [ 2.53337810e-03 1.95803780e-03 -1.40563052e-03] [-7.00085204e-04 -3.07017126e-04 2.87869990e-03] [ 7.00085206e-04 3.07017126e-04 2.87869989e-03] [ 9.17563904e-04 -2.40183471e-03 -1.81149084e-03] [-9.17563906e-04 2.40183471e-03 -1.81149084e-03] [-6.74103577e-04 -1.01668739e-03 2.57337655e-04] [ 6.74103572e-04 1.01668738e-03 2.57337657e-04] [-2.16225235e-03 1.92021828e-04 -1.40535511e-03] [ 2.16225235e-03 -1.92021827e-04 -1.40535512e-03] [ 3.03028466e-03 -6.63863107e-05 3.18013350e-04] [-3.03028466e-03 6.63863143e-05 3.18013344e-04] [ 2.50145952e-03 -1.57519978e-04 6.84050521e-05] [-2.50145952e-03 1.57519982e-04 6.84050508e-05] [-5.20783441e-04 8.88885434e-04 1.32616952e-03] [ 5.20783443e-04 -8.88885430e-04 1.32616953e-03] [ 2.07745382e-03 3.95291790e-04 -1.55728704e-03] [-2.07745382e-03 -3.95291797e-04 -1.55728705e-03] [-8.05366142e-04 -2.30816183e-03 5.06335024e-04] [ 8.05366144e-04 2.30816186e-03 5.06335024e-04] [-2.20177450e-03 -5.07420351e-05 8.22379527e-04] [ 2.20177451e-03 5.07420364e-05 8.22379529e-04] [ 1.40633074e-03 6.33529509e-04 9.53855664e-05] [-1.40633074e-03 -6.33529510e-04 9.53855651e-05] [-3.32079737e-04 -1.93888878e-03 -2.34354147e-04] [ 3.32079736e-04 1.93888877e-03 -2.34354151e-04] [-1.13613920e-03 1.77549558e-03 -7.51603418e-04] [ 1.13613920e-03 -1.77549558e-03 -7.51603432e-04] [ 2.29696103e-03 8.81588231e-04 -1.17379669e-04] [-2.29696103e-03 -8.81588230e-04 -1.17379661e-04] [ 4.03031235e-04 -3.65297058e-04 -1.02748020e-03] [-4.03031234e-04 3.65297060e-04 -1.02748020e-03] [ 4.03942503e-04 1.44662140e-03 1.48667937e-04] [-4.03942502e-04 -1.44662140e-03 1.48667940e-04]] Final stress: [-1.61295073e-05 6.78292483e-06 -9.44533633e-05 -1.48770977e-14 -6.85771102e-15 -9.03506950e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 4.63063551e-04 1.58364330e-03 1.37793172e-03] [-4.63063549e-04 -1.58364326e-03 1.37793171e-03] [ 4.33067086e-04 9.18902226e-04 -1.41814356e-03] [-4.33067087e-04 -9.18902208e-04 -1.41814356e-03] [-9.60107081e-04 -1.87654135e-03 -5.82204583e-05] [ 9.60107081e-04 1.87654136e-03 -5.82204509e-05] [ 3.21342776e-04 5.74139752e-04 8.52964605e-04] [-3.21342771e-04 -5.74139748e-04 8.52964601e-04] [-7.87384356e-04 -7.97812096e-04 -1.53442575e-03] [ 7.87384358e-04 7.97812096e-04 -1.53442575e-03] [ 5.95812981e-04 4.77953364e-04 -2.16453299e-04] [-5.95812979e-04 -4.77953364e-04 -2.16453303e-04] [ 8.67477055e-04 1.05118286e-03 -7.14586692e-04] [-8.67477054e-04 -1.05118287e-03 -7.14586697e-04] [ 4.02974836e-03 -1.01573994e-03 -2.40673680e-03] [-4.02974835e-03 1.01573993e-03 -2.40673681e-03] [-1.59818020e-03 -9.64012886e-05 -4.79678038e-04] [ 1.59818020e-03 9.64012880e-05 -4.79678038e-04] [-1.50712536e-03 -5.25625730e-04 6.45263438e-04] [ 1.50712535e-03 5.25625732e-04 6.45263438e-04] [-2.86996969e-04 9.11237268e-04 3.94554525e-04] [ 2.86996972e-04 -9.11237269e-04 3.94554519e-04] [ 8.27330777e-04 3.55235262e-03 1.24744727e-04] [-8.27330776e-04 -3.55235272e-03 1.24744750e-04] [ 2.96404623e-04 -2.94684935e-06 1.43376587e-04] [-2.96404619e-04 2.94686247e-06 1.43376620e-04] [-5.25197270e-04 -5.73036609e-04 1.94951786e-03] [ 5.25197270e-04 5.73036635e-04 1.94951789e-03] [-5.43109850e-04 -2.13617097e-03 2.80150933e-03] [ 5.43109852e-04 2.13617097e-03 2.80150933e-03] [-9.99182086e-04 1.98418167e-03 -2.38399354e-04] [ 9.99182082e-04 -1.98418167e-03 -2.38399364e-04] [-1.63432271e-03 -1.29156581e-03 7.07710912e-04] [ 1.63432272e-03 1.29156581e-03 7.07710909e-04] [-1.31826047e-03 -5.50211069e-04 3.86406822e-04] [ 1.31826047e-03 5.50211066e-04 3.86406823e-04] [-3.54991296e-04 9.63289159e-04 1.03522878e-03] [ 3.54991298e-04 -9.63289160e-04 1.03522877e-03] [ 2.27509618e-04 -5.83801727e-04 1.85447491e-04] [-2.27509605e-04 5.83801703e-04 1.85447475e-04] [ 8.25374079e-04 1.56713801e-04 -1.30908930e-03] [-8.25374092e-04 -1.56713823e-04 -1.30908928e-03] [-6.62504714e-04 1.52268987e-04 -1.46477874e-03] [ 6.62504713e-04 -1.52268989e-04 -1.46477874e-03] [ 4.95136401e-04 1.67651839e-03 -2.88682439e-04] [-4.95136402e-04 -1.67651839e-03 -2.88682434e-04] [ 9.24690085e-04 1.42770512e-03 2.72153034e-03] [-9.24690076e-04 -1.42770513e-03 2.72153035e-03] [ 7.92913290e-04 9.20055907e-04 -9.31498018e-04] [-7.92913302e-04 -9.20055915e-04 -9.31498025e-04] [-7.80201388e-04 -4.93824138e-04 -1.31809407e-03] [ 7.80201386e-04 4.93824143e-04 -1.31809407e-03] [ 8.15641768e-04 -5.31122224e-04 5.59990601e-04] [-8.15641765e-04 5.31122224e-04 5.59990595e-04] [ 9.85476296e-04 -3.83097035e-04 -9.91475879e-04] [-9.85476293e-04 3.83097020e-04 -9.91475877e-04] [-2.03782938e-04 2.64265108e-03 -9.04943178e-04] [ 2.03782936e-04 -2.64265110e-03 -9.04943180e-04] [-7.77723144e-04 2.33087455e-03 2.09136557e-03] [ 7.77723145e-04 -2.33087455e-03 2.09136557e-03] [ 1.22087408e-03 1.96736333e-04 6.57325064e-04] [-1.22087408e-03 -1.96736332e-04 6.57325066e-04] [ 2.45697527e-03 7.52208960e-04 1.74234701e-03] [-2.45697527e-03 -7.52208952e-04 1.74234702e-03] [ 5.59898665e-04 -8.86522409e-04 -2.28649845e-03] [-5.59898660e-04 8.86522413e-04 -2.28649846e-03] [-2.79311762e-03 1.99855940e-03 -1.75567906e-03] [ 2.79311762e-03 -1.99855940e-03 -1.75567905e-03] [ 1.12579560e-03 -7.00982382e-04 -5.35573079e-05] [-1.12579561e-03 7.00982381e-04 -5.35573081e-05] [ 9.95933987e-04 2.68344074e-03 -1.92273850e-03] [-9.95933988e-04 -2.68344073e-03 -1.92273850e-03] [-6.29671103e-04 4.06066428e-04 3.06537217e-03] [ 6.29671101e-04 -4.06066424e-04 3.06537217e-03] [-2.42698709e-03 -2.21562405e-04 -1.62075443e-03] [ 2.42698709e-03 2.21562405e-04 -1.62075444e-03] [-6.57117456e-04 1.09350509e-03 3.31078962e-04] [ 6.57117453e-04 -1.09350509e-03 3.31078960e-04] [-3.20290077e-03 -4.57300040e-05 4.50903265e-04] [ 3.20290077e-03 4.57299968e-05 4.50903259e-04] [-3.00012493e-03 -2.37662841e-04 7.84118632e-05] [ 3.00012493e-03 2.37662846e-04 7.84118595e-05] [ 4.64795812e-04 1.01412123e-03 1.40080577e-03] [-4.64795813e-04 -1.01412122e-03 1.40080578e-03] [-2.25069001e-03 2.94565406e-04 -1.70718494e-03] [ 2.25069001e-03 -2.94565401e-04 -1.70718494e-03] [ 1.03122726e-03 -2.15362449e-03 5.38777891e-04] [-1.03122727e-03 2.15362447e-03 5.38777892e-04] [ 2.63971921e-03 -5.79411251e-05 9.32515454e-04] [-2.63971921e-03 5.79411240e-05 9.32515460e-04] [-1.58632221e-03 7.10869099e-04 9.64590273e-05] [ 1.58632221e-03 -7.10869100e-04 9.64590237e-05] [ 2.73605713e-04 -1.54387212e-03 -2.30559961e-04] [-2.73605716e-04 1.54387221e-03 -2.30559962e-04] [ 2.49741144e-03 -9.53294695e-04 -5.90433227e-05] [-2.49741144e-03 9.53294688e-04 -5.90433196e-05] [-1.27600997e-03 -2.06876828e-03 -7.28557215e-04] [ 1.27600997e-03 2.06876828e-03 -7.28557216e-04] [ 4.42911312e-04 -1.54200211e-03 3.38034066e-04] [-4.42911309e-04 1.54200212e-03 3.38034038e-04] [ 4.46906687e-04 1.60616602e-04 -9.69795108e-04] [-4.46906692e-04 -1.60616585e-04 -9.69795088e-04]] Final stress: [-1.70146587e-05 8.85394415e-06 -1.00160241e-04 1.60148706e-15 3.67385913e-15 9.82164086e-05] Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 154 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 2.42477796e-04 -3.89366594e-03 -2.19756370e-03] [-4.58052895e-04 -3.04458157e-03 3.92230263e-04] [-1.73423148e-03 -4.60542966e-04 4.47919503e-04] [ 1.82568178e-03 -1.44005463e-03 -7.87540248e-04] [-1.98016733e-03 -4.46680826e-04 -4.62647637e-03] [ 2.23633632e-03 1.18428163e-03 4.16522547e-03] [ 1.74808277e-03 4.42328958e-03 -2.60163736e-03] [-1.68945232e-03 2.41674485e-03 7.50312649e-04] [ 4.40671393e-04 -2.65053847e-03 1.94626302e-03] [-5.04537394e-04 -3.17531904e-03 -1.88529491e-03] [-1.57164689e-03 -6.96266465e-04 3.77197132e-03] [ 1.59174588e-03 -1.62336368e-03 -4.40677074e-03] [ 8.25490434e-04 2.43215276e-03 5.50493437e-04] [-7.89910654e-04 2.50182589e-03 -1.54658178e-03] [ 4.93910698e-03 3.51706040e-04 1.90106836e-03] [-4.97831922e-03 -4.92357606e-04 -3.62911067e-04] [ 6.06550542e-04 -3.76658025e-05 9.17127545e-04] [-8.07652383e-04 -4.32009878e-04 -1.84389531e-03] [-7.11780004e-05 -3.68371471e-03 7.24274498e-04] [ 4.85791683e-05 -2.54519923e-03 4.19241701e-04] [-4.49615182e-03 1.84955005e-03 8.26714623e-04] [ 4.50080352e-03 1.96699381e-03 -9.37796073e-04] [ 2.20744889e-03 -2.72568391e-03 -3.57236553e-04] [-2.17983415e-03 -2.48076768e-03 1.49848819e-03] [-3.75197179e-04 -6.02925527e-03 -1.04777047e-03] [ 2.76943911e-04 -2.44352461e-03 1.63576216e-03] [-1.20843865e-04 -9.67708571e-04 -5.46342280e-03] [ 1.43308156e-04 -6.22174294e-04 3.50670781e-03] [-1.98833457e-03 3.65129681e-03 7.89440096e-03] [ 1.63526332e-03 2.45459377e-03 -4.68974564e-03] [-1.30638152e-03 -2.27926390e-03 1.07072985e-03] [ 1.27652253e-03 -1.43958986e-03 -3.09601998e-03] [ 3.47510730e-03 -2.74449740e-03 -1.14369032e-03] [-3.51826431e-03 -7.44776922e-04 1.06358300e-03] [-3.12685731e-04 6.08501970e-04 -1.76189577e-04] [-1.76153406e-03 5.81924852e-03 7.14938428e-07] [-2.08910272e-03 1.73306561e-03 1.55783269e-03] [ 3.32330120e-03 5.23697265e-03 1.44426400e-03] [ 2.67414569e-03 -2.65887911e-05 1.58874224e-03] [ 3.52009204e-03 3.10459419e-03 7.31551909e-05] [-3.42810794e-03 7.68767817e-04 -7.97491118e-05] [-2.62038689e-03 2.46159391e-03 1.27410960e-03] [ 4.29005166e-03 6.49601229e-04 6.23178824e-03] [ 1.55880962e-03 2.64210096e-03 4.15964867e-03] [-4.13488141e-03 4.10609674e-03 -5.80669130e-03] [-1.40543177e-03 -8.41968122e-04 -3.76768117e-03] [ 4.11860002e-04 -2.47375659e-03 5.16192164e-04] [-3.23859352e-03 -1.74500640e-03 7.70301050e-04] [ 5.72807250e-06 -3.27515455e-03 -1.09409619e-04] [ 3.32070420e-03 -9.91110126e-04 -3.57075363e-04] [-1.12769651e-03 7.08877693e-05 2.04440641e-03] [ 3.57095908e-03 7.12522542e-04 -4.05436924e-03] [-4.08448674e-05 -2.74596897e-04 -3.08680761e-03] [-1.89061453e-03 1.24712939e-03 3.30404573e-03] [-1.57195365e-03 7.62428804e-04 -1.58635377e-03] [ 7.51048148e-03 5.75702878e-04 1.35454158e-03] [ 4.65219982e-04 8.03004067e-04 1.78920479e-03] [-6.92585162e-03 4.06508879e-04 -1.17233862e-03] [ 7.72893435e-04 -2.58544942e-03 3.32837024e-03] [ 7.64569752e-03 -8.70018444e-04 2.15847109e-03] [-6.72439590e-04 -4.73798810e-03 -3.29071680e-03] [-7.65258111e-03 1.23859273e-03 -2.21252966e-03] [ 3.36786864e-04 -3.80488033e-03 -3.98059796e-03] [ 1.05875022e-03 1.29023812e-03 -3.40558568e-03] [-1.35744534e-03 -3.54223009e-03 2.88583652e-03] [-8.21087564e-05 1.14694082e-03 2.17804580e-03] [-1.40646647e-03 -4.57125670e-03 -1.87241407e-03] [-3.62948631e-04 1.52158221e-03 -6.62214821e-04] [ 2.43239836e-03 -4.49367093e-03 2.89636629e-03] [-4.84601653e-04 1.57083297e-03 1.72940239e-03] [-3.53812446e-03 4.08850758e-03 6.01795837e-03] [ 1.03988267e-02 -3.32916770e-04 1.25725205e-03] [ 3.24623040e-03 3.48478028e-03 -6.55520704e-03] [-9.73680379e-03 8.47822939e-04 -1.83943169e-03] [-8.14403401e-04 1.56174031e-04 2.51594872e-03] [ 1.46539270e-03 2.47641296e-03 -8.43012820e-05] [ 1.67802799e-03 2.21548721e-04 -4.06609305e-03] [-2.30677538e-03 2.31584576e-03 -1.49013148e-03] [-1.55368369e-03 -1.03266614e-03 3.10758026e-03] [ 1.64639150e-03 -1.61345081e-03 -2.63227965e-03] [ 4.67578339e-04 4.72668256e-04 -5.11090527e-04] [-4.03307802e-04 -4.31209232e-04 1.77674767e-03] [-2.11728558e-03 3.87566076e-04 -3.41651249e-03] [ 2.12860316e-03 -1.24334342e-04 2.09770181e-03] [ 2.06004210e-03 1.54260096e-03 -3.02044300e-03] [-2.11052596e-03 1.65471391e-03 2.45454627e-03] [-5.74827768e-04 5.39741231e-05 1.90437464e-03] [ 1.22798904e-04 2.77223726e-03 -3.20053882e-03] [-9.97744482e-04 -2.60956901e-03 1.28927075e-04] [ 1.03010397e-03 -1.17332236e-03 -1.45271783e-03] [ 4.18506555e-03 2.09572086e-03 3.51089344e-03] [-4.01149465e-03 2.68193299e-03 -3.49132891e-03] [-2.18365715e-03 9.09864838e-04 -4.57753822e-03] [ 1.85501857e-03 -1.48378449e-03 5.75095860e-03] [ 1.28118737e-05 5.10469471e-03 7.45731220e-03] [ 3.06650021e-04 2.12590812e-03 -2.45946566e-03] [ 2.99907880e-04 3.59602968e-03 -5.17598546e-03] [-5.29179847e-04 3.54546197e-03 4.31577139e-03] [ 1.54228006e-03 -3.68393621e-03 -6.16145885e-04] [-1.69769828e-03 -2.42404556e-03 3.46796391e-03] [-1.46269084e-03 -2.83278103e-03 2.18102649e-04] [ 1.81090600e-03 -3.16892132e-03 -3.54570434e-03]] Final stress: [-2.79849328e-05 2.50730969e-05 -5.63184371e-05 3.04066937e-05 -3.22072186e-07 9.35316423e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-3.92086471e-04 1.02223081e-02 3.14126888e-03] [-6.36077945e-05 1.28369034e-02 -7.06980092e-03] [ 2.47140394e-03 3.72622005e-03 -1.58447085e-03] [-2.20690676e-03 1.79590950e-03 -2.33521777e-04] [ 3.44446501e-03 -2.43189921e-03 1.04857831e-02] [-2.75959484e-03 1.53197464e-03 -1.17382612e-02] [-3.57021585e-03 -3.88760052e-03 6.28161513e-04] [ 3.69436828e-03 -9.36161679e-03 -6.44027157e-03] [-1.00083750e-03 6.37868826e-03 -3.07958321e-03] [ 8.45827781e-04 4.87410305e-03 3.91142963e-03] [ 2.37399953e-03 2.38580527e-03 -1.12742481e-02] [-2.33525510e-03 -1.23113825e-04 9.65834901e-03] [-1.50477380e-03 -4.12903119e-03 -5.23407450e-03] [ 1.58062989e-03 -4.52255546e-03 3.02123921e-03] [-8.76518919e-03 1.19488427e-03 8.09866414e-05] [ 8.63176025e-03 -1.72934338e-03 3.29365939e-03] [-2.03170186e-03 1.01577605e-03 -3.28423035e-03] [ 1.45583048e-03 8.99464177e-04 1.13289228e-03] [ 2.11419829e-03 5.62213521e-03 2.33046743e-03] [-2.19313688e-03 8.37192445e-03 1.27043834e-04] [ 7.78397021e-03 -4.79071751e-03 -3.12870521e-03] [-7.75935043e-03 -4.66567272e-03 2.13424726e-03] [-3.52726375e-03 3.17673796e-03 1.25966643e-03] [ 3.58205328e-03 4.06505818e-03 4.55887364e-04] [ 4.04713537e-04 2.19454687e-03 6.47849778e-03] [-5.91705173e-04 1.12492763e-02 -3.66610332e-03] [ 8.18252114e-05 4.31441799e-04 7.31787111e-03] [-4.76771174e-05 1.61368558e-03 -1.19406709e-02] [ 3.96016528e-03 -2.15519028e-03 -8.68146764e-03] [-4.79839592e-03 -5.99772966e-03 1.31665370e-02] [ 9.83730877e-04 1.45834257e-03 -5.14506290e-03] [-1.02608225e-03 3.73279431e-03 1.48129466e-03] [-4.60103341e-03 -1.61015474e-03 1.00305599e-03] [ 4.55218878e-03 3.02353486e-03 -8.50183489e-04] [-5.39829599e-03 -2.36292702e-03 3.19682272e-03] [ 6.77345031e-03 -8.96469135e-03 1.93879911e-03] [-1.38454590e-03 -1.11226921e-04 -8.46885428e-04] [-2.23586110e-03 -9.69131351e-03 6.08378251e-04] [-6.97292069e-03 -7.46446217e-04 -9.22962352e-05] [-6.59655390e-03 -5.16319584e-03 2.03264890e-03] [ 5.59612795e-03 8.44901132e-04 3.32211958e-03] [ 8.42578028e-03 -6.27566841e-03 8.08874378e-04] [-6.76763852e-03 -8.61276170e-03 -7.60930366e-03] [-1.85660304e-03 1.28554139e-03 -5.50153140e-03] [ 6.79517331e-03 -1.24357632e-03 1.00816382e-02] [ 2.63451005e-03 -6.08761336e-03 8.00322613e-03] [-1.47117567e-04 6.40165494e-03 -1.04036736e-03] [ 6.71797175e-03 1.56204103e-03 -1.92798699e-03] [ 1.39538845e-03 4.70590916e-03 1.81720103e-03] [-6.71976138e-03 3.05841162e-03 2.75637878e-03] [-1.78857257e-03 -3.91372218e-04 -5.65935147e-03] [-2.32824430e-03 -2.44068622e-03 6.18166314e-03] [-1.91767126e-03 -1.20141095e-03 3.80855532e-03] [ 7.38266920e-03 -1.23745664e-03 -7.25965709e-03] [-2.90855246e-04 -8.20148712e-04 4.67480291e-03] [-1.32510368e-02 -5.96406411e-05 -3.00356138e-03] [-2.96163840e-03 -4.75656348e-04 -3.78567657e-03] [ 1.50547094e-02 -7.27827594e-04 3.83152537e-03] [-1.10945697e-03 8.42675969e-03 -6.08845439e-03] [-1.26026862e-02 -1.27370490e-03 -3.21357655e-03] [ 1.16883087e-03 4.41262045e-03 5.70194523e-03] [ 1.27553481e-02 2.61477547e-03 2.54244196e-03] [-3.07833764e-03 6.27235888e-03 4.09355816e-03] [ 6.17433226e-04 -5.19900504e-04 3.29843802e-03] [ 9.87280019e-04 7.33364796e-03 -6.25703461e-03] [ 1.25647615e-03 -1.35003192e-03 -5.83411484e-03] [ 3.32175383e-03 8.74308311e-03 6.58834096e-03] [-5.62550093e-05 -2.67426167e-03 2.80562674e-03] [-8.57907284e-04 9.37187903e-03 -4.85421028e-03] [-1.85985405e-03 -2.95345191e-03 -1.03335955e-03] [ 4.83818867e-03 -6.41049294e-03 -1.28968263e-02] [-1.62604889e-02 -2.79755524e-03 -1.84142168e-03] [-6.23676258e-03 -8.25382939e-03 1.17226029e-02] [ 1.86861982e-02 5.89724418e-04 5.51900325e-04] [ 3.71197431e-03 -1.27534179e-03 -6.62999545e-03] [-4.42049673e-03 -4.76077137e-03 -1.91344316e-03] [-1.85961133e-03 -1.49264419e-03 3.94226204e-03] [ 2.60956404e-03 -4.75152731e-03 -8.64546172e-04] [ 2.94701075e-03 4.35551081e-03 -6.60277095e-03] [-2.72335811e-03 2.98545520e-03 8.41490150e-03] [ 1.54158782e-03 1.97337669e-03 4.50016432e-03] [-1.41135478e-03 5.51090712e-04 -2.15945551e-03] [ 3.92607552e-03 2.03563151e-03 3.95233296e-03] [-3.91042177e-03 1.01248097e-03 -7.03006688e-03] [-4.80788026e-03 -3.36219654e-03 5.25461639e-03] [ 4.68005232e-03 -3.35119898e-03 -6.76510584e-03] [-6.57349355e-04 -9.13907773e-03 -6.56987884e-03] [-5.40843156e-04 -1.67238517e-03 3.19182968e-03] [-8.65535422e-05 1.15089843e-03 -2.54592309e-03] [ 1.87381086e-04 3.84237325e-03 1.94768061e-04] [-6.15283778e-03 -5.63738643e-03 -6.39158061e-03] [ 6.62582790e-03 -4.69643385e-03 6.67525952e-03] [ 4.23862613e-03 2.48048668e-03 1.07418737e-02] [-5.12303372e-03 -3.39264554e-03 -8.26009454e-03] [ 1.05966970e-04 -5.04284913e-03 -8.99930036e-03] [-1.55017090e-03 -6.62325019e-03 1.03338154e-02] [-1.73418397e-04 -8.74891442e-03 1.47691212e-02] [ 1.80416595e-03 -3.27471203e-03 -5.93010604e-03] [-3.51975070e-03 4.04611459e-03 -3.64527543e-04] [ 3.30894498e-03 4.63295026e-03 -4.50619035e-03] [ 3.36840735e-03 6.15634339e-03 -3.64243430e-04] [-2.63304563e-03 2.82527272e-03 4.54672918e-03]] Final stress: [-6.75860951e-05 5.50318002e-05 -8.06757483e-05 -3.21233363e-05 -1.03764866e-06 -1.77300506e-04] Minimization converged after 146 steps. Minimization converged after 34 steps. Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 2.60356366e-03 7.10304147e-04 -6.64412121e-05] [ 1.46746929e-03 -8.93279009e-04 -1.57043131e-04] [ 2.27165487e-03 -2.54761149e-04 7.74784134e-05] [ 6.59671568e-04 2.85779766e-04 -1.57454633e-04] [ 1.29876201e-03 -7.84796355e-04 -3.82638898e-05] [ 2.60255469e-03 5.31644914e-04 -1.13596603e-06] [-1.53381018e-03 -8.80945738e-04 1.28493151e-03] [ 3.00461545e-04 5.48217773e-04 9.78601964e-04] [ 2.53354756e-03 -3.55609365e-05 -6.04353548e-04] [-2.54265940e-04 -2.41787663e-05 -5.32978196e-04] [ 7.25203815e-05 3.37520547e-04 6.96482621e-06] [-2.86602013e-03 -4.95347667e-04 -1.26079608e-04] [-5.30351720e-04 -2.36121605e-04 6.80744875e-05] [ 1.62282287e-03 1.69777924e-04 7.63974538e-05] [-1.99027954e-03 -6.18225629e-04 8.67266164e-05] [ 1.74278817e-03 6.79428009e-04 8.79888941e-05] [-4.93672625e-04 2.10432207e-04 -2.14342678e-04] [-1.20077449e-04 -4.44407418e-05 -6.65339013e-05] [ 1.38250522e-03 1.39002784e-04 -7.35801736e-06] [-2.00614437e-03 -1.33250902e-04 1.00616219e-05] [ 6.66525945e-04 1.12419721e-05 2.19043039e-04] [-1.92621015e-03 -7.98549035e-05 3.59325930e-04] [-4.72059985e-03 8.82581970e-04 4.52677970e-04] [-1.19776975e-03 -8.96642139e-04 4.79725962e-04] [ 3.54947612e-03 7.97159772e-05 -8.03657518e-04] [ 2.17683775e-03 -5.49794446e-04 -1.10659405e-03] [ 3.17518872e-04 1.68054458e-04 -1.35212206e-05] [ 1.29124497e-03 -9.35636884e-05 3.70886088e-05] [ 2.27680668e-03 2.64937311e-04 9.76168538e-04] [-1.14312604e-03 -1.94064410e-06 9.88415686e-04] [ 8.00240878e-04 -6.17246241e-05 -4.23253503e-04] [ 1.31481487e-03 2.07937669e-04 -5.80478112e-04] [-1.21551308e-03 -5.60799248e-05 -2.83782551e-04] [ 9.14393901e-04 2.27511584e-04 -3.04317594e-04] [-1.62034333e-03 5.52981586e-05 -6.96786528e-04] [ 1.64618297e-03 -6.43383340e-04 1.97451357e-04] [ 1.79432687e-05 1.25838578e-03 6.10640138e-04] [-1.00887939e-03 -4.29393172e-04 1.58157661e-03] [-7.01120046e-04 1.94650491e-03 8.22445125e-04] [-6.20323845e-04 1.45775952e-04 -6.01580239e-04] [-5.69481968e-04 -2.96668137e-04 4.42117867e-04] [-7.72941257e-04 -1.78239705e-03 -9.42657387e-04] [-2.12266130e-03 -1.89348593e-03 1.39679311e-03] [-1.88064816e-03 3.84123469e-03 -1.98274493e-03] [-1.46968471e-03 -3.01272437e-03 1.79188889e-03] [-2.25650402e-03 6.04918683e-04 -8.77109203e-04] [-6.26829566e-04 8.31786145e-04 -9.31796772e-04] [-1.07132866e-03 -1.40165485e-03 -4.66378918e-04] [-1.35522690e-03 6.45135680e-04 1.35311959e-03] [-1.77319289e-04 -3.12221709e-04 1.45803410e-03] [ 1.10101116e-03 5.36563021e-05 -1.20530198e-03] [-1.53720802e-03 -1.86527607e-04 5.92216346e-04] [-1.67645050e-03 1.34470887e-04 -1.18923202e-03] [ 1.86343811e-03 2.08854077e-04 6.40196576e-04] [ 1.98124578e-03 -7.08142801e-04 3.35497791e-04] [-2.44289406e-03 -1.48255800e-03 -4.55960308e-04] [-2.60005068e-03 2.82061652e-03 -2.76726488e-04] [ 1.98547957e-03 -3.51558956e-04 -1.15629244e-03] [ 2.90225537e-03 3.71157141e-04 6.74731525e-04] [-6.17268626e-04 1.82758811e-03 -1.13465729e-03] [-3.77864868e-04 -2.87287585e-03 9.41071715e-04] [ 2.56910991e-03 5.34102754e-04 -6.45451614e-04] [-2.72098261e-04 2.55040771e-03 1.29267493e-03] [-8.92343453e-04 1.57710118e-05 -1.59402999e-03] [-5.86139824e-04 -4.30672238e-04 8.30416367e-04] [-4.49595287e-04 -2.19651671e-03 -1.82858326e-03] [-4.97948637e-04 1.59622364e-03 2.00379648e-03] [-1.68099461e-03 -1.82794279e-03 2.06976838e-03] [-2.27463067e-03 1.69044472e-03 -2.18223694e-03] [-7.30950453e-05 -1.42139822e-03 -2.24893777e-03] [ 3.03247688e-03 5.44565666e-04 5.35958915e-04] [-2.37202406e-03 2.32687790e-04 -1.38140263e-03] [-2.15710102e-03 -9.68672151e-04 1.92851990e-03] [ 2.99599100e-03 6.50005337e-04 8.58361687e-05] [ 2.15432497e-03 9.91568051e-04 1.22560236e-03] [ 2.60388245e-04 -5.29212291e-04 -8.64753991e-04] [-3.05556032e-04 5.80760604e-04 1.20244759e-03] [ 3.00631308e-03 -1.09598779e-03 -1.09931182e-03] [ 2.27331542e-04 -3.24465320e-04 9.03439544e-04] [-1.06390195e-05 4.43510541e-04 6.87717960e-04] [ 3.31579050e-03 1.16216968e-04 1.07756367e-04] [-2.89600410e-03 -1.36602020e-04 1.45641822e-04] [-1.15712949e-03 2.63454629e-05 -2.57109404e-04] [-1.45191772e-03 -1.31988249e-04 -3.04124926e-04] [ 3.01709529e-03 7.24314548e-04 -1.06617230e-03] [ 2.28183695e-03 -6.86137813e-04 -1.14945625e-03] [-3.54620653e-03 -1.92134779e-04 -2.22246058e-04] [ 2.24350079e-03 9.63552719e-04 -4.27223637e-04] [-3.77602621e-03 -2.71248443e-04 -2.40246082e-04] [ 6.98982869e-04 1.43835552e-04 -1.40989266e-04] [-1.42664136e-03 1.87168708e-04 9.65568059e-05] [ 1.08000953e-03 -1.82802409e-04 2.11770462e-05] [ 3.34933613e-03 -7.91291806e-04 2.52843938e-04] [ 3.19878952e-05 1.03476725e-03 1.81638122e-04] [-6.22098274e-04 3.18014365e-03 -1.61570636e-03] [ 9.47984387e-04 1.05469557e-03 3.83261573e-04] [ 6.89582426e-04 -1.79424832e-03 -8.85468363e-04] [-5.92457496e-04 -2.71284755e-03 1.16732242e-03] [-1.87871894e-03 2.57403377e-03 2.22472347e-04] [ 3.90743609e-04 1.21175056e-03 8.33460703e-04] [-2.18155041e-04 -4.33009822e-04 -3.01134961e-04] [-1.01613292e-03 -3.60506528e-03 6.53637445e-04]] Final stress: [-4.57551061e-06 3.30157338e-06 -2.80347629e-05 -4.56160017e-07 -2.21507636e-05 -3.18912872e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 1.57339347e-03 9.83179082e-04 -1.77208376e-04] [ 2.80455543e-03 -7.70199922e-04 -7.32872288e-05] [ 7.13189836e-04 -3.06717727e-04 -1.94394352e-04] [ 2.44664496e-03 2.70079221e-04 7.78513890e-05] [ 2.79983365e-03 -5.77947646e-04 -3.91065270e-06] [ 1.39085901e-03 8.70694641e-04 -4.76325795e-05] [ 3.20403671e-04 -5.70284827e-04 1.03340422e-03] [-1.64958773e-03 9.53832414e-04 1.38600384e-03] [-2.75750810e-04 3.10369033e-05 -5.66623975e-04] [ 2.73048988e-03 3.64422279e-05 -6.49128802e-04] [-3.07574762e-03 5.46885478e-04 -1.45596219e-04] [ 7.69506700e-05 -3.63646973e-04 8.42488641e-06] [ 1.74745458e-03 -1.84335573e-04 8.21032640e-05] [-5.68257888e-04 2.59773929e-04 7.14210718e-05] [ 1.86803508e-03 -7.44443420e-04 9.81284263e-05] [-2.13773990e-03 6.71196984e-04 9.75646432e-05] [-1.24933569e-04 3.64025832e-05 -7.07911082e-05] [-5.30475515e-04 -2.29416296e-04 -2.43305377e-04] [-2.15382965e-03 1.45520703e-04 9.84488000e-06] [ 1.48694627e-03 -1.51456603e-04 -1.05649989e-05] [-2.07043826e-03 8.44443543e-05 3.85769631e-04] [ 7.17214386e-04 -4.51430966e-06 2.21741767e-04] [-1.28851664e-03 9.57580583e-04 5.12042759e-04] [-5.07659283e-03 -9.39116300e-04 4.80651492e-04] [ 2.34299328e-03 5.92047377e-04 -1.19462012e-03] [ 3.82520854e-03 -4.31136897e-05 -8.37589760e-04] [ 1.39178539e-03 1.05410339e-04 3.24204442e-05] [ 3.48668403e-04 -1.90831834e-04 -2.59184358e-05] [-1.22450357e-03 4.91914688e-06 1.06074835e-03] [ 2.45331894e-03 -3.09561694e-04 1.04571573e-03] [ 1.42489086e-03 -2.38578849e-04 -6.38119807e-04] [ 8.62258510e-04 6.90306245e-05 -4.56250249e-04] [ 9.83666275e-04 -2.64358425e-04 -3.24212836e-04] [-1.31433754e-03 6.60495282e-05 -2.99585770e-04] [-3.13182602e-05 -1.36354938e-03 6.66559998e-04] [-1.07699625e-03 4.60333989e-04 1.70313356e-03] [-1.75845204e-03 -5.10931923e-05 -7.43360343e-04] [ 1.82814895e-03 6.75580322e-04 2.04048315e-04] [-6.15453776e-04 3.20057508e-04 4.78762088e-04] [-8.42813595e-04 1.92752371e-03 -1.00043881e-03] [-7.60817492e-04 -2.10010266e-03 8.88728139e-04] [-6.70834302e-04 -1.59565458e-04 -6.37436748e-04] [-1.58057335e-03 3.23474379e-03 1.93012702e-03] [-2.41739110e-03 -6.25405902e-04 -9.07704948e-04] [-2.30036908e-03 2.06241649e-03 1.53439628e-03] [-2.02138532e-03 -4.13811587e-03 -2.12620558e-03] [-1.45241098e-03 -6.86424930e-04 1.46483320e-03] [-1.97223152e-04 3.38000133e-04 1.55408400e-03] [-6.68641742e-04 -8.94196763e-04 -9.94076865e-04] [-1.17258262e-03 1.51806470e-03 -4.85891806e-04] [-1.80766185e-03 -1.47430001e-04 -1.27298650e-03] [ 2.03522327e-03 -2.35046264e-04 6.84838835e-04] [ 1.15200552e-03 -6.30768823e-05 -1.29134175e-03] [-1.64620567e-03 2.01768490e-04 6.30119813e-04] [-2.83013899e-03 -3.06202239e-03 -2.98199582e-04] [ 2.13958102e-03 3.79014045e-04 -1.24371203e-03] [ 2.12383651e-03 7.68280963e-04 3.61085872e-04] [-2.63617689e-03 1.59196918e-03 -4.82336158e-04] [-4.09973760e-04 3.09746983e-03 9.96995618e-04] [ 2.76325477e-03 -5.76579410e-04 -6.96832925e-04] [ 3.12066807e-03 -4.03269029e-04 7.22372213e-04] [-6.59940641e-04 -1.95643180e-03 -1.23000919e-03] [-6.28862882e-04 4.65092681e-04 8.78548680e-04] [-4.79957428e-04 2.36949710e-03 -1.97337710e-03] [-2.84497854e-04 -2.75113721e-03 1.38676353e-03] [-9.71055975e-04 -1.48368096e-05 -1.72841998e-03] [-2.45258075e-03 -1.81660423e-03 -2.34851074e-03] [-8.18051498e-05 1.52622087e-03 -2.42108221e-03] [-5.28130672e-04 -1.71531029e-03 2.14901773e-03] [-1.81049581e-03 1.96227355e-03 2.22678968e-03] [-2.32444148e-03 1.04581067e-03 2.07194345e-03] [ 3.24309885e-03 -7.33135697e-04 1.00003961e-04] [ 3.25127198e-03 -6.07609670e-04 5.73529911e-04] [-2.53851794e-03 -2.33727908e-04 -1.48602747e-03] [-3.20492592e-04 -6.19053647e-04 1.29887450e-03] [ 3.23910788e-03 1.17985525e-03 -1.18489871e-03] [ 2.30608511e-03 -1.06469212e-03 1.31332044e-03] [ 2.80321022e-04 5.65444496e-04 -9.25138719e-04] [-1.48623032e-05 -4.87646712e-04 7.53958989e-04] [ 2.35225853e-04 3.47076574e-04 1.00163753e-03] [-3.11596242e-03 1.52387885e-04 1.58729590e-04] [ 3.57197832e-03 -1.28574465e-04 1.14469869e-04] [-1.56078510e-03 1.43880458e-04 -3.31151153e-04] [-1.24949023e-03 -2.10773375e-05 -2.77147495e-04] [ 2.47826758e-03 7.46963332e-04 -1.25364267e-03] [ 3.24411284e-03 -7.90580425e-04 -1.15630584e-03] [ 2.43002199e-03 -1.11923190e-03 -4.80703431e-04] [-3.83140729e-03 2.25680292e-04 -2.43354664e-04] [ 7.52047114e-04 -1.59782415e-04 -1.51990971e-04] [-4.06435347e-03 3.06562930e-04 -2.67127386e-04] [ 1.16626909e-03 2.03573043e-04 1.91841315e-05] [-1.53085291e-03 -2.07834854e-04 1.06075442e-04] [ 4.11884031e-05 -1.10111109e-03 1.98441238e-04] [ 3.62025824e-03 8.15756568e-04 2.81135927e-04] [ 7.28747409e-04 1.95596480e-03 -9.51777262e-04] [-6.37431409e-04 2.91371497e-03 1.26061185e-03] [-6.73024582e-04 -3.42863741e-03 -1.73129684e-03] [ 1.03020882e-03 -1.12635002e-03 4.16300356e-04] [-2.37609886e-04 4.65490925e-04 -3.23735689e-04] [-1.08765329e-03 3.90043325e-03 7.15997580e-04] [-2.03701441e-03 -2.76205423e-03 2.54959911e-04] [ 4.19668526e-04 -1.31160644e-03 9.00746181e-04]] Final stress: [-5.39541501e-06 4.06698010e-06 -2.97966626e-05 5.32211345e-07 -2.45708927e-05 3.43899466e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-1.43725293e-03 8.72715881e-04 -1.51720484e-04] [-2.54648800e-03 -6.96921924e-04 -6.44198706e-05] [-6.46176937e-04 -2.80735792e-04 -1.49393214e-04] [-2.22594991e-03 2.50953229e-04 7.64227724e-05] [-2.55492375e-03 -5.20303082e-04 2.37064238e-07] [-1.28088299e-03 7.63669034e-04 -3.51976037e-05] [-2.96603163e-04 -5.35594629e-04 9.56763649e-04] [ 1.51143619e-03 8.55908531e-04 1.25169421e-03] [ 2.45663362e-04 2.35643161e-05 -5.21882564e-04] [-2.48176388e-03 3.43097133e-05 -5.90576085e-04] [ 2.81492509e-03 4.82386493e-04 -1.21797058e-04] [-6.57967279e-05 -3.30692088e-04 6.09251822e-06] [-1.58880948e-03 -1.64665010e-04 7.21947490e-05] [ 5.31254375e-04 2.28679397e-04 6.43216138e-05] [-1.71336716e-03 -6.61140541e-04 8.51057187e-05] [ 1.95837499e-03 6.02671919e-04 8.36323294e-05] [ 1.24221153e-04 4.62852981e-05 -6.59871721e-05] [ 4.81631559e-04 -2.05836569e-04 -2.07940378e-04] [ 1.97177043e-03 1.28798069e-04 1.29987196e-05] [-1.35517735e-03 -1.34410672e-04 -3.65085426e-06] [ 1.89489104e-03 7.79189702e-05 3.49564011e-04] [-6.54104294e-04 -1.20616011e-05 2.14973663e-04] [ 1.17689737e-03 8.86259573e-04 4.73044236e-04] [ 4.63100744e-03 -8.73155883e-04 4.47111829e-04] [-2.14129848e-03 5.31651882e-04 -1.07378400e-03] [-3.48323455e-03 -8.00459821e-05 -7.83246865e-04] [-1.26722022e-03 8.76536298e-05 3.99391308e-05] [-3.07624130e-04 -1.59443231e-04 -8.72966615e-06] [ 1.12760719e-03 1.80449288e-06 9.69646251e-04] [-2.23044767e-03 -2.54637837e-04 9.58123700e-04] [-1.27464098e-03 -2.01269562e-04 -5.64736289e-04] [-7.74386771e-04 6.06216366e-05 -4.13544276e-04] [-8.94872099e-04 -2.19697229e-04 -2.99133694e-04] [ 1.18767305e-03 5.48713897e-05 -2.79509076e-04] [-1.60210450e-03 6.36908902e-04 1.94232143e-04] [ 1.58885796e-03 -5.44920753e-05 -6.86059331e-04] [ 9.94641589e-04 4.20594816e-04 1.55016998e-03] [-3.02808367e-05 -1.23477932e-03 5.96025908e-04] [ 6.02651444e-04 -1.40253236e-04 -5.96209406e-04] [ 6.82004839e-04 -1.90720236e-03 8.18231669e-04] [ 7.47506189e-04 1.74340927e-03 -9.41821445e-04] [ 5.56954091e-04 2.90687602e-04 4.35204112e-04] [ 1.84441223e-03 -3.76470257e-03 -1.94964586e-03] [ 2.07538043e-03 1.85049683e-03 1.36123600e-03] [ 2.21241636e-03 -5.98292094e-04 -8.68013230e-04] [ 1.44141729e-03 2.95463197e-03 1.75963471e-03] [ 1.03619417e-03 1.37558875e-03 -4.57753307e-04] [ 6.15422397e-04 -8.20705796e-04 -9.20715503e-04] [ 1.71731051e-04 3.08716043e-04 1.44006289e-03] [ 1.32081281e-03 -6.36001426e-04 1.32344314e-03] [ 1.50846139e-03 1.82640113e-04 5.83513925e-04] [-1.08741266e-03 -4.93955860e-05 -1.18338226e-03] [-1.82017192e-03 -2.04612410e-04 6.31025445e-04] [ 1.64186858e-03 -1.30827561e-04 -1.16684245e-03] [ 2.37655400e-03 1.44888376e-03 -4.51370686e-04] [-1.95198263e-03 6.92882533e-04 3.31692985e-04] [-1.95068040e-03 3.39603877e-04 -1.13340579e-03] [ 2.52202536e-03 -2.74890475e-03 -2.65489793e-04] [ 6.03349462e-04 -1.79238571e-03 -1.11346360e-03] [-2.84575089e-03 -3.63683313e-04 6.61055533e-04] [-2.51866844e-03 -5.23540793e-04 -6.30327492e-04] [ 3.66598415e-04 2.81461630e-03 9.29904975e-04] [ 8.70904257e-04 -1.72878949e-05 -1.55792558e-03] [ 2.75006917e-04 -2.49992093e-03 1.27854419e-03] [ 4.44670309e-04 2.15251555e-03 -1.80293574e-03] [ 5.77191669e-04 4.23673808e-04 8.14514257e-04] [ 1.64838485e-03 1.79380838e-03 2.02956745e-03] [ 4.94334334e-04 -1.56192378e-03 1.96493776e-03] [ 7.92770183e-05 1.39078369e-03 -2.20016436e-03] [ 2.22576056e-03 -1.65849507e-03 -2.13668369e-03] [ 2.32988931e-03 -2.38006838e-04 -1.35692944e-03] [-2.97337643e-03 -5.34165545e-04 5.30411100e-04] [-2.92796461e-03 -6.18936721e-04 7.54758001e-05] [ 2.11296767e-03 9.49809114e-04 1.89126898e-03] [-2.54097781e-04 5.20833759e-04 -8.52382630e-04] [-2.11891698e-03 -9.70678962e-04 1.19949914e-03] [-2.94745343e-03 1.07209443e-03 -1.07736009e-03] [ 2.99514195e-04 -5.71415497e-04 1.17755826e-03] [ 1.46189116e-05 -4.27684135e-04 6.67044808e-04] [-2.39622841e-04 3.13464025e-04 8.74799308e-04] [ 2.83910750e-03 1.32752861e-04 1.42526169e-04] [-3.24872628e-03 -1.13165429e-04 1.06168797e-04] [ 1.42131361e-03 1.29623275e-04 -2.97814474e-04] [ 1.13502522e-03 -2.82273159e-05 -2.52548976e-04] [-2.22441627e-03 6.65985661e-04 -1.11888018e-03] [-2.94840144e-03 -7.02898394e-04 -1.03900228e-03] [-2.18874218e-03 -9.28268317e-04 -4.14430562e-04] [ 3.46573456e-03 1.86701769e-04 -2.17331777e-04] [-6.82248579e-04 -1.39473964e-04 -1.38611557e-04] [ 3.70220021e-03 2.62124481e-04 -2.34125488e-04] [-1.05303433e-03 1.76580823e-04 2.16192352e-05] [ 1.40240882e-03 -1.80883593e-04 9.42052070e-05] [-2.15228325e-05 -1.02001979e-03 1.77540485e-04] [-3.26911031e-03 7.86406259e-04 2.46010120e-04] [-9.27996308e-04 -1.03722009e-03 3.78098796e-04] [ 6.04673303e-04 -3.11542385e-03 -1.58355002e-03] [ 5.79440467e-04 2.66258366e-03 1.14750956e-03] [-6.83035174e-04 1.75194701e-03 -8.65615146e-04] [-3.87494760e-04 -1.19128728e-03 8.10938930e-04] [ 1.83342832e-03 -2.52508114e-03 2.10449472e-04] [ 9.95177945e-04 3.52772488e-03 6.30880355e-04] [ 2.06591058e-04 4.31057483e-04 -3.00826472e-04]] Final stress: [-4.40170606e-06 3.12881063e-06 -2.75907000e-05 4.37544915e-07 2.15545355e-05 -3.12011200e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-2.46835348e-03 6.88157006e-04 -5.87413232e-05] [-1.39209248e-03 -8.53059370e-04 -1.41299526e-04] [-2.15933033e-03 -2.45296905e-04 7.51410280e-05] [-6.25767741e-04 2.72902514e-04 -1.37235485e-04] [-1.23683792e-03 -7.30529066e-04 -3.25471598e-05] [-2.47310437e-03 5.01460096e-04 6.11360329e-07] [ 1.46180189e-03 -8.36104266e-04 1.22446488e-03] [-2.78528706e-04 5.34239267e-04 9.46266256e-04] [-2.41430909e-03 -3.50134802e-05 -5.76128748e-04] [ 2.43039441e-04 -1.99054651e-05 -5.11556343e-04] [-6.86040268e-05 3.19022619e-04 7.35328084e-06] [ 2.72829274e-03 -4.61231196e-04 -1.12994247e-04] [ 5.10964806e-04 -2.22469153e-04 6.50445432e-05] [-1.54557275e-03 1.61615118e-04 7.20635020e-05] [ 1.89256835e-03 -5.92008536e-04 7.94925745e-05] [-1.66080640e-03 6.46000913e-04 8.11512233e-05] [ 4.62577289e-04 1.98654251e-04 -1.96482298e-04] [ 1.16658524e-04 -4.90349194e-05 -6.36465616e-05] [-1.31603637e-03 1.33771773e-04 -4.79684189e-06] [ 1.89743400e-03 -1.28102536e-04 1.08627544e-05] [-6.28471139e-04 1.47520206e-05 2.15618651e-04] [ 1.82859513e-03 -7.66917910e-05 3.41665613e-04] [ 4.47228944e-03 8.47392180e-04 4.34657081e-04] [ 1.12766716e-03 -8.58927175e-04 4.59018866e-04] [-3.36361643e-03 1.01016328e-04 -7.78585651e-04] [-2.07112933e-03 -5.23483853e-04 -1.04904470e-03] [-3.03485620e-04 1.56439019e-04 -4.43647447e-06] [-1.22824152e-03 -8.84816055e-05 4.13643146e-05] [-2.16182418e-03 2.36125852e-04 9.32090481e-04] [ 1.07474077e-03 1.71531588e-06 9.42686132e-04] [-7.76520990e-04 -5.64230467e-05 -4.01934949e-04] [-1.25498275e-03 1.88328616e-04 -5.44223312e-04] [ 1.15588028e-03 -5.16754429e-05 -2.73659884e-04] [-8.68426783e-04 2.06900099e-04 -2.91771179e-04] [ 9.68263203e-04 -4.04983270e-04 1.49443134e-03] [-4.56485267e-05 1.18596803e-03 5.82300605e-04] [-1.53136097e-03 -6.14781107e-04 1.84940308e-04] [ 1.53495055e-03 5.16922836e-05 -6.58116919e-04] [ 7.28467523e-04 -1.68962248e-03 -9.02786448e-04] [ 5.40590770e-04 -2.81626120e-04 4.17556564e-04] [ 5.88772966e-04 1.33929064e-04 -5.81033591e-04] [ 6.62550016e-04 1.85117742e-03 7.74090893e-04] [ 2.14798622e-03 5.86318928e-04 -8.50725781e-04] [ 1.39597892e-03 -2.86330771e-03 1.70027185e-03] [ 1.78745496e-03 3.64249266e-03 -1.88794016e-03] [ 2.00557725e-03 -1.78115802e-03 1.30564301e-03] [ 1.68723579e-04 -2.94405370e-04 1.38362608e-03] [ 1.29704266e-03 6.14466054e-04 1.27709106e-03] [ 1.01625623e-03 -1.32723001e-03 -4.42885769e-04] [ 5.99487782e-04 7.93459543e-04 -8.74562386e-04] [-1.76086603e-03 1.94268014e-04 6.01811466e-04] [ 1.58830026e-03 1.22431925e-04 -1.12249817e-03] [ 1.46389306e-03 -1.72429443e-04 5.55857942e-04] [-1.07331232e-03 4.58820927e-05 -1.13948015e-03] [-1.87920420e-03 -3.36850294e-04 -1.10239590e-03] [ 2.46073429e-03 2.66407597e-03 -2.59954818e-04] [ 2.32979418e-03 -1.40944440e-03 -4.40914105e-04] [-1.88550621e-03 -6.66444181e-04 3.21830766e-04] [-2.43830477e-03 5.00231484e-04 -6.09647288e-04] [ 3.64336097e-04 -2.72178595e-03 9.02648826e-04] [ 5.96994842e-04 1.73804372e-03 -1.07154548e-03] [-2.75638217e-03 3.56623709e-04 6.41917610e-04] [ 4.30476851e-04 -2.09099461e-03 -1.73666345e-03] [ 5.55797670e-04 -4.07171647e-04 7.98489496e-04] [ 8.42514982e-04 9.82866053e-06 -1.51247103e-03] [ 2.61463185e-04 2.43192024e-03 1.22879870e-03] [ 5.35191405e-05 -1.34287588e-03 -2.13004290e-03] [ 2.16515628e-03 1.60037043e-03 -2.06757028e-03] [ 1.60117344e-03 -1.73318758e-03 1.96071227e-03] [ 4.65018959e-04 1.50933381e-03 1.90145221e-03] [-2.83060579e-03 6.05873102e-04 8.00405804e-05] [ 2.04261694e-03 -9.16257023e-04 1.83488113e-03] [ 2.26139885e-03 2.30494162e-04 -1.31261915e-03] [-2.88748505e-03 4.95771927e-04 5.09028209e-04] [-2.84914402e-03 -1.03735400e-03 -1.03559486e-03] [ 2.90515515e-04 5.53269864e-04 1.14112320e-03] [-2.55201333e-04 -5.01910748e-04 -8.25082739e-04] [-2.04545003e-03 9.38479289e-04 1.16088254e-03] [-2.17148650e-04 -3.09594570e-04 8.42148735e-04] [ 1.89511127e-05 4.15751199e-04 6.45956478e-04] [-3.15291806e-03 1.09822956e-04 1.02523801e-04] [ 2.75618012e-03 -1.28140343e-04 1.36574247e-04] [ 1.10056566e-03 2.78740926e-05 -2.42150912e-04] [ 1.37154802e-03 -1.23225127e-04 -2.85042250e-04] [-2.86339987e-03 6.82859845e-04 -1.00984766e-03] [-2.16056166e-03 -6.47931479e-04 -1.08458403e-03] [ 3.36585278e-03 -1.82882070e-04 -2.09040879e-04] [-2.12809388e-03 8.80400350e-04 -3.94402784e-04] [ 3.59263561e-03 -2.50151154e-04 -2.23130650e-04] [-6.70330779e-04 1.34562738e-04 -1.33520053e-04] [ 1.35207241e-03 1.75790868e-04 9.00011276e-05] [-1.02448623e-03 -1.71306682e-04 2.16551104e-05] [-3.17788491e-03 -7.75950023e-04 2.34821955e-04] [-3.18008734e-05 9.94086427e-04 1.70648377e-04] [ 5.65635616e-04 -2.57816718e-03 1.10073280e-03] [-6.62195112e-04 -1.69661762e-03 -8.46534358e-04] [-8.92909339e-04 1.01800560e-03 3.60603504e-04] [ 5.89985925e-04 3.01024526e-03 -1.53942317e-03] [ 9.79060032e-04 -3.40844892e-03 6.21787700e-04] [ 2.13094994e-04 -4.15041102e-04 -2.90023119e-04] [-3.64042323e-04 1.14994088e-03 7.91822135e-04] [ 1.78638626e-03 2.44547836e-03 1.93060778e-04]] Final stress: [-4.09550462e-06 2.85226926e-06 -2.68977178e-05 -4.10102778e-07 2.06171514e-05 3.03362156e-05] Minimization converged after 120 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-4.13211134e-04 -3.44982617e-04 -8.92618716e-05] [ 4.13211132e-04 3.44982615e-04 -8.92618697e-05] [-5.38816926e-04 3.95632294e-04 1.42330112e-04] [ 5.38816925e-04 -3.95632293e-04 1.42330111e-04] [-8.77947978e-04 -2.37370031e-05 -5.59604074e-06] [ 8.77947979e-04 2.37370031e-05 -5.59603882e-06] [ 1.86330378e-03 6.33515214e-04 -9.47263971e-04] [-1.86330378e-03 -6.33515210e-04 -9.47263970e-04] [ 6.30322458e-04 2.66949246e-05 2.98754365e-04] [-6.30322459e-04 -2.66949218e-05 2.98754364e-04] [-3.68176413e-04 5.44716036e-05 -2.42988678e-04] [ 3.68176412e-04 -5.44716030e-05 -2.42988675e-04] [ 7.00967660e-05 7.28879897e-06 -2.17272349e-04] [-7.00967657e-05 -7.28880111e-06 -2.17272348e-04] [ 1.46319228e-03 5.80383478e-04 3.59007843e-04] [-1.46319228e-03 -5.80383481e-04 3.59007846e-04] [-3.65078426e-04 -1.41062784e-05 5.81774505e-06] [ 3.65078426e-04 1.41062776e-05 5.81774443e-06] [ 8.59310799e-04 -2.40401808e-04 1.68357841e-04] [-8.59310797e-04 2.40401809e-04 1.68357841e-04] [-1.13861371e-03 -1.33701511e-05 -1.20081650e-04] [ 1.13861371e-03 1.33701516e-05 -1.20081649e-04] [ 1.15674351e-03 -1.91482770e-03 -4.39985184e-04] [-1.15674351e-03 1.91482768e-03 -4.39985182e-04] [ 6.18638630e-04 -6.03793527e-04 3.18151539e-04] [-6.18638629e-04 6.03793530e-04 3.18151542e-04] [ 3.57612756e-04 3.47599002e-05 -5.61868687e-04] [-3.57612757e-04 -3.47598912e-05 -5.61868688e-04] [-1.19304233e-03 1.21463767e-04 1.89859385e-04] [ 1.19304233e-03 -1.21463765e-04 1.89859386e-04] [-1.87897185e-04 -1.86484806e-05 -2.31744414e-04] [ 1.87897185e-04 1.86484788e-05 -2.31744415e-04] [ 1.03699128e-03 -1.25800199e-04 1.64341867e-04] [-1.03699128e-03 1.25800199e-04 1.64341866e-04] [ 6.52483549e-04 -1.02129044e-03 2.06638185e-04] [-6.52483548e-04 1.02129044e-03 2.06638185e-04] [-7.75631337e-04 -9.49404720e-04 -1.98001605e-04] [ 7.75631338e-04 9.49404721e-04 -1.98001601e-04] [-9.94941459e-05 -1.85131289e-04 -4.33358084e-04] [ 9.94941476e-05 1.85131285e-04 -4.33358090e-04] [ 8.14173261e-05 7.01543298e-04 1.40134283e-03] [-8.14173243e-05 -7.01543301e-04 1.40134283e-03] [ 6.32567158e-04 4.96552000e-04 9.76999231e-04] [-6.32567157e-04 -4.96551999e-04 9.76999230e-04] [-6.31296155e-04 9.86164928e-04 -1.08904469e-03] [ 6.31296155e-04 -9.86164929e-04 -1.08904469e-03] [ 2.09978810e-03 -1.12236929e-03 -1.16858488e-03] [-2.09978810e-03 1.12236929e-03 -1.16858488e-03] [-1.71810656e-03 -8.02098037e-04 5.25544037e-04] [ 1.71810656e-03 8.02098034e-04 5.25544034e-04] [ 2.05862354e-04 6.33017607e-04 9.56563176e-04] [-2.05862353e-04 -6.33017606e-04 9.56563177e-04] [-4.14695862e-04 4.23693901e-04 -9.75167697e-04] [ 4.14695861e-04 -4.23693901e-04 -9.75167697e-04] [-7.77395974e-04 9.32802434e-04 -2.38724871e-04] [ 7.77395972e-04 -9.32802433e-04 -2.38724872e-04] [ 6.38404105e-04 7.77452797e-05 5.94077108e-04] [-6.38404101e-04 -7.77452787e-05 5.94077111e-04] [-1.01568912e-03 -3.57583873e-04 -1.52317236e-04] [ 1.01568912e-03 3.57583872e-04 -1.52317236e-04] [ 1.00538814e-03 -5.00611458e-04 2.87139581e-04] [-1.00538815e-03 5.00611457e-04 2.87139581e-04] [ 4.69332005e-05 -1.88731765e-04 -2.51418647e-03] [-4.69332044e-05 1.88731763e-04 -2.51418647e-03] [-4.65042054e-04 7.06750104e-05 2.73215868e-03] [ 4.65042051e-04 -7.06750099e-05 2.73215868e-03] [-4.15970990e-05 2.18243337e-04 4.86577070e-04] [ 4.15971032e-05 -2.18243338e-04 4.86577070e-04] [ 5.17170932e-04 3.78425701e-04 -3.04916130e-05] [-5.17170931e-04 -3.78425699e-04 -3.04916119e-05] [-1.27489589e-03 -9.36385438e-04 4.27079738e-04] [ 1.27489588e-03 9.36385442e-04 4.27079738e-04] [ 1.09480510e-03 -7.06221919e-04 -7.89927947e-04] [-1.09480511e-03 7.06221916e-04 -7.89927949e-04] [ 4.92726998e-04 -2.17764082e-05 6.19509571e-04] [-4.92726996e-04 2.17764078e-05 6.19509574e-04] [ 1.15647197e-04 -1.69877840e-04 -1.34870891e-03] [-1.15647199e-04 1.69877840e-04 -1.34870891e-03] [-1.19118087e-03 3.82950655e-04 -3.14912998e-04] [ 1.19118087e-03 -3.82950656e-04 -3.14912998e-04] [ 1.38942522e-03 -4.60457405e-06 7.13307874e-05] [-1.38942522e-03 4.60457612e-06 7.13307868e-05] [-2.63847986e-04 1.68119615e-04 -3.07568008e-04] [ 2.63847985e-04 -1.68119618e-04 -3.07568010e-04] [ 5.18484686e-04 -5.45905007e-04 5.53042524e-04] [-5.18484688e-04 5.45905003e-04 5.53042520e-04] [-2.39219130e-03 -5.87685735e-05 -1.76192846e-05] [ 2.39219130e-03 5.87685780e-05 -1.76192843e-05] [-1.40569222e-03 -1.12503374e-04 -7.37296938e-05] [ 1.40569222e-03 1.12503374e-04 -7.37296922e-05] [ 1.76865345e-03 -2.55550491e-04 1.24237054e-04] [-1.76865345e-03 2.55550491e-04 1.24237055e-04] [-6.86983478e-04 1.86036995e-03 1.24002967e-04] [ 6.86983474e-04 -1.86036994e-03 1.24002966e-04] [-7.49592537e-04 5.19496617e-04 6.04522716e-04] [ 7.49592539e-04 -5.19496619e-04 6.04522715e-04] [ 9.97779540e-04 4.71339248e-04 1.25684091e-04] [-9.97779537e-04 -4.71339245e-04 1.25684090e-04] [ 1.24919802e-03 1.30534484e-03 5.94929040e-04] [-1.24919802e-03 -1.30534483e-03 5.94929035e-04] [-7.41265926e-04 6.57575197e-04 -5.49592251e-04] [ 7.41265925e-04 -6.57575196e-04 -5.49592248e-04]] Final stress: [-7.98429830e-06 4.56671095e-06 -1.20005193e-05 -2.72963824e-15 -2.36871409e-15 2.28314894e-05] Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90412 0.54231 0.43125 0. 0. 0. ] [ 0.54231 0.91053 0.49799 -0. 0. -0. ] [ 0.43125 0.49799 0.77681 -0. 0. -0. ] [ 0. -0. -0. 0.24759 -0.00001 0. ] [ 0. 0. 0. -0.00001 0.20614 0. ] [ 0. -0. -0. 0. 0. 0.19934]] 95%% Error estimate [ASE units]: [[0.00001 0. 0. 0. 0. 0. ] [0. 0.00001 0. 0. 0. 0.00916] [0. 0. 0. 0. 0. 0. ] [0. 0. 0. 0. 0.00003 0. ] [0. 0. 0. 0.00003 0. 0. ] [0. 0.00916 0. 0. 0. 6.54959]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 3.274796 is too big compared to maximum elastic constant component 0.910533 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.000006 Unable to compute elastic constants with method energy-condensed, escalating to method stress-condensed Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 111 steps. Minimization converged after 110 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 111 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-9.31199503e-04 -6.13958237e-04 -1.87752611e-04] [ 9.31199500e-04 6.13958236e-04 -1.87752614e-04] [-1.26081919e-03 2.44751101e-04 9.49397967e-06] [ 1.26081919e-03 -2.44751101e-04 9.49398198e-06] [-1.62704169e-03 -3.15864558e-04 1.53679894e-04] [ 1.62704169e-03 3.15864555e-04 1.53679896e-04] [ 2.68841254e-03 -8.55558083e-04 8.14064489e-04] [-2.68841254e-03 8.55558091e-04 8.14064496e-04] [ 1.00260234e-03 -5.01842833e-05 -1.26125972e-04] [-1.00260234e-03 5.01842743e-05 -1.26125968e-04] [-1.49981716e-04 3.53945819e-04 -1.25853190e-04] [ 1.49981717e-04 -3.53945819e-04 -1.25853189e-04] [ 7.41313623e-05 5.25742870e-05 7.61097169e-04] [-7.41313617e-05 -5.25742888e-05 7.61097159e-04] [ 3.08346455e-03 8.90430050e-04 1.05969898e-03] [-3.08346456e-03 -8.90430050e-04 1.05969898e-03] [ 1.18538301e-04 1.27488376e-05 1.33150129e-04] [-1.18538300e-04 -1.27488419e-05 1.33150126e-04] [ 6.68595717e-04 -2.60520263e-04 -3.87434576e-04] [-6.68595717e-04 2.60520264e-04 -3.87434575e-04] [-2.57925371e-03 1.71743165e-04 2.87225795e-04] [ 2.57925371e-03 -1.71743168e-04 2.87225789e-04] [ 7.17132278e-04 2.47154495e-04 -5.54690068e-05] [-7.17132274e-04 -2.47154490e-04 -5.54690084e-05] [ 3.44830066e-04 7.37320894e-04 -1.36400268e-03] [-3.44830067e-04 -7.37320871e-04 -1.36400265e-03] [ 5.80032793e-04 -9.12924669e-04 -1.42428634e-03] [-5.80032792e-04 9.12924664e-04 -1.42428632e-03] [-2.02480510e-03 2.85121754e-04 3.87735613e-04] [ 2.02480510e-03 -2.85121752e-04 3.87735613e-04] [ 5.81122613e-04 -1.80441575e-04 -3.77949407e-04] [-5.81122614e-04 1.80441575e-04 -3.77949410e-04] [ 1.87509666e-03 -3.46559243e-04 -1.81864121e-05] [-1.87509666e-03 3.46559242e-04 -1.81864104e-05] [ 1.06912792e-03 -1.79985225e-03 2.50531187e-04] [-1.06912792e-03 1.79985225e-03 2.50531190e-04] [-1.74924080e-03 -1.99508177e-03 4.82923207e-04] [ 1.74924080e-03 1.99508176e-03 4.82923205e-04] [-5.50120540e-04 3.30164898e-04 -1.80811780e-03] [ 5.50120542e-04 -3.30164897e-04 -1.80811780e-03] [ 5.25396082e-04 6.18320275e-04 2.49825913e-03] [-5.25396084e-04 -6.18320272e-04 2.49825913e-03] [ 6.74851314e-04 7.28733467e-04 2.04604660e-03] [-6.74851311e-04 -7.28733464e-04 2.04604660e-03] [-8.81621015e-04 1.49952041e-03 -1.94107806e-03] [ 8.81621016e-04 -1.49952041e-03 -1.94107806e-03] [ 1.73926227e-03 -1.14363515e-03 -1.86167122e-03] [-1.73926227e-03 1.14363516e-03 -1.86167122e-03] [-1.83291298e-03 -1.33920695e-03 1.82577036e-03] [ 1.83291299e-03 1.33920695e-03 1.82577037e-03] [ 6.18459962e-05 1.02859007e-03 8.02329564e-04] [-6.18459974e-05 -1.02859007e-03 8.02329564e-04] [-6.12562106e-04 1.28447905e-03 -1.51518272e-03] [ 6.12562108e-04 -1.28447905e-03 -1.51518272e-03] [-2.32460997e-03 1.28931906e-03 -7.61274002e-04] [ 2.32460998e-03 -1.28931906e-03 -7.61274004e-04] [ 1.61825741e-04 2.94713929e-03 9.57416021e-05] [-1.61825748e-04 -2.94713928e-03 9.57416047e-05] [-2.06728906e-03 -3.73310743e-04 2.77739429e-04] [ 2.06728906e-03 3.73310744e-04 2.77739427e-04] [ 1.86968966e-03 -7.53487909e-04 -4.79322519e-04] [-1.86968966e-03 7.53487908e-04 -4.79322518e-04] [-1.66564818e-03 -1.05309121e-03 -3.41052081e-03] [ 1.66564817e-03 1.05309121e-03 -3.41052082e-03] [ 1.70827035e-03 -1.04486742e-03 2.79944075e-03] [-1.70827035e-03 1.04486742e-03 2.79944075e-03] [ 3.02947993e-04 -3.52455878e-04 -4.25412497e-04] [-3.02948000e-04 3.52455881e-04 -4.25412490e-04] [ 7.86361940e-05 1.64578653e-04 6.91250281e-04] [-7.86361922e-05 -1.64578651e-04 6.91250275e-04] [-2.73073511e-03 -8.22971076e-04 1.30021892e-03] [ 2.73073511e-03 8.22971081e-04 1.30021892e-03] [ 1.45575468e-03 -1.73832709e-03 -1.28762341e-03] [-1.45575467e-03 1.73832709e-03 -1.28762341e-03] [ 1.23802789e-04 -1.45818904e-05 1.30586462e-03] [-1.23802788e-04 1.45818907e-05 1.30586463e-03] [ 2.20118433e-04 -4.49558189e-04 -1.13101917e-03] [-2.20118435e-04 4.49558190e-04 -1.13101917e-03] [-1.41679684e-03 -5.42143060e-04 2.36596825e-04] [ 1.41679684e-03 5.42143047e-04 2.36596812e-04] [ 1.60202953e-03 2.72067617e-05 2.17724464e-05] [-1.60202953e-03 -2.72067631e-05 2.17724481e-05] [-1.07725726e-03 2.83843000e-04 -4.06029601e-04] [ 1.07725726e-03 -2.83842998e-04 -4.06029603e-04] [ 5.62389055e-04 9.16065752e-04 -5.70280916e-04] [-5.62389056e-04 -9.16065758e-04 -5.70280924e-04] [-5.31143535e-04 5.34342081e-05 -2.11531796e-05] [ 5.31143536e-04 -5.34342081e-05 -2.11531792e-05] [-2.75848697e-03 -1.13959308e-04 -1.05720850e-04] [ 2.75848697e-03 1.13959307e-04 -1.05720853e-04] [ 2.84481048e-03 -3.40248499e-04 2.53114898e-04] [-2.84481048e-03 3.40248499e-04 2.53114893e-04] [ 4.63439511e-04 1.17555950e-04 4.92117943e-05] [-4.63439513e-04 -1.17555957e-04 4.92117931e-05] [-1.47676773e-03 1.11874244e-03 6.50021919e-04] [ 1.47676773e-03 -1.11874245e-03 6.50021918e-04] [ 1.09736142e-03 2.06932127e-04 -1.16459641e-03] [-1.09736142e-03 -2.06932128e-04 -1.16459640e-03] [ 1.71389365e-03 1.29559388e-03 1.27330991e-03] [-1.71389365e-03 -1.29559389e-03 1.27330990e-03] [-2.45200071e-03 2.57417002e-03 4.89773836e-04] [ 2.45200072e-03 -2.57417003e-03 4.89773849e-04]] Final stress: [-3.58627133e-06 -8.16189951e-07 -9.57142512e-06 7.59016308e-15 5.22742455e-15 3.81986028e-05] Minimization converged after 20 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 22 steps. Minimization converged after 19 steps. Minimization converged after 18 steps. Minimization converged after 21 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.01485392e-03 1.48611538e-03 3.52184174e-04] [-1.01485392e-03 -1.48611540e-03 3.52184177e-04] [ 1.26611398e-03 2.61929701e-04 -2.32514406e-04] [-1.26611398e-03 -2.61929705e-04 -2.32514403e-04] [ 1.84940703e-03 -7.04368864e-04 6.07218667e-04] [-1.84940703e-03 7.04368864e-04 6.07218652e-04] [-4.16924805e-03 -2.37783001e-03 2.86394162e-03] [ 4.16924805e-03 2.37783000e-03 2.86394161e-03] [-1.65189644e-03 -8.22401931e-05 -4.53767940e-04] [ 1.65189643e-03 8.22401988e-05 -4.53767939e-04] [ 3.05338517e-04 7.17366128e-04 -1.51825266e-05] [-3.05338518e-04 -7.17366127e-04 -1.51825245e-05] [ 9.00628032e-04 4.36945696e-04 2.15581825e-03] [-9.00628029e-04 -4.36945695e-04 2.15581825e-03] [-3.68761599e-03 1.75187149e-03 3.17830609e-03] [ 3.68761598e-03 -1.75187150e-03 3.17830608e-03] [-9.50170824e-04 1.51606871e-04 2.97897592e-04] [ 9.50170825e-04 -1.51606874e-04 2.97897584e-04] [-1.90106657e-04 -5.42042357e-04 -8.15541318e-04] [ 1.90106653e-04 5.42042351e-04 -8.15541318e-04] [ 2.99658504e-03 5.92873724e-04 5.60172279e-04] [-2.99658504e-03 -5.92873722e-04 5.60172266e-04] [-5.30734760e-04 3.10173075e-03 3.58753490e-04] [ 5.30734764e-04 -3.10173074e-03 3.58753489e-04] [-7.48275938e-04 1.68576852e-03 -2.63280598e-03] [ 7.48275934e-04 -1.68576850e-03 -2.63280594e-03] [-9.60369884e-04 -3.30166191e-03 -3.60818000e-03] [ 9.60369883e-04 3.30166192e-03 -3.60817998e-03] [ 3.81347800e-03 5.35298584e-04 1.05609448e-03] [-3.81347801e-03 -5.35298591e-04 1.05609448e-03] [-1.86810161e-03 -5.36207753e-04 -5.99276012e-04] [ 1.86810161e-03 5.36207754e-04 -5.99276018e-04] [-1.77183644e-03 -1.32746210e-03 -3.07914787e-04] [ 1.77183644e-03 1.32746211e-03 -3.07914784e-04] [-2.76032542e-03 3.28187796e-03 9.95230090e-04] [ 2.76032542e-03 -3.28187796e-03 9.95230091e-04] [ 1.14984688e-03 2.67753944e-03 6.10962325e-04] [-1.14984688e-03 -2.67753944e-03 6.10962320e-04] [ 7.00594652e-04 2.96619069e-05 2.53889948e-03] [-7.00594656e-04 -2.96618963e-05 2.53889949e-03] [-1.04407253e-03 -3.87929245e-04 -2.32809391e-03] [ 1.04407254e-03 3.87929248e-04 -2.32809392e-03] [-1.37523523e-03 -2.24929907e-03 -2.26584246e-03] [ 1.37523523e-03 2.24929907e-03 -2.26584246e-03] [ 9.20909529e-04 -8.97224822e-04 2.28116034e-03] [-9.20909532e-04 8.97224828e-04 2.28116034e-03] [-3.74467366e-03 2.78739701e-03 2.27557442e-03] [ 3.74467365e-03 -2.78739701e-03 2.27557441e-03] [ 3.57022940e-03 1.23042166e-03 -9.63630845e-04] [-3.57022940e-03 -1.23042166e-03 -9.63630840e-04] [-1.50146101e-03 -2.52166298e-03 -2.73576019e-03] [ 1.50146102e-03 2.52166298e-03 -2.73576019e-03] [ 3.77868216e-04 -1.40980892e-03 1.09916248e-03] [-3.77868220e-04 1.40980893e-03 1.09916249e-03] [-2.85647318e-05 -4.96653494e-03 -1.68296872e-04] [ 2.85647317e-05 4.96653495e-03 -1.68296868e-04] [-5.91239446e-03 -6.63027182e-05 -1.56287957e-03] [ 5.91239446e-03 6.63027135e-05 -1.56287956e-03] [ 2.35852474e-03 8.59241451e-04 -3.14895547e-04] [-2.35852474e-03 -8.59241450e-04 -3.14895547e-04] [-2.72367850e-03 -4.45578114e-05 -1.90559986e-04] [ 2.72367849e-03 4.45578089e-05 -1.90559984e-04] [ 2.21271670e-03 1.40610669e-03 2.78151914e-03] [-2.21271671e-03 -1.40610669e-03 2.78151914e-03] [-1.61728309e-03 1.11421751e-04 -5.35192541e-03] [ 1.61728310e-03 -1.11421755e-04 -5.35192541e-03] [ 1.54213480e-04 2.31152722e-04 1.59165966e-03] [-1.54213484e-04 -2.31152724e-04 1.59165966e-03] [ 1.10691147e-03 1.65737267e-03 -4.54401702e-04] [-1.10691147e-03 -1.65737267e-03 -4.54401713e-04] [ 1.56294732e-03 2.09390834e-03 -2.47602598e-03] [-1.56294731e-03 -2.09390833e-03 -2.47602598e-03] [-4.56803689e-03 8.38607685e-04 2.20282865e-03] [ 4.56803690e-03 -8.38607669e-04 2.20282865e-03] [ 3.44372603e-04 9.28936466e-04 -9.95495091e-04] [-3.44372605e-04 -9.28936464e-04 -9.95495098e-04] [ 4.18417468e-04 -2.75376120e-04 1.82066361e-03] [-4.18417466e-04 2.75376117e-04 1.82066361e-03] [ 1.22071640e-03 -9.43440165e-04 7.38808981e-05] [-1.22071640e-03 9.43440152e-04 7.38809002e-05] [-1.83425904e-03 8.75617133e-05 -7.45505623e-05] [ 1.83425904e-03 -8.75617148e-05 -7.45505592e-05] [ 2.14618831e-03 8.66094920e-04 -1.07003368e-03] [-2.14618830e-03 -8.66094924e-04 -1.07003368e-03] [-1.65663478e-03 2.48497026e-03 -1.61397685e-03] [ 1.65663479e-03 -2.48497025e-03 -1.61397684e-03] [ 1.35685973e-03 -1.93575454e-03 -1.33795870e-04] [-1.35685973e-03 1.93575456e-03 -1.33795868e-04] [ 3.35913058e-03 -5.87633847e-05 -2.65773024e-04] [-3.35913058e-03 5.87633788e-05 -2.65773023e-04] [-3.58641488e-03 -9.45539378e-04 7.66183373e-04] [ 3.58641488e-03 9.45539379e-04 7.66183377e-04] [ 8.18740111e-04 -1.63542349e-03 -4.96268675e-05] [-8.18740103e-04 1.63542347e-03 -4.96268683e-05] [ 2.13882618e-03 -3.60031123e-04 -1.71594903e-03] [-2.13882618e-03 3.60031126e-04 -1.71594902e-03] [-2.65704772e-03 -1.42812921e-03 -7.07412869e-04] [ 2.65704773e-03 1.42812921e-03 -7.07412874e-04] [-3.98741062e-03 -4.37252744e-03 1.27841882e-03] [ 3.98741061e-03 4.37252743e-03 1.27841881e-03] [ 1.74178144e-03 -4.77593797e-04 2.35757933e-03] [-1.74178143e-03 4.77593794e-04 2.35757935e-03]] Final stress: [-3.75124482e-06 -3.02653072e-06 -1.45162105e-05 9.09361530e-15 6.64721886e-15 -4.63094929e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.37836534e-04 5.95987866e-04 1.65237972e-04] [ 4.37836532e-04 -5.95987875e-04 1.65237974e-04] [-5.68989653e-04 1.07605359e-04 -6.51521683e-05] [ 5.68989652e-04 -1.07605364e-04 -6.51521676e-05] [-7.41371512e-04 -2.68886115e-04 2.74441933e-04] [ 7.41371512e-04 2.68886114e-04 2.74441934e-04] [ 1.83202952e-03 -1.04184060e-03 1.25220974e-03] [-1.83202952e-03 1.04184061e-03 1.25220975e-03] [ 7.33319944e-04 -4.40201929e-05 -1.96150459e-04] [-7.33319945e-04 4.40201868e-05 -1.96150459e-04] [-1.88642120e-04 2.89515999e-04 3.18925327e-06] [ 1.88642120e-04 -2.89516001e-04 3.18925695e-06] [-3.57839013e-04 2.00473513e-04 9.44692868e-04] [ 3.57839016e-04 -2.00473514e-04 9.44692871e-04] [ 1.52984296e-03 7.90386267e-04 1.36948281e-03] [-1.52984296e-03 -7.90386265e-04 1.36948282e-03] [ 3.69884251e-04 7.67372946e-05 1.43832554e-04] [-3.69884250e-04 -7.67372975e-05 1.43832552e-04] [ 8.98877454e-05 -2.36531224e-04 -3.57411595e-04] [-8.98877466e-05 2.36531220e-04 -3.57411600e-04] [-1.27809043e-03 2.57586940e-04 2.49002409e-04] [ 1.27809043e-03 -2.57586940e-04 2.49002409e-04] [ 2.82428496e-04 1.38198615e-03 1.67123804e-04] [-2.82428493e-04 -1.38198614e-03 1.67123804e-04] [ 2.84466353e-04 7.76425756e-04 -1.14802732e-03] [-2.84466354e-04 -7.76425751e-04 -1.14802732e-03] [ 4.77780776e-04 -1.45579487e-03 -1.53410811e-03] [-4.77780776e-04 1.45579486e-03 -1.53410812e-03] [-1.62024911e-03 1.91998883e-04 4.60651301e-04] [ 1.62024911e-03 -1.91998885e-04 4.60651299e-04] [ 7.94888531e-04 -2.15495958e-04 -2.39521765e-04] [-7.94888531e-04 2.15495957e-04 -2.39521764e-04] [ 7.80616087e-04 -5.43479510e-04 -1.32294115e-04] [-7.80616087e-04 5.43479511e-04 -1.32294115e-04] [ 5.40007240e-04 -1.08854890e-03 2.34657447e-04] [-5.40007239e-04 1.08854890e-03 2.34657449e-04] [-1.09355833e-03 -1.38164758e-03 4.37408978e-04] [ 1.09355833e-03 1.38164758e-03 4.37408976e-04] [-4.46576276e-04 2.19397102e-04 -1.05773536e-03] [ 4.46576279e-04 -2.19397100e-04 -1.05773536e-03] [ 2.89134791e-04 2.01066550e-05 1.10854640e-03] [-2.89134790e-04 -2.01066543e-05 1.10854640e-03] [ 3.86486022e-04 3.61256787e-04 9.67330190e-04] [-3.86486019e-04 -3.61256783e-04 9.67330189e-04] [-5.71515415e-04 8.45842853e-04 -1.05403701e-03] [ 5.71515414e-04 -8.45842850e-04 -1.05403701e-03] [ 1.54415297e-03 -5.39313697e-04 -4.35577459e-04] [-1.54415297e-03 5.39313700e-04 -4.35577458e-04] [-1.65983921e-03 -1.18173289e-03 9.70882651e-04] [ 1.65983921e-03 1.18173289e-03 9.70882649e-04] [ 2.11368071e-04 6.20037354e-04 4.63421908e-04] [-2.11368072e-04 -6.20037357e-04 4.63421911e-04] [-5.97801611e-04 1.12994590e-03 -1.16337061e-03] [ 5.97801609e-04 -1.12994590e-03 -1.16337061e-03] [-2.42388958e-03 3.96759005e-05 -6.56062352e-04] [ 2.42388958e-03 -3.96758906e-05 -6.56062354e-04] [-1.10208614e-04 2.12177728e-03 -1.04277739e-04] [ 1.10208613e-04 -2.12177727e-03 -1.04277737e-04] [-1.15165926e-03 -6.00892723e-05 -2.83667957e-05] [ 1.15165926e-03 6.00892744e-05 -2.83667956e-05] [ 9.96170805e-04 -4.24443155e-04 -1.56848245e-04] [-9.96170807e-04 4.24443154e-04 -1.56848243e-04] [-6.95917730e-04 -2.63117660e-06 -2.32376454e-03] [ 6.95917725e-04 2.63117338e-06 -2.32376454e-03] [ 9.47975699e-04 -5.74768449e-04 1.26335260e-03] [-9.47975701e-04 5.74768446e-04 1.26335261e-03] [ 5.69258849e-04 -6.89875765e-04 -1.34340166e-04] [-5.69258850e-04 6.89875764e-04 -1.34340163e-04] [-2.77771797e-05 -8.13878510e-05 6.45276860e-04] [ 2.77771781e-05 8.13878488e-05 6.45276857e-04] [-1.94088967e-03 -4.17159131e-04 9.27278958e-04] [ 1.94088967e-03 4.17159134e-04 9.27278956e-04] [ 6.92143486e-04 -8.69411740e-04 -1.04488997e-03] [-6.92143486e-04 8.69411743e-04 -1.04488997e-03] [ 1.48988022e-04 1.10365100e-04 7.98412017e-04] [-1.48988019e-04 -1.10365099e-04 7.98412023e-04] [ 1.91336703e-04 -4.06231291e-04 -4.54339176e-04] [-1.91336707e-04 4.06231294e-04 -4.54339180e-04] [-5.65092674e-04 -3.89971174e-04 -2.90772014e-05] [ 5.65092675e-04 3.89971170e-04 -2.90772038e-05] [ 8.39379373e-04 3.01741773e-05 -4.27721012e-05] [-8.39379376e-04 -3.01741781e-05 -4.27721015e-05] [-9.02021872e-04 3.87713346e-04 -4.49431663e-04] [ 9.02021875e-04 -3.87713347e-04 -4.49431668e-04] [ 6.55713431e-04 1.04477929e-03 -6.51520119e-04] [-6.55713431e-04 -1.04477930e-03 -6.51520129e-04] [-7.74484677e-04 -6.98130947e-04 -2.67644946e-05] [ 7.74484677e-04 6.98130951e-04 -2.67644954e-05] [-1.47826041e-03 -4.74029285e-06 -1.16770402e-04] [ 1.47826041e-03 4.74029208e-06 -1.16770404e-04] [ 1.52639842e-03 -4.38324104e-04 3.24708226e-04] [-1.52639841e-03 4.38324105e-04 3.24708227e-04] [-2.58441394e-04 -7.74833206e-04 -3.61593635e-05] [ 2.58441393e-04 7.74833200e-04 -3.61593621e-05] [-1.14219998e-03 5.91062372e-04 -3.29151137e-04] [ 1.14219997e-03 -5.91062372e-04 -3.29151144e-04] [ 9.63955568e-04 1.82353891e-04 -7.44061007e-04] [-9.63955567e-04 -1.82353891e-04 -7.44060999e-04] [ 7.74136179e-04 2.30639953e-04 9.92707549e-04] [-7.74136181e-04 -2.30639958e-04 9.92707551e-04] [-1.72323615e-03 1.88322466e-03 5.48134001e-04] [ 1.72323615e-03 -1.88322466e-03 5.48133999e-04]] Final stress: [-8.39847690e-07 -3.45034530e-06 -7.92208612e-06 -2.54081037e-15 -1.51779359e-15 1.89210203e-05] Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 8.40166259e-05 -5.68979402e-04 -9.00818383e-05] [-8.40166258e-05 5.68979402e-04 -9.00818392e-05] [ 2.25080788e-04 7.38871360e-05 5.62800615e-05] [-2.25080788e-04 -7.38871345e-05 5.62800625e-05] [ 3.08493783e-04 -9.12292019e-05 9.13327229e-05] [-3.08493783e-04 9.12292029e-05 9.13327232e-05] [-4.78897145e-04 1.18509131e-04 -2.51162727e-04] [ 4.78897146e-04 -1.18509136e-04 -2.51162732e-04] [-1.17151470e-04 5.81615500e-06 7.76576895e-05] [ 1.17151471e-04 -5.81615334e-06 7.76576897e-05] [ 4.10841762e-05 1.05956137e-04 -1.41283376e-04] [-4.10841765e-05 -1.05956136e-04 -1.41283375e-04] [ 4.90929021e-05 7.18708569e-05 4.03623376e-05] [-4.90929018e-05 -7.18708553e-05 4.03623405e-05] [-3.47202412e-04 5.23920667e-04 2.19698914e-04] [ 3.47202412e-04 -5.23920667e-04 2.19698912e-04] [-1.13692722e-05 1.59129172e-05 1.74549091e-05] [ 1.13692729e-05 -1.59129151e-05 1.74549108e-05] [-3.18188996e-04 -1.72007910e-04 2.29039106e-05] [ 3.18188996e-04 1.72007911e-04 2.29039125e-05] [ 3.28592789e-04 2.81578019e-05 -1.04469097e-05] [-3.28592789e-04 -2.81578007e-05 -1.04469098e-05] [-2.31532598e-04 7.37576724e-05 -2.81088873e-05] [ 2.31532597e-04 -7.37576778e-05 -2.81088875e-05] [-2.25422581e-04 -1.40065768e-04 6.30961197e-05] [ 2.25422580e-04 1.40065763e-04 6.30961155e-05] [-2.09255922e-04 -4.04759343e-04 -3.11714087e-04] [ 2.09255922e-04 4.04759346e-04 -3.11714087e-04] [ 3.90380981e-04 8.11305037e-05 1.30897896e-04] [-3.90380979e-04 -8.11305030e-05 1.30897897e-04] [-7.27198849e-06 -4.99029894e-05 -8.24547014e-05] [ 7.27198760e-06 4.99029890e-05 -8.24547017e-05] [-3.94822164e-04 -3.43161920e-05 2.93133416e-05] [ 3.94822164e-04 3.43161936e-05 2.93133427e-05] [-2.77729381e-04 3.66412971e-04 -5.99579676e-05] [ 2.77729381e-04 -3.66412971e-04 -5.99579680e-05] [ 2.04094776e-04 3.51078594e-04 1.61280625e-04] [-2.04094775e-04 -3.51078594e-04 1.61280626e-04] [-5.83690801e-05 -2.26886673e-04 6.10540837e-04] [ 5.83690787e-05 2.26886673e-04 6.10540837e-04] [-1.57190234e-04 -1.08844281e-04 -3.32500940e-04] [ 1.57190234e-04 1.08844281e-04 -3.32500940e-04] [-2.25443802e-04 -4.88858231e-04 -3.87994854e-04] [ 2.25443802e-04 4.88858229e-04 -3.87994854e-04] [ 1.74543438e-04 -2.15898243e-04 3.01484801e-04] [-1.74543438e-04 2.15898242e-04 3.01484801e-04] [-5.25727440e-04 2.56406077e-04 3.13093104e-04] [ 5.25727442e-04 -2.56406078e-04 3.13093104e-04] [ 4.41053455e-04 2.64199969e-04 -4.66179632e-04] [-4.41053455e-04 -2.64199970e-04 -4.66179632e-04] [-1.16149286e-04 -2.06285301e-04 -3.79198542e-04] [ 1.16149287e-04 2.06285302e-04 -3.79198543e-04] [ 2.93692297e-05 -1.90238350e-04 2.55892864e-04] [-2.93692302e-05 1.90238350e-04 2.55892865e-04] [-4.49546401e-05 -3.84635746e-04 1.50778111e-04] [ 4.49546378e-05 3.84635742e-04 1.50778113e-04] [-4.06320065e-04 -3.21796461e-04 -1.46060896e-04] [ 4.06320066e-04 3.21796459e-04 -1.46060896e-04] [ 3.28642279e-04 9.61632566e-05 5.16678783e-05] [-3.28642279e-04 -9.61632569e-05 5.16678789e-05] [-3.76805065e-04 -5.63715550e-05 -1.94738760e-05] [ 3.76805065e-04 5.63715548e-05 -1.94738765e-05] [-5.27680455e-05 -7.31602391e-05 8.49916150e-04] [ 5.27680473e-05 7.31602403e-05 8.49916152e-04] [-2.36412787e-04 8.64385922e-05 -8.65219366e-04] [ 2.36412787e-04 -8.64385908e-05 -8.65219367e-04] [ 3.23433775e-04 -1.32458524e-04 2.42281140e-04] [-3.23433775e-04 1.32458524e-04 2.42281138e-04] [-6.43862839e-06 -1.51543454e-06 1.73892950e-05] [ 6.43862769e-06 1.51543412e-06 1.73892966e-05] [ 2.92070453e-04 1.80031547e-04 -2.55210854e-04] [-2.92070452e-04 -1.80031550e-04 -2.55210852e-04] [-5.75211301e-04 1.73020714e-04 1.15805683e-04] [ 5.75211301e-04 -1.73020714e-04 1.15805683e-04] [ 7.91423625e-05 1.31695880e-04 -2.81885303e-04] [-7.91423634e-05 -1.31695880e-04 -2.81885306e-04] [ 2.43022277e-04 1.06916334e-05 6.92170036e-05] [-2.43022277e-04 -1.06916339e-05 6.92170046e-05] [ 1.76966437e-04 8.75775280e-05 -1.72480844e-04] [-1.76966437e-04 -8.75775261e-05 -1.72480841e-04] [-4.24289701e-04 -1.44621180e-05 9.90615181e-06] [ 4.24289701e-04 1.44621182e-05 9.90615054e-06] [ 1.01716391e-04 1.29724714e-04 -1.70980345e-04] [-1.01716391e-04 -1.29724715e-04 -1.70980345e-04] [-1.45431105e-05 -5.46378877e-05 1.52585857e-04] [ 1.45431117e-05 5.46378910e-05 1.52585861e-04] [ 5.08686034e-04 3.60842945e-04 2.07809686e-05] [-5.08686035e-04 -3.60842947e-04 2.07809682e-05] [ 5.10894147e-04 -2.18252693e-05 -4.51526906e-05] [-5.10894148e-04 2.18252697e-05 -4.51526909e-05] [-5.26289267e-04 -1.84901226e-04 9.24403230e-05] [ 5.26289267e-04 1.84901225e-04 9.24403225e-05] [ 1.15702075e-04 6.16675759e-05 3.01988905e-05] [-1.15702075e-04 -6.16675727e-05 3.01988893e-05] [ 2.32001072e-04 -2.27508376e-05 4.52177334e-05] [-2.32001074e-04 2.27508391e-05 4.52177365e-05] [-2.11111852e-04 -2.30458301e-04 2.85755288e-04] [ 2.11111851e-04 2.30458301e-04 2.85755287e-04] [-2.90811184e-04 -3.76833008e-04 -1.43689513e-04] [ 2.90811187e-04 3.76833011e-04 -1.43689510e-04] [ 2.81595628e-04 -2.33631896e-04 1.16007541e-04] [-2.81595629e-04 2.33631897e-04 1.16007539e-04]] Final stress: [-2.07637629e-06 -1.39340259e-06 -7.05062088e-06 -1.39828228e-15 1.85959592e-15 -5.82307165e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.94373759e-04 -1.89593404e-04 -4.17282793e-05] [ 1.94373757e-04 1.89593390e-04 -4.17282759e-05] [-2.30313419e-04 1.22260640e-04 6.55664142e-05] [ 2.30313419e-04 -1.22260640e-04 6.55664134e-05] [-3.46178436e-04 -4.54953903e-05 3.70474541e-05] [ 3.46178436e-04 4.54953901e-05 3.70474550e-05] [ 6.29173875e-04 4.13158244e-04 -5.72513277e-04] [-6.29173877e-04 -4.13158237e-04 -5.72513272e-04] [ 1.93812578e-04 3.39852943e-05 1.61799790e-04] [-1.93812579e-04 -3.39852976e-05 1.61799791e-04] [-1.19987236e-04 3.32348583e-05 -1.34464031e-04] [ 1.19987236e-04 -3.32348585e-05 -1.34464031e-04] [ 1.17068126e-04 3.10667621e-05 -1.64273947e-04] [-1.17068126e-04 -3.10667626e-05 -1.64273947e-04] [ 4.78652346e-04 3.32199147e-04 1.15187961e-04] [-4.78652347e-04 -3.32199145e-04 1.15187964e-04] [-1.83483095e-04 1.94187098e-05 -1.74153553e-05] [ 1.83483096e-04 -1.94187125e-05 -1.74153575e-05] [ 3.95713462e-04 -1.39596251e-04 1.45946170e-04] [-3.95713462e-04 1.39596249e-04 1.45946166e-04] [-5.09663470e-04 -3.02292607e-05 -1.14097101e-04] [ 5.09663471e-04 3.02292610e-05 -1.14097101e-04] [ 5.51872669e-04 -4.54907824e-04 -9.28465363e-05] [-5.51872670e-04 4.54907820e-04 -9.28465350e-05] [ 1.08368710e-04 -4.27697797e-04 4.14861851e-04] [-1.08368710e-04 4.27697801e-04 4.14861855e-04] [ 2.05855574e-04 -1.34991410e-04 -1.51869337e-04] [-2.05855573e-04 1.34991410e-04 -1.51869337e-04] [-3.72301890e-04 4.12635156e-05 1.56477558e-04] [ 3.72301887e-04 -4.12635167e-05 1.56477557e-04] [-1.44966077e-04 -1.57036229e-05 -8.48640134e-05] [ 1.44966078e-04 1.57036241e-05 -8.48640134e-05] [ 4.89048622e-04 -5.90747035e-05 4.34323012e-05] [-4.89048621e-04 5.90747062e-05 4.34323002e-05] [ 2.47010741e-04 -3.72499631e-04 9.06210750e-05] [-2.47010741e-04 3.72499631e-04 9.06210754e-05] [-2.52586626e-04 -2.81819773e-04 -8.48462836e-05] [ 2.52586626e-04 2.81819773e-04 -8.48462851e-05] [-3.61292144e-05 8.25313435e-06 -2.68685610e-04] [ 3.61292200e-05 -8.25313804e-06 -2.68685613e-04] [-1.54804885e-04 2.73326724e-04 6.18395222e-04] [ 1.54804885e-04 -2.73326726e-04 6.18395222e-04] [ 2.38622918e-04 1.39794133e-04 3.80740219e-04] [-2.38622916e-04 -1.39794132e-04 3.80740219e-04] [-2.37370614e-04 4.17893440e-04 -5.08382937e-04] [ 2.37370614e-04 -4.17893438e-04 -5.08382937e-04] [ 5.88967324e-04 -3.52353620e-04 -4.29596670e-04] [-5.88967328e-04 3.52353618e-04 -4.29596666e-04] [-5.15074482e-04 -3.14244499e-04 2.48858614e-04] [ 5.15074483e-04 3.14244497e-04 2.48858612e-04] [ 2.39257125e-05 1.97000727e-04 3.03298425e-04] [-2.39257126e-05 -1.97000727e-04 3.03298425e-04] [-5.26522931e-05 9.52115023e-05 -3.14304057e-04] [ 5.26522942e-05 -9.52115025e-05 -3.14304056e-04] [-1.81188497e-04 3.79935173e-04 -7.32991707e-05] [ 1.81188495e-04 -3.79935177e-04 -7.32991691e-05] [ 1.78354277e-04 -6.49149978e-05 2.75725359e-04] [-1.78354279e-04 6.49149971e-05 2.75725357e-04] [-3.95323546e-04 -1.26201978e-04 3.15969542e-05] [ 3.95323546e-04 1.26201978e-04 3.15969535e-05] [ 4.03908060e-04 -2.72303941e-04 7.39798123e-05] [-4.03908060e-04 2.72303941e-04 7.39798130e-05] [-1.99576677e-04 -1.46346669e-04 -1.02746939e-03] [ 1.99576675e-04 1.46346666e-04 -1.02746939e-03] [-1.35046875e-04 -4.77363796e-05 1.04782217e-03] [ 1.35046876e-04 4.77363771e-05 1.04782217e-03] [ 1.01266160e-04 1.17828788e-04 2.24742907e-04] [-1.01266162e-04 -1.17828788e-04 2.24742909e-04] [ 2.21909904e-04 1.70093047e-04 9.19493561e-05] [-2.21909904e-04 -1.70093047e-04 9.19493542e-05] [-4.68551206e-04 -4.45215977e-04 4.46224272e-05] [ 4.68551204e-04 4.45215981e-04 4.46224251e-05] [ 4.47682453e-04 -2.12477748e-04 -2.56496843e-04] [-4.47682452e-04 2.12477750e-04 -2.56496841e-04] [ 1.77962871e-04 -5.18932343e-05 1.49836128e-04] [-1.77962870e-04 5.18932363e-05 1.49836128e-04] [ 1.76648030e-04 -1.02312339e-04 -5.66222597e-04] [-1.76648029e-04 1.02312339e-04 -5.66222596e-04] [-5.12409488e-04 2.84165177e-04 -2.60912879e-04] [ 5.12409489e-04 -2.84165179e-04 -2.60912882e-04] [ 5.74125480e-04 1.34544291e-05 4.46334824e-05] [-5.74125481e-04 -1.34544293e-05 4.46334839e-05] [-2.14672324e-05 9.33737256e-05 -1.52120059e-04] [ 2.14672316e-05 -9.33737258e-05 -1.52120059e-04] [ 1.32532090e-04 -3.40525835e-04 3.37009267e-04] [-1.32532088e-04 3.40525835e-04 3.37009265e-04] [-7.82395894e-04 3.16169690e-05 -1.25029191e-06] [ 7.82395897e-04 -3.16169558e-05 -1.25029275e-06] [-5.94646993e-04 -5.32894013e-05 -6.75271945e-05] [ 5.94646993e-04 5.32894019e-05 -6.75271956e-05] [ 7.23772418e-04 -1.59173894e-04 5.55765538e-05] [-7.23772418e-04 1.59173895e-04 5.55765532e-05] [-1.49940087e-04 5.14978214e-04 5.76661683e-05] [ 1.49940085e-04 -5.14978211e-04 5.76661691e-05] [-1.39166060e-04 1.32132651e-04 4.19410564e-04] [ 1.39166063e-04 -1.32132651e-04 4.19410558e-04] [ 3.47237286e-04 1.37224657e-04 1.13738021e-04] [-3.47237284e-04 -1.37224656e-04 1.13738026e-04] [ 4.96759520e-04 4.16850879e-04 -3.06952859e-05] [-4.96759521e-04 -4.16850877e-04 -3.06952880e-05] [-2.22778266e-04 1.74986983e-04 -3.34661080e-04] [ 2.22778267e-04 -1.74986982e-04 -3.34661078e-04]] Final stress: [-4.06117652e-06 1.07052683e-06 -9.55031890e-06 -1.69228010e-15 -1.19033261e-15 1.03880653e-05] Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 115 steps. Minimization converged after 115 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 16 steps. Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.54840448e-04 6.08859761e-05 -6.69551729e-05] [-1.54840446e-04 -6.08859609e-05 -6.69551783e-05] [ 1.19469636e-04 -3.48941997e-05 1.34162437e-04] [-1.19469636e-04 3.48941981e-05 1.34162440e-04] [ 1.96884091e-04 -8.38269363e-05 -2.98207370e-05] [-1.96884091e-04 8.38269354e-05 -2.98207397e-05] [-2.15131807e-04 -8.98349662e-05 1.47003380e-04] [ 2.15131807e-04 8.98349644e-05 1.47003377e-04] [-3.33610195e-05 7.57472665e-05 -3.79785581e-05] [ 3.33610194e-05 -7.57472655e-05 -3.79785587e-05] [ 3.21428294e-05 6.74954409e-05 -5.38397271e-05] [-3.21428297e-05 -6.74954419e-05 -5.38397270e-05] [-1.10332638e-04 -1.65348075e-05 -9.08319524e-05] [ 1.10332638e-04 1.65348087e-05 -9.08319514e-05] [-4.41274457e-04 -6.42800270e-05 1.34971820e-04] [ 4.41274457e-04 6.42800252e-05 1.34971816e-04] [-4.33376012e-05 1.16677861e-04 -7.71684371e-05] [ 4.33376010e-05 -1.16677861e-04 -7.71684374e-05] [ 8.00625561e-05 -5.11088524e-05 8.44761463e-05] [-8.00625567e-05 5.11088545e-05 8.44761489e-05] [ 3.67448194e-04 1.59233540e-05 7.48251275e-05] [-3.67448194e-04 -1.59233549e-05 7.48251262e-05] [-9.95911423e-05 -3.25955873e-05 1.13226101e-04] [ 9.95911421e-05 3.25955965e-05 1.13226099e-04] [-4.50820920e-05 -8.66128078e-05 -1.64790210e-04] [ 4.50820919e-05 8.66128069e-05 -1.64790212e-04] [-2.18281232e-05 7.23299574e-05 -5.83389597e-05] [ 2.18281237e-05 -7.23299579e-05 -5.83389619e-05] [ 2.06575141e-04 6.89143225e-05 2.67972855e-04] [-2.06575142e-04 -6.89143202e-05 2.67972856e-04] [-2.80468955e-05 -8.32535639e-05 -1.21048349e-04] [ 2.80468952e-05 8.32535648e-05 -1.21048348e-04] [-2.11161055e-04 -5.06256316e-05 -1.21952011e-04] [ 2.11161056e-04 5.06256287e-05 -1.21952009e-04] [-1.70358155e-04 2.06317772e-04 1.08278462e-04] [ 1.70358155e-04 -2.06317773e-04 1.08278462e-04] [ 1.78014816e-04 3.08258842e-04 1.38139593e-04] [-1.78014816e-04 -3.08258843e-04 1.38139592e-04] [ 5.91817186e-05 -3.06633930e-05 2.55000812e-04] [-5.91817220e-05 3.06633954e-05 2.55000812e-04] [-2.09895433e-04 -9.32411246e-06 -1.71409191e-04] [ 2.09895432e-04 9.32411291e-06 -1.71409191e-04] [-1.51971177e-05 -3.61511539e-04 -2.28607382e-04] [ 1.51971185e-05 3.61511537e-04 -2.28607382e-04] [ 1.12715895e-04 -2.69284472e-05 1.43793485e-04] [-1.12715898e-04 2.69284472e-05 1.43793486e-04] [-4.55192046e-05 1.98747910e-04 1.67490928e-04] [ 4.55192052e-05 -1.98747908e-04 1.67490926e-04] [-1.14589801e-04 4.65148750e-05 -1.54798355e-04] [ 1.14589800e-04 -4.65148723e-05 -1.54798354e-04] [ 3.37562836e-05 -3.09415291e-05 -1.72984527e-04] [-3.37562838e-05 3.09415287e-05 -1.72984528e-04] [-2.24965459e-05 -7.33315057e-05 -4.37149083e-06] [ 2.24965463e-05 7.33315059e-05 -4.37149055e-06] [ 2.25482495e-04 -8.57208232e-05 6.28078495e-05] [-2.25482496e-04 8.57208233e-05 6.28078501e-05] [-9.35592942e-05 -2.85064162e-04 4.59100246e-06] [ 9.35592935e-05 2.85064164e-04 4.59100390e-06] [ 2.87383522e-04 1.48230526e-04 -5.54181961e-05] [-2.87383523e-04 -1.48230527e-04 -5.54181956e-05] [-2.16376977e-04 -1.52412846e-04 5.65008127e-05] [ 2.16376978e-04 1.52412846e-04 5.65008122e-05] [-7.45416131e-06 1.32614274e-04 2.11867741e-04] [ 7.45416433e-06 -1.32614270e-04 2.11867744e-04] [-2.63841750e-04 2.11694978e-04 -2.25031189e-04] [ 2.63841751e-04 -2.11694977e-04 -2.25031190e-04] [-5.95858298e-06 9.72197655e-05 2.63573743e-04] [ 5.95858159e-06 -9.72197647e-05 2.63573743e-04] [ 3.53964249e-05 1.24437467e-04 -1.54204917e-04] [-3.53964261e-05 -1.24437466e-04 -1.54204917e-04] [ 3.78490197e-04 6.28190186e-05 -1.73502395e-04] [-3.78490197e-04 -6.28190187e-05 -1.73502393e-04] [-2.06164423e-04 2.42742899e-04 1.25129448e-04] [ 2.06164422e-04 -2.42742899e-04 1.25129447e-04] [ 9.57039859e-05 2.89540992e-05 -1.61782097e-04] [-9.57039873e-05 -2.89540991e-05 -1.61782100e-04] [-5.90940571e-05 4.28560885e-05 4.20346334e-05] [ 5.90940573e-05 -4.28560896e-05 4.20346320e-05] [ 1.72050837e-04 3.75735950e-05 -1.66803940e-05] [-1.72050835e-04 -3.75735964e-05 -1.66803943e-05] [ 7.35684119e-05 1.16300061e-05 6.66669071e-05] [-7.35684108e-05 -1.16300067e-05 6.66669066e-05] [ 1.08007225e-04 2.85003297e-05 -1.32502663e-04] [-1.08007224e-04 -2.85003329e-05 -1.32502661e-04] [-1.01571027e-04 -1.08352611e-05 -6.15444543e-05] [ 1.01571028e-04 1.08352607e-05 -6.15444516e-05] [-3.38912074e-04 1.09781709e-04 -6.50253394e-05] [ 3.38912071e-04 -1.09781721e-04 -6.50253390e-05] [ 1.05903082e-04 -3.24317263e-05 -1.17678746e-04] [-1.05903082e-04 3.24317264e-05 -1.17678745e-04] [-3.00442119e-04 -5.72203849e-05 -1.04436327e-05] [ 3.00442121e-04 5.72203856e-05 -1.04436342e-05] [-1.60791813e-05 -4.77774405e-05 8.68560778e-05] [ 1.60791830e-05 4.77774333e-05 8.68560783e-05] [ 1.29069530e-04 2.76308237e-05 -1.38700553e-04] [-1.29069529e-04 -2.76308249e-05 -1.38700549e-04] [ 3.65832169e-06 3.59185358e-06 1.99870393e-04] [-3.65832279e-06 -3.59185585e-06 1.99870390e-04] [-2.14685680e-04 -1.07182927e-04 -2.50628178e-05] [ 2.14685679e-04 1.07182926e-04 -2.50628140e-05] [ 2.06667732e-04 -1.56842753e-04 3.23270368e-06] [-2.06667730e-04 1.56842752e-04 3.23270103e-06]] Final stress: [-1.70430032e-06 -4.85323713e-07 -1.07833382e-05 3.50646172e-15 2.10339899e-15 -6.33347351e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.61099754e-04 6.61765545e-05 -6.97902629e-05] [ 1.61099754e-04 -6.61765437e-05 -6.97902673e-05] [-1.23156966e-04 -3.81512411e-05 1.39420272e-04] [ 1.23156965e-04 3.81512413e-05 1.39420272e-04] [-2.04368541e-04 -8.56755772e-05 -3.31508710e-05] [ 2.04368542e-04 8.56755776e-05 -3.31508723e-05] [ 2.19172439e-04 -9.22469508e-05 1.53742042e-04] [-2.19172439e-04 9.22469424e-05 1.53742030e-04] [ 3.22969877e-05 7.86006934e-05 -4.09465782e-05] [-3.22969871e-05 -7.86006928e-05 -4.09465770e-05] [-3.30836428e-05 6.84708206e-05 -5.48200728e-05] [ 3.30836432e-05 -6.84708200e-05 -5.48200739e-05] [ 1.15793432e-04 -1.81836248e-05 -9.88128129e-05] [-1.15793433e-04 1.81836260e-05 -9.88128107e-05] [ 4.60145766e-04 -7.54929443e-05 1.32996490e-04] [-4.60145765e-04 7.54929424e-05 1.32996485e-04] [ 4.40411738e-05 1.21608206e-04 -8.16059398e-05] [-4.40411744e-05 -1.21608206e-04 -8.16059411e-05] [-8.54849732e-05 -5.08596924e-05 8.93107571e-05] [ 8.54849711e-05 5.08596940e-05 8.93107596e-05] [-3.79043120e-04 1.63157967e-05 7.84195066e-05] [ 3.79043120e-04 -1.63157986e-05 7.84195084e-05] [ 9.89139095e-05 -3.69871355e-05 1.18579236e-04] [-9.89139097e-05 3.69871332e-05 1.18579235e-04] [ 4.86272856e-05 -9.13970731e-05 -1.70288109e-04] [-4.86272849e-05 9.13970695e-05 -1.70288111e-04] [ 2.21626963e-05 8.45839658e-05 -5.13843689e-05] [-2.21626949e-05 -8.45839608e-05 -5.13843673e-05] [-2.13360991e-04 7.04887941e-05 2.76750350e-04] [ 2.13360989e-04 -7.04887940e-05 2.76750352e-04] [ 2.80446892e-05 -8.57919917e-05 -1.24744881e-04] [-2.80446902e-05 8.57919917e-05 -1.24744882e-04] [ 2.16818232e-04 -5.02795837e-05 -1.27171124e-04] [-2.16818232e-04 5.02795832e-05 -1.27171122e-04] [ 1.86700419e-04 -3.20965845e-04 1.41486208e-04] [-1.86700420e-04 3.20965844e-04 1.41486207e-04] [-1.76821107e-04 -2.13654687e-04 1.12524166e-04] [ 1.76821108e-04 2.13654685e-04 1.12524166e-04] [-2.20150268e-04 9.14669636e-06 -1.77974034e-04] [ 2.20150266e-04 -9.14669568e-06 -1.77974033e-04] [ 6.62340865e-05 2.97903095e-05 2.60984170e-04] [-6.62340843e-05 -2.97903097e-05 2.60984170e-04] [ 1.16202080e-04 2.84732321e-05 1.47657285e-04] [-1.16202080e-04 -2.84732327e-05 1.47657285e-04] [-1.31882217e-05 3.73542970e-04 -2.34236781e-04] [ 1.31882214e-05 -3.73542970e-04 -2.34236782e-04] [-1.24055742e-04 -4.69396783e-05 -1.58229574e-04] [ 1.24055742e-04 4.69396793e-05 -1.58229573e-04] [-4.22626261e-05 -2.03891586e-04 1.71695378e-04] [ 4.22626257e-05 2.03891587e-04 1.71695379e-04] [-2.32700978e-05 7.54631369e-05 -4.78385467e-06] [ 2.32700975e-05 -7.54631362e-05 -4.78385607e-06] [ 3.66810269e-05 2.95469807e-05 -1.76688751e-04] [-3.66810257e-05 -2.95469805e-05 -1.76688751e-04] [-8.66491384e-05 3.01853991e-04 8.17996372e-06] [ 8.66491371e-05 -3.01853996e-04 8.17996501e-06] [ 2.38352011e-04 8.71388669e-05 6.43496622e-05] [-2.38352008e-04 -8.71388728e-05 6.43496585e-05] [-2.23174061e-04 1.60104310e-04 5.89575914e-05] [ 2.23174063e-04 -1.60104313e-04 5.89575903e-05] [ 2.98237501e-04 -1.51416161e-04 -5.78090866e-05] [-2.98237501e-04 1.51416161e-04 -5.78090856e-05] [-2.71816449e-04 -2.22628688e-04 -2.23938204e-04] [ 2.71816450e-04 2.22628690e-04 -2.23938203e-04] [-8.72264814e-06 -1.38928947e-04 2.14545942e-04] [ 8.72264562e-06 1.38928949e-04 2.14545940e-04] [ 3.20069151e-05 -1.28557394e-04 -1.63915850e-04] [-3.20069159e-05 1.28557395e-04 -1.63915850e-04] [-7.65695014e-06 -1.03557290e-04 2.72457687e-04] [ 7.65694736e-06 1.03557289e-04 2.72457687e-04] [-2.03127275e-04 -2.55984104e-04 1.29193019e-04] [ 2.03127279e-04 2.55984103e-04 1.29193022e-04] [ 3.90717891e-04 -6.78133390e-05 -1.76858845e-04] [-3.90717891e-04 6.78133381e-05 -1.76858847e-04] [-6.37958796e-05 -4.67658220e-05 4.15212960e-05] [ 6.37958790e-05 4.67658212e-05 4.15212921e-05] [ 9.62233419e-05 -2.91999677e-05 -1.64398272e-04] [-9.62233420e-05 2.91999682e-05 -1.64398267e-04] [-1.79855208e-04 3.87811756e-05 -1.43353066e-05] [ 1.79855207e-04 -3.87811714e-05 -1.43353051e-05] [-8.35331047e-05 1.17279179e-05 6.92649801e-05] [ 8.35331046e-05 -1.17279165e-05 6.92649800e-05] [-1.12597251e-04 2.67526392e-05 -1.34814916e-04] [ 1.12597251e-04 -2.67526401e-05 -1.34814916e-04] [ 1.00414549e-04 -1.33205009e-05 -6.48940510e-05] [-1.00414550e-04 1.33205081e-05 -6.48940462e-05] [ 3.60929100e-04 1.14547924e-04 -6.81554021e-05] [-3.60929098e-04 -1.14547932e-04 -6.81554025e-05] [-1.03149791e-04 -3.32298203e-05 -1.21423790e-04] [ 1.03149792e-04 3.32298196e-05 -1.21423790e-04] [ 3.08948101e-04 -5.55599871e-05 -1.31752761e-05] [-3.08948100e-04 5.55599878e-05 -1.31752766e-05] [ 1.92691936e-05 -5.03985383e-05 9.03127092e-05] [-1.92691938e-05 5.03985376e-05 9.03127080e-05] [ 6.55189860e-06 -9.15945095e-06 2.08979343e-04] [-6.55189960e-06 9.15945123e-06 2.08979349e-04] [ 1.30622508e-04 -3.13026644e-05 -1.45947205e-04] [-1.30622506e-04 3.13026641e-05 -1.45947212e-04] [ 2.13333684e-04 1.65576980e-04 -4.56077511e-08] [-2.13333683e-04 -1.65576977e-04 -4.56065534e-08] [-2.20304993e-04 1.07465271e-04 -2.69882191e-05] [ 2.20304993e-04 -1.07465268e-04 -2.69882207e-05]] Final stress: [-1.71758621e-06 -4.27325864e-07 -1.10653790e-05 1.67674363e-15 -2.20856894e-15 6.52625341e-06] Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90595 0.54087 0.42712 -0. 0.00004 -0.0003 ] [ 0.54087 0.91363 0.50056 -0. -0.00004 -0.00004] [ 0.42712 0.50056 0.77835 0. -0.00003 0.00143] [-0. -0. 0. 0.2483 -0. 0. ] [ 0.00004 -0.00004 -0.00003 -0. 0.21139 0. ] [-0.0003 -0.00004 0.00143 0. 0. 0.12193]] 95%% Error estimate [ASE units]: [[0.0016 0.00862 0.00515 0. 0.00035 0.00133] [0.00862 0.00313 0.00676 0.00002 0.00025 0.00158] [0.00515 0.00676 0.00413 0.00003 0.00015 0.00487] [0. 0.00002 0.00003 0.00124 0. 0. ] [0.00035 0.00025 0.00015 0. 0.0052 0. ] [0.00133 0.00158 0.00487 0. 0. 0.02734]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.013670 is too big compared to maximum elastic constant component 0.913628 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.001426 Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 43 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 35 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 54 steps. Minimization converged after 60 steps. Minimization converged after 113 steps. Minimization converged after 108 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 33 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 57 steps. Minimization converged after 56 steps. Minimization converged after 109 steps. Minimization converged after 108 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 113 steps. Minimization converged after 110 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 108 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.88695908e-03 6.77600245e-03 1.02221673e-03] [ 2.88695908e-03 -6.77600232e-03 1.02221670e-03] [-2.25227581e-03 -1.50093086e-04 -7.99116760e-04] [ 2.25227581e-03 1.50093071e-04 -7.99116748e-04] [-3.01801024e-03 -3.04662558e-04 1.33226786e-04] [ 3.01801024e-03 3.04662552e-04 1.33226781e-04] [ 5.06264898e-03 -5.36088150e-04 1.38748451e-03] [-5.06264897e-03 5.36088133e-04 1.38748448e-03] [ 1.54731413e-03 7.43686403e-05 -2.97498195e-04] [-1.54731413e-03 -7.43686443e-05 -2.97498193e-04] [-9.41059855e-04 -1.19204054e-04 3.08881160e-04] [ 9.41059855e-04 1.19204046e-04 3.08881150e-04] [-1.86781758e-04 -1.08721709e-04 3.92028708e-04] [ 1.86781758e-04 1.08721716e-04 3.92028713e-04] [ 5.61283570e-03 -2.28779060e-03 1.23289986e-03] [-5.61283570e-03 2.28779057e-03 1.23289985e-03] [ 9.06936130e-04 1.15910451e-04 -1.81515998e-04] [-9.06936130e-04 -1.15910450e-04 -1.81515996e-04] [ 6.16941233e-04 3.68531483e-04 1.93822581e-06] [-6.16941232e-04 -3.68531472e-04 1.93822588e-06] [-5.47805689e-03 2.31745099e-04 -1.59673800e-04] [ 5.47805689e-03 -2.31745105e-04 -1.59673799e-04] [ 8.33454330e-04 4.70289328e-04 2.27207742e-04] [-8.33454330e-04 -4.70289258e-04 2.27207722e-04] [ 6.21692664e-04 -2.16014931e-04 2.24086904e-04] [-6.21692665e-04 2.16014916e-04 2.24086882e-04] [ 1.79833498e-03 4.10527781e-04 -9.10931925e-04] [-1.79833498e-03 -4.10527793e-04 -9.10931930e-04] [-4.02855736e-03 2.46515767e-04 5.34419414e-04] [ 4.02855736e-03 -2.46515761e-04 5.34419420e-04] [ 2.16880967e-03 -2.44130206e-04 -2.98894708e-04] [-2.16880967e-03 2.44130209e-04 -2.98894705e-04] [ 4.14788878e-03 -1.45758115e-03 -4.80622862e-04] [-4.14788878e-03 1.45758113e-03 -4.80622851e-04] [ 2.17744657e-03 -4.87291363e-03 -3.16025556e-05] [-2.17744657e-03 4.87291363e-03 -3.16025553e-05] [-3.90641923e-03 -4.13573684e-03 5.55055221e-04] [ 3.90641923e-03 4.13573683e-03 5.55055220e-04] [-2.33173375e-03 1.20772312e-03 -4.69234359e-03] [ 2.33173374e-03 -1.20772311e-03 -4.69234359e-03] [ 2.70125017e-03 7.54578123e-04 3.92772122e-03] [-2.70125016e-03 -7.54578112e-04 3.92772121e-03] [ 1.02617048e-03 1.93715950e-03 3.89281396e-03] [-1.02617048e-03 -1.93715950e-03 3.89281396e-03] [-1.55690410e-03 2.75141194e-03 -3.10562084e-03] [ 1.55690410e-03 -2.75141195e-03 -3.10562084e-03] [ 1.89124117e-03 -1.83231695e-03 -2.57052992e-03] [-1.89124117e-03 1.83231697e-03 -2.57052994e-03] [-8.59593886e-04 -3.79740739e-03 5.04122747e-03] [ 8.59593882e-04 3.79740742e-03 5.04122749e-03] [ 3.31801368e-04 2.46098913e-03 2.75878648e-03] [-3.31801369e-04 -2.46098913e-03 2.75878648e-03] [-1.11861639e-03 2.15459784e-03 -2.98458222e-03] [ 1.11861639e-03 -2.15459784e-03 -2.98458222e-03] [-3.89890824e-03 3.33786801e-03 -7.07212172e-04] [ 3.89890825e-03 -3.33786801e-03 -7.07212170e-04] [ 3.07103241e-03 4.29828268e-03 5.20456338e-04] [-3.07103241e-03 -4.29828268e-03 5.20456334e-04] [-4.61669509e-03 -7.50262822e-04 1.58608961e-04] [ 4.61669509e-03 7.50262821e-04 1.58608963e-04] [ 4.46669778e-03 -1.23461918e-03 -4.84918738e-04] [-4.46669778e-03 1.23461918e-03 -4.84918739e-04] [-3.21828505e-03 -1.56101096e-03 -6.08090086e-03] [ 3.21828507e-03 1.56101098e-03 -6.08090085e-03] [ 4.69966448e-03 -3.98475445e-03 3.24905366e-03] [-4.69966449e-03 3.98475447e-03 3.24905365e-03] [ 6.72750701e-04 -1.48054665e-03 -1.49380439e-03] [-6.72750700e-04 1.48054665e-03 -1.49380439e-03] [-6.71170322e-04 -1.28845305e-03 1.91591882e-03] [ 6.71170322e-04 1.28845305e-03 1.91591883e-03] [-5.32327432e-03 -3.05010574e-03 3.49419672e-03] [ 5.32327432e-03 3.05010575e-03 3.49419672e-03] [ 5.07571339e-03 -2.54768309e-03 -3.65070122e-03] [-5.07571339e-03 2.54768309e-03 -3.65070122e-03] [-4.30174438e-04 -7.13478059e-04 2.84555190e-03] [ 4.30174439e-04 7.13478061e-04 2.84555190e-03] [-1.67555391e-04 -7.60032027e-04 -2.46667421e-03] [ 1.67555389e-04 7.60032029e-04 -2.46667421e-03] [-2.11596492e-03 1.49940172e-05 3.25698571e-04] [ 2.11596492e-03 -1.49940128e-05 3.25698574e-04] [ 1.88034304e-03 1.62008065e-04 -1.68892567e-05] [-1.88034304e-03 -1.62008066e-04 -1.68892619e-05] [-2.68202670e-03 -2.20244959e-04 -1.75278658e-04] [ 2.68202670e-03 2.20244960e-04 -1.75278661e-04] [ 1.88402661e-03 7.71339540e-04 -1.01314784e-03] [-1.88402661e-03 -7.71339534e-04 -1.01314783e-03] [ 3.19948376e-03 -6.56219224e-03 -5.89884467e-04] [-3.19948376e-03 6.56219215e-03 -5.89884461e-04] [-4.95151669e-03 -2.11677497e-05 -1.03119472e-04] [ 4.95151668e-03 2.11677496e-05 -1.03119476e-04] [ 6.27305638e-03 4.23283171e-04 1.43661993e-04] [-6.27305638e-03 -4.23283168e-04 1.43661990e-04] [ 1.77053593e-03 1.41813542e-04 6.95409129e-05] [-1.77053593e-03 -1.41813600e-04 6.95409164e-05] [-2.50088809e-03 5.32950831e-04 7.33655307e-04] [ 2.50088810e-03 -5.32950850e-04 7.33655334e-04] [ 2.96070035e-03 1.89369016e-03 -2.85065129e-03] [-2.96070036e-03 -1.89369017e-03 -2.85065132e-03] [ 4.45426401e-03 3.59390341e-03 7.41797246e-04] [-4.45426401e-03 -3.59390342e-03 7.41797267e-04] [-4.97600756e-03 4.38078243e-03 3.07981183e-04] [ 4.97600756e-03 -4.38078243e-03 3.07981163e-04]] Final stress: [-2.17301895e-05 1.61264379e-05 -5.47505480e-06 -4.17094483e-16 1.52257413e-15 7.17091797e-05] Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 26 steps. Minimization converged after 23 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 42 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 1.63215920e-03 2.35977673e-03 3.79904836e-04] [-1.63215920e-03 -2.35977669e-03 3.79904832e-04] [ 1.27907541e-03 -6.51414204e-05 -2.00739289e-04] [-1.27907540e-03 6.51414176e-05 -2.00739286e-04] [ 1.52681743e-03 -9.12513439e-05 1.07864522e-04] [-1.52681743e-03 9.12513417e-05 1.07864521e-04] [-2.91637955e-03 -4.38173200e-05 3.34312887e-04] [ 2.91637955e-03 4.38173331e-05 3.34312898e-04] [-1.00656918e-03 5.65848402e-05 -3.86661085e-05] [ 1.00656917e-03 -5.65848427e-05 -3.86661094e-05] [ 3.74079465e-04 -5.13508295e-05 8.15907045e-05] [-3.74079465e-04 5.13508258e-05 8.15907026e-05] [ 6.78880837e-04 1.05046598e-05 2.15959486e-04] [-6.78880837e-04 -1.05046600e-05 2.15959480e-04] [-2.57475678e-03 -6.30802770e-04 6.14337164e-04] [ 2.57475678e-03 6.30802758e-04 6.14337165e-04] [-7.18153039e-04 3.83404151e-05 5.98043824e-06] [ 7.18153040e-04 -3.83404190e-05 5.98043652e-06] [-2.92774739e-04 2.49215329e-05 6.88571956e-05] [ 2.92774739e-04 -2.49215329e-05 6.88571886e-05] [ 2.52797204e-03 1.04396436e-04 -1.47403920e-07] [-2.52797204e-03 -1.04396437e-04 -1.47407006e-07] [ 2.91518781e-04 2.75519793e-04 1.02942410e-04] [-2.91518783e-04 -2.75519776e-04 1.02942408e-04] [ 3.87187721e-04 4.66265838e-05 -1.72336345e-04] [-3.87187722e-04 -4.66265724e-05 -1.72336332e-04] [-1.14771370e-03 -1.37370741e-05 -5.44762782e-04] [ 1.14771370e-03 1.37370651e-05 -5.44762776e-04] [ 2.33993725e-03 7.50422505e-05 2.69147040e-04] [-2.33993725e-03 -7.50422503e-05 2.69147040e-04] [-2.33379680e-03 -1.19390987e-04 -1.44682279e-04] [ 2.33379680e-03 1.19390987e-04 -1.44682280e-04] [-1.95511362e-03 -5.47577805e-04 -1.90879666e-04] [ 1.95511362e-03 5.47577799e-04 -1.90879663e-04] [-1.63149270e-03 2.23253631e-03 5.10690698e-04] [ 1.63149270e-03 -2.23253631e-03 5.10690701e-04] [ 1.15524168e-03 2.37698637e-03 -2.70814251e-04] [-1.15524168e-03 -2.37698637e-03 -2.70814254e-04] [ 1.63997729e-03 -3.23787016e-04 2.00503606e-03] [-1.63997729e-03 3.23787018e-04 2.00503606e-03] [-1.72515428e-03 -5.70985451e-04 -2.33840569e-03] [ 1.72515428e-03 5.70985451e-04 -2.33840568e-03] [-5.63684494e-04 -1.11509793e-03 -1.64415392e-03] [ 5.63684492e-04 1.11509793e-03 -1.64415393e-03] [ 4.35878161e-04 -8.42071912e-04 1.73028324e-03] [-4.35878162e-04 8.42071912e-04 1.73028324e-03] [-7.84809677e-04 1.69933060e-03 2.59783957e-03] [ 7.84809678e-04 -1.69933060e-03 2.59783957e-03] [ 1.05815056e-03 9.36162215e-04 -1.75529868e-03] [-1.05815056e-03 -9.36162209e-04 -1.75529867e-03] [-8.09694303e-04 -1.59205944e-03 -1.75415471e-03] [ 8.09694303e-04 1.59205944e-03 -1.75415471e-03] [ 6.18749136e-04 -1.65006183e-03 1.65356248e-03] [-6.18749135e-04 1.65006183e-03 1.65356248e-03] [ 1.62503327e-03 -2.76209668e-03 3.66375413e-05] [-1.62503326e-03 2.76209668e-03 3.66375388e-05] [-2.11384183e-03 -2.58940899e-03 -9.36769279e-05] [ 2.11384182e-03 2.58940900e-03 -9.36769241e-05] [ 2.41216775e-03 7.47997352e-04 -1.73146222e-04] [-2.41216775e-03 -7.47997352e-04 -1.73146222e-04] [-2.50428909e-03 4.80736151e-04 7.42239046e-05] [ 2.50428909e-03 -4.80736152e-04 7.42239056e-05] [ 3.65462741e-03 2.46748767e-03 9.26399857e-04] [-3.65462741e-03 -2.46748767e-03 9.26399860e-04] [-3.17389456e-03 1.58928520e-03 -1.91783721e-03] [ 3.17389456e-03 -1.58928520e-03 -1.91783721e-03] [-3.24844385e-04 7.66438823e-04 1.04912342e-03] [ 3.24844381e-04 -7.66438822e-04 1.04912343e-03] [ 3.96364183e-04 8.85118888e-04 -7.43133431e-04] [-3.96364181e-04 -8.85118887e-04 -7.43133437e-04] [ 2.74145561e-03 8.62987784e-04 -2.26718698e-03] [-2.74145561e-03 -8.62987775e-04 -2.26718698e-03] [-2.82496251e-03 1.26243627e-03 2.04699027e-03] [ 2.82496252e-03 -1.26243626e-03 2.04699028e-03] [-1.94915896e-04 4.51960787e-04 -1.20771423e-03] [ 1.94915900e-04 -4.51960786e-04 -1.20771422e-03] [ 1.50260760e-04 4.03607396e-04 1.17041564e-03] [-1.50260761e-04 -4.03607398e-04 1.17041563e-03] [ 6.06920269e-04 1.63649281e-05 2.48796922e-06] [-6.06920269e-04 -1.63649379e-05 2.48796106e-06] [-8.61446025e-04 1.43096543e-05 -1.60177019e-05] [ 8.61446025e-04 -1.43096559e-05 -1.60177015e-05] [ 1.82043605e-03 -9.55674123e-07 -1.52659596e-04] [-1.82043605e-03 9.55675814e-07 -1.52659596e-04] [-6.92011083e-04 1.17722035e-04 -1.67946572e-04] [ 6.92011083e-04 -1.17722045e-04 -1.67946582e-04] [-3.10659900e-03 -2.16305221e-03 -1.65053860e-04] [ 3.10659900e-03 2.16305218e-03 -1.65053858e-04] [ 2.95568495e-03 -3.43294482e-06 -9.20460353e-05] [-2.95568495e-03 3.43294351e-06 -9.20460362e-05] [-3.22549666e-03 3.50967768e-05 9.55880200e-05] [ 3.22549666e-03 -3.50967754e-05 9.55880188e-05] [-1.29786097e-03 -1.38847148e-04 3.16863879e-05] [ 1.29786098e-03 1.38847136e-04 3.16863891e-05] [ 1.96872271e-03 -1.19441398e-03 -8.04129246e-04] [-1.96872271e-03 1.19441398e-03 -8.04129249e-04] [-1.66406379e-03 -6.14779255e-04 2.01325850e-04] [ 1.66406378e-03 6.14779246e-04 2.01325852e-04] [-3.21873373e-03 -2.66651888e-03 7.03240704e-04] [ 3.21873373e-03 2.66651887e-03 7.03240699e-04] [ 2.96852341e-03 -2.39466227e-03 -1.60839170e-04] [-2.96852341e-03 2.39466226e-03 -1.60839165e-04]] Final stress: [-6.91963097e-06 3.19900272e-06 -6.08371148e-06 6.09507676e-17 1.03496794e-15 -3.41152526e-05] Minimization converged after 111 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 113 steps. Minimization converged after 114 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 17 steps. Minimization converged after 30 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 6.25732467e-04 -1.47723499e-04 -1.80388184e-05] [-6.25732465e-04 1.47723493e-04 -1.80388171e-05] [ 5.76317737e-04 7.70102522e-05 -1.50773702e-05] [-5.76317736e-04 -7.70102537e-05 -1.50773706e-05] [ 8.03165067e-04 -2.13083617e-04 1.67529793e-04] [-8.03165068e-04 2.13083617e-04 1.67529793e-04] [-1.61490290e-03 -9.13193809e-04 1.02758708e-03] [ 1.61490290e-03 9.13193807e-04 1.02758708e-03] [-6.10798277e-04 -5.96915124e-05 -2.04204099e-04] [ 6.10798277e-04 5.96915115e-05 -2.04204097e-04] [ 2.75315900e-04 2.46508153e-04 -1.13125488e-05] [-2.75315900e-04 -2.46508154e-04 -1.13125472e-05] [ 3.17828675e-04 9.98096138e-05 7.41607383e-04] [-3.17828675e-04 -9.98096159e-05 7.41607381e-04] [-1.45989934e-03 6.09488551e-04 8.87322793e-04] [ 1.45989933e-03 -6.09488550e-04 8.87322794e-04] [-3.56670630e-04 3.99325644e-05 1.23998532e-04] [ 3.56670631e-04 -3.99325643e-05 1.23998532e-04] [-1.19230622e-04 -1.61443583e-04 -3.50460723e-04] [ 1.19230622e-04 1.61443582e-04 -3.50460721e-04] [ 1.32011753e-03 1.84134359e-04 2.82117543e-04] [-1.32011753e-03 -1.84134361e-04 2.82117544e-04] [-1.65204538e-04 9.45490481e-04 1.04329748e-04] [ 1.65204540e-04 -9.45490482e-04 1.04329749e-04] [-1.21277814e-04 8.00150175e-04 -1.18353954e-03] [ 1.21277813e-04 -8.00150171e-04 -1.18353953e-03] [-6.00041478e-04 -9.32420620e-04 -1.08276844e-03] [ 6.00041478e-04 9.32420622e-04 -1.08276844e-03] [ 1.46959980e-03 1.49696215e-04 3.06027741e-04] [-1.46959980e-03 -1.49696217e-04 3.06027741e-04] [-8.50461667e-04 -1.39981239e-04 -2.19025075e-04] [ 8.50461667e-04 1.39981238e-04 -2.19025076e-04] [-9.11459276e-04 -2.87043542e-04 -7.66867649e-05] [ 9.11459276e-04 2.87043544e-04 -7.66867642e-05] [-1.03727771e-03 1.43006990e-03 4.62533663e-04] [ 1.03727771e-03 -1.43006990e-03 4.62533662e-04] [ 6.12524183e-04 1.18040842e-03 1.08747265e-04] [-6.12524182e-04 -1.18040842e-03 1.08747265e-04] [ 5.97124407e-04 -5.35647256e-05 1.09392074e-03] [-5.97124407e-04 5.35647261e-05 1.09392074e-03] [-6.49804129e-04 -1.52315410e-04 -9.42008330e-04] [ 6.49804130e-04 1.52315411e-04 -9.42008331e-04] [-4.87296079e-04 -7.85867475e-04 -9.83372550e-04] [ 4.87296079e-04 7.85867474e-04 -9.83372549e-04] [ 3.52281122e-04 -3.84994393e-04 9.71055484e-04] [-3.52281123e-04 3.84994395e-04 9.71055483e-04] [-1.17529731e-03 9.59377110e-04 8.38809330e-04] [ 1.17529731e-03 -9.59377111e-04 8.38809329e-04] [ 9.65372539e-04 6.36401148e-04 -6.07799758e-04] [-9.65372542e-04 -6.36401148e-04 -6.07799757e-04] [-4.86114682e-04 -9.37623393e-04 -1.11658265e-03] [ 4.86114684e-04 9.37623393e-04 -1.11658265e-03] [ 1.69307416e-04 -5.80460270e-04 5.34741023e-04] [-1.69307416e-04 5.80460271e-04 5.34741023e-04] [ 1.94389338e-04 -1.96007135e-03 -1.93189643e-04] [-1.94389339e-04 1.96007135e-03 -1.93189645e-04] [-2.05314446e-03 -2.93514900e-04 -4.78115144e-04] [ 2.05314446e-03 2.93514902e-04 -4.78115141e-04] [ 1.17038063e-03 4.16008723e-04 -1.26082086e-04] [-1.17038063e-03 -4.16008723e-04 -1.26082086e-04] [-1.31239357e-03 1.45622568e-04 -3.66023253e-05] [ 1.31239357e-03 -1.45622568e-04 -3.66023254e-05] [ 1.19940765e-03 8.01426948e-04 9.96959452e-04] [-1.19940765e-03 -8.01426949e-04 9.96959452e-04] [-1.00731694e-03 5.89520324e-04 -1.61745422e-03] [ 1.00731695e-03 -5.89520326e-04 -1.61745422e-03] [-8.71385311e-05 3.22982535e-04 5.73827265e-04] [ 8.71385302e-05 -3.22982535e-04 5.73827267e-04] [ 3.16455665e-04 7.39222063e-04 -3.88857899e-04] [-3.16455667e-04 -7.39222062e-04 -3.88857898e-04] [ 8.91849571e-04 1.02278860e-03 -1.07349860e-03] [-8.91849569e-04 -1.02278861e-03 -1.07349860e-03] [-1.88043501e-03 3.75196074e-04 1.12103756e-03] [ 1.88043501e-03 -3.75196073e-04 1.12103756e-03] [ 8.71475294e-05 4.59151901e-04 -4.21188123e-04] [-8.71475291e-05 -4.59151901e-04 -4.21188123e-04] [ 6.30064915e-05 1.14999865e-04 7.85881345e-04] [-6.30064908e-05 -1.14999866e-04 7.85881343e-04] [ 4.97036967e-04 -4.78751893e-04 1.74307374e-04] [-4.97036967e-04 4.78751893e-04 1.74307373e-04] [-5.78129538e-04 1.21053238e-05 -2.34029387e-05] [ 5.78129538e-04 -1.21053223e-05 -2.34029409e-05] [ 9.69765540e-04 2.31282902e-04 -2.87517617e-04] [-9.69765540e-04 -2.31282903e-04 -2.87517617e-04] [-4.40307193e-04 8.90261993e-04 -6.03916786e-04] [ 4.40307194e-04 -8.90261992e-04 -6.03916786e-04] [-3.02923361e-04 -3.43392570e-05 8.09684532e-06] [ 3.02923361e-04 3.43392622e-05 8.09684673e-06] [ 1.35573379e-03 -2.70410217e-05 -6.68351722e-05] [-1.35573378e-03 2.70410217e-05 -6.68351724e-05] [-1.71582792e-03 -2.65657718e-04 2.06439768e-04] [ 1.71582792e-03 2.65657716e-04 2.06439769e-04] [-2.44643598e-05 -6.00312846e-04 -2.39778816e-05] [ 2.44643608e-05 6.00312845e-04 -2.39778829e-05] [ 7.90370752e-04 -3.39537814e-05 -6.74265883e-04] [-7.90370754e-04 3.39537841e-05 -6.74265882e-04] [-1.10869969e-03 -5.96518451e-04 -1.05764902e-04] [ 1.10869969e-03 5.96518452e-04 -1.05764903e-04] [-1.76232221e-03 -1.73561155e-03 6.87599613e-04] [ 1.76232221e-03 1.73561155e-03 6.87599610e-04] [ 9.61290679e-04 -4.58711039e-04 7.27068536e-04] [-9.61290678e-04 4.58711038e-04 7.27068541e-04]] Final stress: [ 6.56975232e-08 -3.86904088e-06 -5.88725010e-06 -6.81214447e-16 6.40580603e-16 -2.00033852e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.63069303e-04 -2.59136797e-03 -5.40089196e-04] [ 5.63069302e-04 2.59136796e-03 -5.40089194e-04] [-5.69582818e-04 3.93960574e-04 2.05720924e-04] [ 5.69582818e-04 -3.93960571e-04 2.05720924e-04] [-1.05329806e-03 -1.58088325e-04 4.67190825e-05] [ 1.05329806e-03 1.58088325e-04 4.67190808e-05] [ 1.82109908e-03 -2.07908255e-04 -1.91194526e-04] [-1.82109908e-03 2.07908253e-04 -1.91194530e-04] [ 7.16983107e-04 -7.37265418e-05 8.42565132e-05] [-7.16983106e-04 7.37265397e-05 8.42565158e-05] [-3.16342582e-04 3.11246562e-04 -2.84982606e-04] [ 3.16342582e-04 -3.11246560e-04 -2.84982603e-04] [-3.63286122e-04 7.87718350e-05 3.80867942e-04] [ 3.63286122e-04 -7.87718388e-05 3.80867937e-04] [ 1.47542176e-03 1.41209464e-03 5.44523862e-04] [-1.47542176e-03 -1.41209463e-03 5.44523865e-04] [ 2.68644971e-04 -5.59031654e-05 1.36729935e-04] [-2.68644972e-04 5.59031646e-05 1.36729933e-04] [ 5.32506641e-04 -4.07703361e-04 -2.64749397e-04] [-5.32506640e-04 4.07703359e-04 -2.64749396e-04] [-1.32093430e-03 9.17058714e-05 2.56009849e-04] [ 1.32093430e-03 -9.17058697e-05 2.56009846e-04] [ 4.35121510e-04 -9.27135599e-04 -3.24861814e-04] [-4.35121509e-04 9.27135582e-04 -3.24861807e-04] [ 4.96653757e-04 3.71142928e-04 -1.05281495e-03] [-4.96653758e-04 -3.71142916e-04 -1.05281493e-03] [ 8.13116113e-04 -5.39990091e-04 -1.04729214e-03] [-8.13116112e-04 5.39990091e-04 -1.04729213e-03] [-1.68942676e-03 2.57692760e-04 1.13893812e-04] [ 1.68942676e-03 -2.57692761e-04 1.13893812e-04] [ 5.60069948e-04 -7.96588198e-05 -3.35699035e-04] [-5.60069948e-04 7.96588185e-05 -3.35699038e-04] [ 1.07321550e-03 7.49450724e-05 2.21394734e-04] [-1.07321551e-03 -7.49450678e-05 2.21394732e-04] [ 8.41773133e-04 -1.36389634e-03 -4.38636839e-05] [-8.41773130e-04 1.36389634e-03 -4.38636823e-05] [-1.15171804e-03 -1.68860116e-03 4.56545381e-04] [ 1.15171804e-03 1.68860115e-03 4.56545379e-04] [-5.69297588e-04 -3.88746631e-04 -3.51547521e-04] [ 5.69297589e-04 3.88746628e-04 -3.51547522e-04] [ 5.63909221e-04 3.71678191e-04 1.55401267e-03] [-5.63909224e-04 -3.71678192e-04 1.55401267e-03] [ 5.43431763e-04 1.91037698e-04 1.26615214e-03] [-5.43431760e-04 -1.91037697e-04 1.26615214e-03] [-6.61561887e-04 8.49860657e-04 -1.25810809e-03] [ 6.61561884e-04 -8.49860654e-04 -1.25810809e-03] [ 1.65635573e-03 -1.20380836e-03 -1.21822748e-03] [-1.65635573e-03 1.20380836e-03 -1.21822748e-03] [-1.88592074e-03 -6.15725381e-04 2.26864648e-04] [ 1.88592074e-03 6.15725378e-04 2.26864648e-04] [ 1.47773283e-04 7.46371187e-04 7.44994256e-04] [-1.47773283e-04 -7.46371185e-04 7.44994256e-04] [-5.79599699e-04 8.38944443e-04 -1.19448555e-03] [ 5.79599699e-04 -8.38944444e-04 -1.19448555e-03] [-2.05344354e-03 7.25206459e-04 -4.65829766e-04] [ 2.05344354e-03 -7.25206459e-04 -4.65829768e-04] [ 6.29142928e-04 1.35542164e-03 1.51691900e-04] [-6.29142928e-04 -1.35542163e-03 1.51691902e-04] [-1.52452982e-03 -4.40789218e-04 -7.10490507e-05] [ 1.52452982e-03 4.40789219e-04 -7.10490520e-05] [ 1.31262342e-03 -6.49379275e-04 9.33095996e-06] [-1.31262343e-03 6.49379275e-04 9.33096001e-06] [-8.02094474e-04 -1.09533707e-03 -1.77617978e-03] [ 8.02094469e-04 1.09533707e-03 -1.77617978e-03] [ 3.99808979e-04 -2.53039092e-04 2.19357606e-03] [-3.99808974e-04 2.53039091e-04 2.19357606e-03] [ 1.59513562e-04 -6.23382165e-04 -2.24067357e-04] [-1.59513564e-04 6.23382165e-04 -2.24067353e-04] [ 1.58279799e-04 -2.48622918e-04 3.39854850e-04] [-1.58279799e-04 2.48622917e-04 3.39854847e-04] [-1.96525799e-03 -4.10903015e-04 1.21259907e-03] [ 1.96525799e-03 4.10903017e-04 1.21259907e-03] [ 8.99079280e-04 -1.33822021e-03 -1.24063307e-03] [-8.99079284e-04 1.33822021e-03 -1.24063307e-03] [ 3.92412700e-04 -2.38453676e-04 6.48319013e-04] [-3.92412701e-04 2.38453675e-04 6.48319013e-04] [ 1.60909268e-04 -5.76630200e-04 -8.36631972e-04] [-1.60909266e-04 5.76630198e-04 -8.36631971e-04] [-7.31587901e-04 -3.43936544e-04 1.42051484e-04] [ 7.31587903e-04 3.43936538e-04 1.42051481e-04] [ 9.30991832e-04 -7.67426389e-05 4.10680377e-05] [-9.30991831e-04 7.67426387e-05 4.10680391e-05] [-1.04356036e-03 2.37844065e-04 -3.51675702e-04] [ 1.04356035e-03 -2.37844064e-04 -3.51675702e-04] [ 4.69496711e-04 2.92052443e-04 -5.83844040e-06] [-4.69496711e-04 -2.92052441e-04 -5.83843856e-06] [-1.04040895e-03 1.71575639e-03 1.11259641e-04] [ 1.04040895e-03 -1.71575638e-03 1.11259639e-04] [-1.37761583e-03 -1.05859451e-04 -3.36945890e-05] [ 1.37761583e-03 1.05859450e-04 -3.36945899e-05] [ 2.13641537e-03 -3.49090484e-04 1.68740479e-04] [-2.13641537e-03 3.49090486e-04 1.68740477e-04] [-4.16623232e-04 9.71086678e-04 5.79250987e-05] [ 4.16623234e-04 -9.71086665e-04 5.79250991e-05] [-1.38526062e-03 9.52459133e-04 4.67224263e-04] [ 1.38526062e-03 -9.52459132e-04 4.67224261e-04] [ 8.79317973e-04 -2.09844621e-04 4.92171912e-06] [-8.79317970e-04 2.09844624e-04 4.92172035e-06] [ 1.21765793e-03 9.24167777e-04 9.33197742e-04] [-1.21765793e-03 -9.24167776e-04 9.33197730e-04] [-1.52755755e-03 1.37440690e-03 3.93069649e-04] [ 1.52755755e-03 -1.37440690e-03 3.93069660e-04]] Final stress: [-2.03508451e-06 -2.25541353e-06 -7.25222469e-06 6.59582901e-15 -7.81603945e-16 2.49663646e-05] Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 16 steps. Minimization converged after 19 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.09370924e-03 5.82106449e-04 3.64770627e-05] [-1.09370925e-03 -5.82106445e-04 3.64770620e-05] [ 1.11911836e-03 1.55468682e-04 -1.82698670e-05] [-1.11911836e-03 -1.55468682e-04 -1.82698636e-05] [ 1.54627384e-03 -4.41740170e-04 2.47163941e-04] [-1.54627384e-03 4.41740169e-04 2.47163943e-04] [-2.88689397e-03 -8.81784424e-04 1.06607172e-03] [ 2.88689396e-03 8.81784424e-04 1.06607172e-03] [-9.56257311e-04 5.85216758e-05 -1.38409273e-04] [ 9.56257309e-04 -5.85216664e-05 -1.38409283e-04] [ 4.62421116e-04 4.13383992e-04 -1.32965684e-04] [-4.62421117e-04 -4.13383994e-04 -1.32965689e-04] [-1.45398653e-05 2.00132240e-04 7.82638558e-04] [ 1.45398634e-05 -2.00132235e-04 7.82638566e-04] [-3.20947832e-03 8.77193094e-04 1.58951782e-03] [ 3.20947832e-03 -8.77193097e-04 1.58951782e-03] [-4.50469050e-04 1.59458330e-04 3.85502431e-05] [ 4.50469049e-04 -1.59458333e-04 3.85502375e-05] [-1.08102589e-04 -3.62256824e-04 -2.14513526e-04] [ 1.08102593e-04 3.62256823e-04 -2.14513531e-04] [ 2.77505090e-03 2.63295719e-04 2.41861880e-04] [-2.77505090e-03 -2.63295720e-04 2.41861880e-04] [-8.05572068e-04 1.12656152e-03 2.01854444e-04] [ 8.05572069e-04 -1.12656150e-03 2.01854438e-04] [-5.52998755e-04 3.72220411e-04 -1.06423145e-03] [ 5.52998758e-04 -3.72220410e-04 -1.06423145e-03] [-7.02094937e-04 -1.44450754e-03 -1.76483604e-03] [ 7.02094936e-04 1.44450753e-03 -1.76483604e-03] [ 2.52050472e-03 3.66837224e-04 7.48540166e-04] [-2.52050473e-03 -3.66837222e-04 7.48540165e-04] [-8.29064276e-04 -3.41220074e-04 -4.38757710e-04] [ 8.29064276e-04 3.41220077e-04 -4.38757709e-04] [-1.86477891e-03 -7.07379535e-04 -2.05830893e-04] [ 1.86477891e-03 7.07379533e-04 -2.05830894e-04] [-2.10641588e-03 2.39139946e-03 5.20024854e-04] [ 2.10641588e-03 -2.39139946e-03 5.20024854e-04] [ 1.19791879e-03 2.27803782e-03 4.21962508e-04] [-1.19791880e-03 -2.27803782e-03 4.21962501e-04] [ 6.85466769e-04 -1.87694836e-04 2.15743270e-03] [-6.85466770e-04 1.87694837e-04 2.15743270e-03] [-1.06566946e-03 -2.28813746e-04 -1.76994092e-03] [ 1.06566945e-03 2.28813746e-04 -1.76994091e-03] [-9.42814654e-04 -1.95625328e-03 -1.91358168e-03] [ 9.42814656e-04 1.95625328e-03 -1.91358168e-03] [ 7.80801615e-04 -7.87038904e-04 1.92697898e-03] [-7.80801613e-04 7.87038902e-04 1.92697898e-03] [-1.89753622e-03 1.94304640e-03 1.74825509e-03] [ 1.89753622e-03 -1.94304641e-03 1.74825509e-03] [ 1.75217081e-03 1.11791259e-03 -1.21345709e-03] [-1.75217081e-03 -1.11791258e-03 -1.21345709e-03] [-6.75614653e-04 -1.33452608e-03 -1.77814913e-03] [ 6.75614652e-04 1.33452607e-03 -1.77814913e-03] [ 2.59109328e-05 -9.57527578e-04 8.91467208e-04] [-2.59109283e-05 9.57527573e-04 8.91467207e-04] [ 6.20121976e-04 -2.70164220e-03 1.56384895e-04] [-6.20121972e-04 2.70164220e-03 1.56384899e-04] [-3.22280545e-03 -8.63739145e-04 -7.26672960e-04] [ 3.22280545e-03 8.63739148e-04 -7.26672965e-04] [ 2.11583604e-03 7.77902309e-04 -2.99575551e-04] [-2.11583604e-03 -7.77902305e-04 -2.99575551e-04] [-2.23880706e-03 1.06464305e-05 8.12914479e-05] [ 2.23880706e-03 -1.06464285e-05 8.12914470e-05] [ 1.18216299e-03 1.20412494e-03 2.48320465e-03] [-1.18216300e-03 -1.20412495e-03 2.48320465e-03] [-1.31660504e-03 7.84921269e-04 -3.67378447e-03] [ 1.31660505e-03 -7.84921267e-04 -3.67378447e-03] [ 9.97991927e-05 4.20321927e-04 1.33771766e-03] [-9.97991929e-05 -4.20321928e-04 1.33771766e-03] [ 6.64997097e-04 1.11259294e-03 -5.98064413e-04] [-6.64997093e-04 -1.11259294e-03 -5.98064415e-04] [ 2.00239741e-03 1.59949575e-03 -1.92767945e-03] [-2.00239741e-03 -1.59949574e-03 -1.92767945e-03] [-3.29559454e-03 1.18016520e-03 1.64429314e-03] [ 3.29559454e-03 -1.18016520e-03 1.64429314e-03] [ 4.76770923e-04 6.35202143e-04 -1.21668743e-03] [-4.76770923e-04 -6.35202144e-04 -1.21668743e-03] [ 7.10874811e-05 9.09696028e-05 1.27984603e-03] [-7.10874780e-05 -9.09696032e-05 1.27984603e-03] [ 1.26098813e-03 -2.67801241e-04 -3.15157215e-05] [-1.26098813e-03 2.67801241e-04 -3.15157233e-05] [-9.54574955e-04 6.72282828e-05 5.59824806e-05] [ 9.54574958e-04 -6.72282863e-05 5.59824792e-05] [ 1.37656736e-03 4.33216986e-04 -6.67985711e-04] [-1.37656736e-03 -4.33216982e-04 -6.67985713e-04] [-1.07878684e-03 9.63103768e-04 -6.54177007e-04] [ 1.07878684e-03 -9.63103769e-04 -6.54177001e-04] [ 6.10487415e-05 -8.77973848e-04 -1.61054795e-04] [-6.10487399e-05 8.77973849e-04 -1.61054795e-04] [ 2.20276457e-03 -1.09268291e-04 -2.52546019e-04] [-2.20276457e-03 1.09268286e-04 -2.52546013e-04] [-3.10006871e-03 -5.15008551e-04 3.58039882e-04] [ 3.10006871e-03 5.15008553e-04 3.58039881e-04] [ 2.43046366e-04 -4.66279948e-04 9.54614064e-05] [-2.43046360e-04 4.66279946e-04 9.54614108e-05] [ 1.43728228e-03 -2.38218599e-04 -1.18742129e-03] [-1.43728227e-03 2.38218597e-04 -1.18742129e-03] [-1.52000128e-03 -8.11405994e-04 5.02434639e-04] [ 1.52000128e-03 8.11405995e-04 5.02434638e-04] [-2.64484400e-03 -2.58508361e-03 3.37251638e-04] [ 2.64484399e-03 2.58508361e-03 3.37251641e-04] [ 1.74468926e-03 -9.65580745e-04 1.09940304e-03] [-1.74468925e-03 9.65580738e-04 1.09940303e-03]] Final stress: [-6.19190596e-06 1.66631803e-06 -1.75439843e-05 6.88743658e-15 -3.63553394e-15 -4.25688786e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.67275366e-03 -9.10696641e-03 -2.21651118e-03] [ 1.67275366e-03 9.10696627e-03 -2.21651113e-03] [-2.72776118e-03 2.29892647e-03 3.20458938e-04] [ 2.72776117e-03 -2.29892646e-03 3.20458915e-04] [-3.78970000e-03 -1.14516581e-03 1.47278407e-04] [ 3.78969999e-03 1.14516582e-03 1.47278414e-04] [ 9.44506887e-03 3.58913041e-03 -6.30330647e-03] [-9.44506886e-03 -3.58913034e-03 -6.30330639e-03] [ 3.72089353e-03 2.81303235e-04 1.96028292e-03] [-3.72089353e-03 -2.81303238e-04 1.96028290e-03] [-1.07069869e-03 1.42268174e-03 -1.95108466e-03] [ 1.07069870e-03 -1.42268174e-03 -1.95108465e-03] [-4.78500931e-04 5.24615857e-04 -4.92595062e-04] [ 4.78500928e-04 -5.24615885e-04 -4.92595116e-04] [ 7.24595899e-03 6.67252767e-03 2.35847771e-03] [-7.24595900e-03 -6.67252767e-03 2.35847776e-03] [-4.68514146e-04 -4.61612651e-04 5.26786366e-05] [ 4.68514137e-04 4.61612651e-04 5.26786551e-05] [ 2.83748965e-03 -2.38896035e-03 5.01709428e-04] [-2.83748965e-03 2.38896034e-03 5.01709398e-04] [-6.03227824e-03 -8.29009593e-05 -6.43304203e-04] [ 6.03227823e-03 8.29009626e-05 -6.43304200e-04] [ 4.50190267e-03 -7.39453328e-03 -2.09220844e-03] [-4.50190266e-03 7.39453318e-03 -2.09220841e-03] [ 2.32908785e-03 -3.65964062e-03 1.29382304e-03] [-2.32908785e-03 3.65964067e-03 1.29382309e-03] [ 2.19498526e-03 -2.19939221e-03 -4.49262454e-03] [-2.19498526e-03 2.19939222e-03 -4.49262451e-03] [-7.37506413e-03 1.90587343e-03 4.01536381e-04] [ 7.37506413e-03 -1.90587343e-03 4.01536366e-04] [ 7.06418442e-04 -6.85397187e-04 -1.51012123e-03] [-7.06418440e-04 6.85397188e-04 -1.51012124e-03] [ 4.45765300e-03 -5.96388073e-04 1.24050964e-03] [-4.45765300e-03 5.96388103e-04 1.24050962e-03] [ 2.24247505e-03 -5.01565910e-03 9.72447526e-04] [-2.24247505e-03 5.01565911e-03 9.72447530e-04] [-5.50039876e-03 -5.14468193e-03 -1.61832540e-04] [ 5.50039876e-03 5.14468193e-03 -1.61832549e-04] [-4.05601368e-04 -1.14339517e-03 -2.24281214e-03] [ 4.05601394e-04 1.14339514e-03 -2.24281216e-03] [-7.84891942e-04 3.52353689e-03 8.95586210e-03] [ 7.84891914e-04 -3.52353692e-03 8.95586211e-03] [ 2.77874584e-03 8.21322428e-04 5.92605243e-03] [-2.77874584e-03 -8.21322428e-04 5.92605242e-03] [-3.57235869e-03 5.70230558e-03 -4.90544235e-03] [ 3.57235869e-03 -5.70230557e-03 -4.90544234e-03] [ 1.04767003e-02 -5.73744137e-03 -5.62129399e-03] [-1.04767003e-02 5.73744136e-03 -5.62129395e-03] [-9.73464427e-03 -3.63767794e-03 1.35665228e-03] [ 9.73464430e-03 3.63767792e-03 1.35665224e-03] [ 3.17659666e-04 3.89258775e-03 3.76876754e-03] [-3.17659661e-04 -3.89258773e-03 3.76876755e-03] [-3.48168571e-03 2.94026902e-03 -4.50647212e-03] [ 3.48168570e-03 -2.94026901e-03 -4.50647214e-03] [-6.21243766e-03 4.51204198e-03 -1.35998542e-03] [ 6.21243770e-03 -4.51204194e-03 -1.35998546e-03] [ 1.60802637e-03 2.87084720e-03 2.77625337e-03] [-1.60802639e-03 -2.87084719e-03 2.77625338e-03] [-4.92255984e-03 -9.62104229e-04 -1.97303146e-04] [ 4.92255983e-03 9.62104236e-04 -1.97303158e-04] [ 4.16011092e-03 -2.36418478e-03 5.79044630e-05] [-4.16011091e-03 2.36418479e-03 5.79044694e-05] [-2.48972374e-03 -1.47243112e-03 -1.24112027e-02] [ 2.48972372e-03 1.47243109e-03 -1.24112028e-02] [-1.11853206e-03 2.37066890e-03 1.37569265e-02] [ 1.11853208e-03 -2.37066893e-03 1.37569266e-02] [ 2.53050097e-03 -4.48298708e-04 1.21545310e-03] [-2.53050097e-03 4.48298709e-04 1.21545311e-03] [ 1.23197650e-03 1.20654456e-03 1.11730018e-03] [-1.23197651e-03 -1.20654457e-03 1.11730017e-03] [-7.42687593e-03 -3.29048891e-03 2.05404624e-03] [ 7.42687595e-03 3.29048889e-03 2.05404624e-03] [ 3.15994188e-03 -5.39303131e-03 -4.00939778e-03] [-3.15994184e-03 5.39303133e-03 -4.00939776e-03] [ 2.38134590e-03 3.28811572e-04 2.04858231e-03] [-2.38134589e-03 -3.28811575e-04 2.04858234e-03] [ 2.06006629e-03 -1.28846505e-03 -5.69150643e-03] [-2.06006630e-03 1.28846506e-03 -5.69150645e-03] [-5.30204163e-03 1.19786369e-03 -8.92216865e-04] [ 5.30204161e-03 -1.19786371e-03 -8.92216881e-04] [ 6.90538698e-03 -1.80041549e-04 5.53235221e-04] [-6.90538698e-03 1.80041544e-04 5.53235227e-04] [-2.34669459e-03 1.28663749e-03 -2.24294412e-03] [ 2.34669459e-03 -1.28663749e-03 -2.24294411e-03] [ 2.98373646e-03 -1.71985131e-03 2.51929525e-03] [-2.98373648e-03 1.71985126e-03 2.51929521e-03] [-1.15448886e-02 3.29147635e-03 -1.90526597e-04] [ 1.15448886e-02 -3.29147624e-03 -1.90526602e-04] [-7.91974644e-03 -7.94588920e-04 -4.27209494e-04] [ 7.91974644e-03 7.94588920e-04 -4.27209481e-04] [ 7.88315700e-03 -1.77918670e-03 9.72756919e-04] [-7.88315700e-03 1.77918672e-03 9.72756925e-04] [-2.92972189e-03 8.59010631e-03 7.62475223e-04] [ 2.92972187e-03 -8.59010623e-03 7.62475225e-04] [-4.94165051e-03 3.82425468e-03 4.63826781e-03] [ 4.94165051e-03 -3.82425466e-03 4.63826776e-03] [ 4.32261581e-03 -2.30560316e-04 1.86643682e-03] [-4.32261582e-03 2.30560319e-04 1.86643689e-03] [ 5.56932983e-03 4.87813936e-03 2.77700023e-03] [-5.56932983e-03 -4.87813938e-03 2.77700017e-03] [-4.28585858e-03 4.28988038e-03 -1.81056919e-03] [ 4.28585858e-03 -4.28988037e-03 -1.81056913e-03]] Final stress: [-4.83578996e-05 3.18346388e-05 -3.87801991e-05 -1.24805657e-14 1.01082663e-14 1.08623103e-04] Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 16 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.41620171e-04 -6.09937676e-04 -1.32130668e-04] [-2.41620169e-04 6.09937656e-04 -1.32130665e-04] [ 2.91994352e-04 2.54426923e-04 1.39168046e-04] [-2.91994353e-04 -2.54426919e-04 1.39168044e-04] [ 6.45432998e-04 -9.18704358e-05 5.23331256e-05] [-6.45432998e-04 9.18704350e-05 5.23331264e-05] [-9.37299821e-04 5.74590165e-04 -8.61083838e-04] [ 9.37299821e-04 -5.74590162e-04 -8.61083837e-04] [-4.53413130e-04 3.91041865e-05 2.46979943e-04] [ 4.53413128e-04 -3.91041855e-05 2.46979947e-04] [ 1.57179061e-04 8.86386069e-05 -2.41037806e-04] [-1.57179061e-04 -8.86386054e-05 -2.41037802e-04] [-2.35700712e-04 3.56061409e-05 -1.99122044e-04] [ 2.35700714e-04 -3.56061417e-05 -1.99122048e-04] [-9.31488039e-04 6.22527216e-04 2.20947429e-04] [ 9.31488038e-04 -6.22527209e-04 2.20947428e-04] [ 3.68730292e-04 2.29470752e-05 -6.70947760e-06] [-3.68730292e-04 -2.29470766e-05 -6.70947816e-06] [-5.80968010e-04 -2.45992174e-04 1.79077441e-04] [ 5.80968010e-04 2.45992172e-04 1.79077440e-04] [ 9.24813062e-04 -3.89267607e-05 -1.34977378e-04] [-9.24813063e-04 3.89267597e-05 -1.34977376e-04] [-7.48772720e-04 -8.84197648e-04 -1.97733966e-04] [ 7.48772721e-04 8.84197637e-04 -1.97733962e-04] [-2.18261497e-04 -5.68495242e-04 4.47959159e-04] [ 2.18261498e-04 5.68495249e-04 4.47959162e-04] [-1.97606522e-04 -2.05688665e-04 -3.42785269e-04] [ 1.97606522e-04 2.05688662e-04 -3.42785267e-04] [ 4.62437509e-04 9.32687151e-05 2.49627404e-04] [-4.62437506e-04 -9.32687153e-05 2.49627403e-04] [ 3.71833598e-04 -3.23319750e-05 -1.71416867e-04] [-3.71833596e-04 3.23319742e-05 -1.71416865e-04] [-6.44714074e-04 -7.99229078e-05 8.81582557e-05] [ 6.44714073e-04 7.99229107e-05 8.81582522e-05] [-4.00445904e-04 5.23422205e-04 -6.86845509e-05] [ 4.00445905e-04 -5.23422203e-04 -6.86845511e-05] [ 3.63096327e-04 6.35811919e-04 1.45765944e-04] [-3.63096329e-04 -6.35811918e-04 1.45765945e-04] [-9.96341838e-05 -5.37274429e-04 1.03287534e-03] [ 9.96341823e-05 5.37274426e-04 1.03287533e-03] [-1.71287463e-04 3.11348757e-06 -3.13664478e-04] [ 1.71287464e-04 -3.11349212e-06 -3.13664474e-04] [-3.81817993e-04 -7.45292329e-04 -7.38852984e-04] [ 3.81817992e-04 7.45292329e-04 -7.38852984e-04] [ 3.87278807e-04 -2.44214450e-04 5.50874509e-04] [-3.87278809e-04 2.44214452e-04 5.50874511e-04] [-7.79873802e-04 4.99590987e-04 2.11829738e-04] [ 7.79873809e-04 -4.99590990e-04 2.11829744e-04] [ 8.92767865e-04 6.48322648e-04 -6.26396943e-04] [-8.92767858e-04 -6.48322652e-04 -6.26396948e-04] [-1.40989165e-04 -4.32740132e-05 -5.21979657e-04] [ 1.40989166e-04 4.32740136e-05 -5.21979657e-04] [ 4.95440300e-05 -1.91223885e-04 4.37206252e-04] [-4.95440311e-05 1.91223886e-04 4.37206252e-04] [ 6.64532343e-06 -1.46804501e-04 2.84500420e-04] [-6.64532419e-06 1.46804504e-04 2.84500418e-04] [-1.28776246e-04 -7.56299357e-04 -1.94726108e-05] [ 1.28776243e-04 7.56299363e-04 -1.94726068e-05] [ 6.23454709e-04 3.70991605e-04 1.43553220e-04] [-6.23454708e-04 -3.70991605e-04 1.43553220e-04] [-6.20949717e-04 1.32761735e-04 5.01089569e-06] [ 6.20949715e-04 -1.32761734e-04 5.01089602e-06] [-2.92369788e-04 3.94715487e-05 1.60785827e-03] [ 2.92369781e-04 -3.94715545e-05 1.60785826e-03] [-2.62612396e-04 2.87090398e-04 -1.52664092e-03] [ 2.62612397e-04 -2.87090403e-04 -1.52664091e-03] [ 3.73462323e-04 -2.72341247e-04 6.98566300e-05] [-3.73462324e-04 2.72341249e-04 6.98566282e-05] [ 1.34976237e-04 -1.53171160e-04 3.96074452e-04] [-1.34976235e-04 1.53171160e-04 3.96074452e-04] [ 7.20168453e-04 3.44272108e-04 -4.30623595e-04] [-7.20168451e-04 -3.44272113e-04 -4.30623592e-04] [-8.52742591e-04 5.54314232e-04 1.14724261e-04] [ 8.52742593e-04 -5.54314231e-04 1.14724263e-04] [ 2.83169705e-04 1.67943822e-04 -9.39737369e-04] [-2.83169706e-04 -1.67943825e-04 -9.39737369e-04] [ 3.12488274e-04 6.15483256e-05 2.91919942e-04] [-3.12488272e-04 -6.15483280e-05 2.91919941e-04] [ 7.95979426e-04 3.75247694e-04 -3.54248253e-04] [-7.95979429e-04 -3.75247696e-04 -3.54248252e-04] [-1.02121717e-03 1.96201618e-05 8.55935290e-05] [ 1.02121717e-03 -1.96201609e-05 8.55935283e-05] [ 6.98446035e-05 1.59654262e-04 -2.62105005e-04] [-6.98446030e-05 -1.59654262e-04 -2.62105003e-04] [-9.77468718e-05 -4.73222127e-04 4.90373275e-04] [ 9.77468733e-05 4.73222125e-04 4.90373274e-04] [ 1.18104841e-03 2.51761862e-04 9.19953918e-06] [-1.18104841e-03 -2.51761847e-04 9.19953771e-06] [ 1.09224688e-03 -1.03325136e-04 -1.10609106e-04] [-1.09224688e-03 1.03325136e-04 -1.10609107e-04] [-1.17823568e-03 -2.67695264e-04 9.71706064e-05] [ 1.17823568e-03 2.67695263e-04 9.71706067e-05] [ 6.38485790e-05 9.73449999e-04 1.03158061e-04] [-6.38485820e-05 -9.73449987e-04 1.03158060e-04] [ 4.80848500e-04 -2.41731816e-04 1.07210036e-04] [-4.80848505e-04 2.41731820e-04 1.07210035e-04] [-2.27547018e-04 -3.98600795e-04 7.25281299e-04] [ 2.27547018e-04 3.98600796e-04 7.25281303e-04] [-3.65241875e-04 -5.08855587e-04 -4.12891700e-04] [ 3.65241875e-04 5.08855588e-04 -4.12891705e-04] [ 7.60027032e-04 -8.38337859e-04 7.86174577e-05] [-7.60027033e-04 8.38337858e-04 7.86174623e-05]] Final stress: [-5.80037503e-06 2.88356558e-06 -1.39315610e-05 5.30391177e-15 -1.75203575e-15 -1.55993531e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-2.62285893e-04 -1.17758554e-03 -2.72524600e-04] [ 2.62285891e-04 1.17758551e-03 -2.72524587e-04] [-4.14528684e-04 6.07427065e-04 2.72314796e-04] [ 4.14528683e-04 -6.07427062e-04 2.72314789e-04] [-1.34991455e-03 -1.97076802e-04 9.69399853e-05] [ 1.34991455e-03 1.97076804e-04 9.69399925e-05] [ 1.94093706e-03 1.37897141e-03 -1.98397632e-03] [-1.94093706e-03 -1.37897138e-03 -1.98397630e-03] [ 1.28966296e-03 1.10993687e-04 5.88558469e-04] [-1.28966296e-03 -1.10993694e-04 5.88558468e-04] [-3.40380638e-04 1.99999591e-04 -5.24795538e-04] [ 3.40380639e-04 -1.99999595e-04 -5.24795539e-04] [ 4.88875946e-04 1.29516470e-04 -4.49281931e-04] [-4.88875948e-04 -1.29516475e-04 -4.49281931e-04] [ 2.37281529e-03 1.33852123e-03 5.53570712e-04] [-2.37281528e-03 -1.33852123e-03 5.53570729e-04] [-7.92855737e-04 3.19221947e-05 -3.72266044e-05] [ 7.92855741e-04 -3.19222003e-05 -3.72266072e-05] [ 7.93142798e-04 -5.80493040e-04 4.33464997e-04] [-7.93142798e-04 5.80493037e-04 4.33464987e-04] [-2.07735185e-03 -6.01574347e-05 -3.37056523e-04] [ 2.07735185e-03 6.01574258e-05 -3.37056515e-04] [ 1.27370855e-03 -2.08054759e-03 -4.57428723e-04] [-1.27370855e-03 2.08054755e-03 -4.57428714e-04] [ 6.07384996e-04 -1.41200222e-03 1.08863454e-03] [-6.07385000e-04 1.41200223e-03 1.08863453e-03] [ 1.67572659e-04 -4.16336703e-04 -8.11002042e-04] [-1.67572662e-04 4.16336713e-04 -8.11002053e-04] [-9.97438623e-04 2.82547206e-04 4.44662733e-04] [ 9.97438623e-04 -2.82547204e-04 4.44662732e-04] [-9.27248850e-04 -1.28143390e-04 -3.32424278e-04] [ 9.27248848e-04 1.28143386e-04 -3.32424279e-04] [ 8.51573631e-04 -2.62721988e-04 1.98786105e-04] [-8.51573626e-04 2.62721996e-04 1.98786101e-04] [ 6.94756374e-04 -1.44970753e-03 1.95662084e-04] [-6.94756370e-04 1.44970753e-03 1.95662083e-04] [-9.07320816e-04 -1.23259684e-03 -7.90024977e-05] [ 9.07320814e-04 1.23259684e-03 -7.90024983e-05] [-5.17559347e-04 -5.60993948e-05 -5.24143362e-04] [ 5.17559366e-04 5.60993811e-05 -5.24143381e-04] [-3.32703494e-05 1.20373312e-03 2.12287584e-03] [ 3.32703454e-05 -1.20373314e-03 2.12287585e-03] [ 8.38863899e-04 5.85229293e-04 1.02201890e-03] [-8.38863898e-04 -5.85229292e-04 1.02201889e-03] [-8.28616945e-04 1.68316900e-03 -1.31176238e-03] [ 8.28616947e-04 -1.68316899e-03 -1.31176238e-03] [ 2.10895343e-03 -1.48972060e-03 -7.61708321e-04] [-2.10895344e-03 1.48972059e-03 -7.61708301e-04] [-1.75867394e-03 -1.17300034e-03 -1.39084269e-04] [ 1.75867393e-03 1.17300034e-03 -1.39084276e-04] [ 1.47445771e-04 2.76235346e-04 8.52788351e-04] [-1.47445771e-04 -2.76235343e-04 8.52788356e-04] [-4.56674257e-04 -5.13899750e-05 -9.64710062e-04] [ 4.56674258e-04 5.13899751e-05 -9.64710065e-04] [ 2.64948302e-05 2.00680329e-03 3.05780614e-04] [-2.64948286e-05 -2.00680328e-03 3.05780611e-04] [-2.85500047e-04 5.82126206e-04 3.84510487e-04] [ 2.85500046e-04 -5.82126198e-04 3.84510489e-04] [-1.19454492e-03 -1.22405917e-05 -4.25775117e-05] [ 1.19454492e-03 1.22405942e-05 -4.25775073e-05] [ 1.20393924e-03 -5.10687940e-04 2.89800847e-04] [-1.20393923e-03 5.10687945e-04 2.89800842e-04] [-3.35214960e-04 -3.32506967e-04 -3.04832659e-03] [ 3.35214958e-04 3.32506958e-04 -3.04832661e-03] [-8.49009538e-04 1.57709791e-04 3.19674761e-03] [ 8.49009542e-04 -1.57709802e-04 3.19674761e-03] [ 5.08053065e-04 5.36817471e-05 8.30904462e-04] [-5.08053060e-04 -5.36817528e-05 8.30904461e-04] [ 6.69374602e-04 3.55862813e-04 2.11295329e-04] [-6.69374603e-04 -3.55862809e-04 2.11295334e-04] [-1.73329133e-03 -1.16467053e-03 2.29238968e-04] [ 1.73329132e-03 1.16467054e-03 2.29238962e-04] [ 1.44006537e-03 -6.30593215e-04 -1.00925153e-03] [-1.44006538e-03 6.30593203e-04 -1.00925154e-03] [ 6.19427681e-04 -8.10863684e-05 5.26201293e-04] [-6.19427679e-04 8.10863726e-05 5.26201298e-04] [ 7.40204171e-04 -3.56164903e-04 -1.97413522e-03] [-7.40204179e-04 3.56164907e-04 -1.97413522e-03] [-1.64836649e-03 9.08130594e-04 -8.01854251e-04] [ 1.64836651e-03 -9.08130591e-04 -8.01854246e-04] [ 2.19153867e-03 1.41045927e-05 2.05347006e-04] [-2.19153866e-03 -1.41045915e-05 2.05347002e-04] [-3.42813014e-04 3.70000098e-04 -6.05632644e-04] [ 3.42813012e-04 -3.70000096e-04 -6.05632649e-04] [ 4.11143154e-05 -1.09363101e-03 1.11197638e-03] [-4.11143149e-05 1.09363100e-03 1.11197636e-03] [-2.64802215e-03 2.66802893e-04 -3.91815699e-05] [ 2.64802216e-03 -2.66802863e-04 -3.91815715e-05] [-2.41982651e-03 -1.92050599e-04 -2.37800958e-04] [ 2.41982650e-03 1.92050598e-04 -2.37800960e-04] [ 2.27425075e-03 -5.70001175e-04 2.22389153e-04] [-2.27425075e-03 5.70001177e-04 2.22389154e-04] [-5.08147595e-05 2.37331293e-03 2.38847133e-04] [ 5.08147497e-05 -2.37331288e-03 2.38847132e-04] [-4.28727668e-04 8.33382771e-04 1.66104965e-03] [ 4.28727670e-04 -8.33382770e-04 1.66104963e-03] [ 9.95409042e-04 5.44476988e-04 1.52580401e-04] [-9.95409038e-04 -5.44476980e-04 1.52580412e-04] [ 1.51033625e-03 2.07012735e-03 1.95950555e-04] [-1.51033625e-03 -2.07012735e-03 1.95950554e-04] [-6.34820371e-04 1.29707657e-03 -8.88009635e-04] [ 6.34820368e-04 -1.29707657e-03 -8.88009635e-04]] Final stress: [-1.29406833e-05 9.43978303e-06 -2.43362800e-05 -1.12089654e-14 -6.30541652e-15 2.94757520e-05] Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 7.14639386e-04 3.92889758e-04 -1.45112242e-04] [-7.14639386e-04 -3.92889744e-04 -1.45112232e-04] [ 1.12984460e-03 5.70894792e-04 3.93962316e-04] [-1.12984460e-03 -5.70894800e-04 3.93962310e-04] [ 1.42858639e-03 -1.36314322e-03 7.14382671e-04] [-1.42858639e-03 1.36314322e-03 7.14382673e-04] [-3.48781237e-03 -3.54350258e-03 4.05634967e-03] [ 3.48781236e-03 3.54350265e-03 4.05634973e-03] [-1.31700725e-03 1.03405104e-04 -6.27662022e-04] [ 1.31700725e-03 -1.03405078e-04 -6.27662046e-04] [ 2.24463236e-04 1.48698982e-03 -3.50645970e-04] [-2.24463235e-04 -1.48698984e-03 -3.50645968e-04] [-4.62304825e-05 6.34623719e-04 2.94827278e-03] [ 4.62304716e-05 -6.34623711e-04 2.94827278e-03] [-4.20813543e-03 3.26004783e-03 5.18389270e-03] [ 4.20813542e-03 -3.26004783e-03 5.18389271e-03] [-1.59687163e-03 4.73311518e-04 2.83731505e-04] [ 1.59687163e-03 -4.73311531e-04 2.83731495e-04] [ 1.69202613e-03 -1.24783382e-03 -9.92683547e-04] [-1.69202612e-03 1.24783380e-03 -9.92683556e-04] [ 3.98676120e-03 8.95787297e-04 1.11556403e-03] [-3.98676121e-03 -8.95787314e-04 1.11556405e-03] [-1.11608959e-03 2.85919140e-03 5.81659924e-04] [ 1.11608958e-03 -2.85919140e-03 5.81659926e-04] [-1.33919908e-04 2.28066578e-03 -4.93181443e-03] [ 1.33919908e-04 -2.28066574e-03 -4.93181442e-03] [ 2.83149547e-05 -4.53935570e-03 -5.81232595e-03] [-2.83149553e-05 4.53935567e-03 -5.81232596e-03] [ 3.57958564e-03 1.24462329e-03 2.20229123e-03] [-3.57958566e-03 -1.24462329e-03 2.20229122e-03] [-1.45590688e-03 -1.12655363e-03 -1.30649560e-03] [ 1.45590687e-03 1.12655364e-03 -1.30649560e-03] [-1.44651668e-03 -1.87820013e-03 -6.93232595e-04] [ 1.44651668e-03 1.87820013e-03 -6.93232598e-04] [-2.94572824e-03 3.27504272e-03 1.36421691e-03] [ 2.94572824e-03 -3.27504272e-03 1.36421692e-03] [ 6.50341353e-04 2.45895643e-03 1.80096525e-03] [-6.50341364e-04 -2.45895645e-03 1.80096524e-03] [ 7.72450181e-05 1.10018671e-04 2.68935941e-03] [-7.72449909e-05 -1.10018691e-04 2.68935939e-03] [-7.81787734e-04 4.40878982e-04 -1.25351331e-03] [ 7.81787711e-04 -4.40878996e-04 -1.25351331e-03] [-1.13211445e-03 -3.99400153e-03 -2.02994343e-03] [ 1.13211444e-03 3.99400153e-03 -2.02994344e-03] [ 9.55463976e-04 -1.06392968e-03 1.82904845e-03] [-9.55463978e-04 1.06392969e-03 1.82904845e-03] [-2.85235751e-03 2.91111400e-03 1.08836109e-03] [ 2.85235753e-03 -2.91111400e-03 1.08836110e-03] [ 1.98192719e-03 9.25988026e-04 -1.74700136e-04] [-1.98192720e-03 -9.25988026e-04 -1.74700129e-04] [-9.20890706e-04 -1.91180861e-03 -2.46733638e-03] [ 9.20890706e-04 1.91180861e-03 -2.46733637e-03] [-7.72962639e-04 -4.68417104e-04 -5.04664596e-04] [ 7.72962647e-04 4.68417100e-04 -5.04664602e-04] [-8.38041743e-04 -4.70275517e-03 -3.70518208e-04] [ 8.38041760e-04 4.70275520e-03 -3.70518217e-04] [-7.57096973e-03 1.57503787e-03 -2.03527801e-03] [ 7.57096972e-03 -1.57503782e-03 -2.03527800e-03] [ 2.15569344e-03 6.39747226e-04 -7.53498655e-04] [-2.15569345e-03 -6.39747229e-04 -7.53498666e-04] [-2.44189316e-03 -1.53224124e-03 -1.06902293e-04] [ 2.44189317e-03 1.53224125e-03 -1.06902290e-04] [ 1.28714056e-03 1.14437650e-03 2.07121702e-03] [-1.28714056e-03 -1.14437650e-03 2.07121702e-03] [-1.46309216e-03 1.18278195e-04 -5.08526219e-03] [ 1.46309216e-03 -1.18278198e-04 -5.08526219e-03] [-9.97053559e-06 7.58200874e-04 3.39307336e-03] [ 9.97052408e-06 -7.58200888e-04 3.39307339e-03] [ 1.98576817e-03 3.07431631e-03 -1.45617486e-03] [-1.98576816e-03 -3.07431631e-03 -1.45617487e-03] [ 2.65304806e-03 9.22211894e-04 -2.69217701e-03] [-2.65304806e-03 -9.22211871e-04 -2.69217703e-03] [-6.71442061e-03 -6.31218087e-04 2.19129763e-03] [ 6.71442062e-03 6.31218108e-04 2.19129764e-03] [ 1.91689828e-03 1.29017505e-03 -7.87195850e-04] [-1.91689828e-03 -1.29017505e-03 -7.87195824e-04] [-3.90931891e-04 -7.15870521e-04 1.37485483e-03] [ 3.90931891e-04 7.15870517e-04 1.37485481e-03] [ 1.10033377e-04 -1.27928941e-03 5.29713997e-05] [-1.10033370e-04 1.27928939e-03 5.29713648e-05] [-2.16935700e-04 -2.31783120e-05 1.59153263e-04] [ 2.16935705e-04 2.31783004e-05 1.59153256e-04] [ 1.93017066e-03 1.61800005e-03 -2.21558742e-03] [-1.93017066e-03 -1.61800005e-03 -2.21558742e-03] [-2.28262362e-03 3.41525883e-03 -2.26348848e-03] [ 2.28262362e-03 -3.41525889e-03 -2.26348851e-03] [-2.39497190e-04 -1.01168565e-03 -3.74004864e-04] [ 2.39497195e-04 1.01168564e-03 -3.74004854e-04] [ 2.08349114e-03 -1.09871093e-04 -7.79639394e-04] [-2.08349114e-03 1.09871077e-04 -7.79639383e-04] [-3.22995227e-03 -1.75940356e-03 1.14004285e-03] [ 3.22995226e-03 1.75940356e-03 1.14004286e-03] [ 1.55456493e-03 -1.14289049e-03 2.79169272e-04] [-1.55456495e-03 1.14289053e-03 2.79169279e-04] [ 1.45840266e-03 3.43175664e-04 -2.14706761e-03] [-1.45840265e-03 -3.43175672e-04 -2.14706765e-03] [-1.89397855e-03 -1.95389385e-03 -6.23365104e-04] [ 1.89397856e-03 1.95389384e-03 -6.23365071e-04] [-3.99416183e-03 -3.88458298e-03 2.54416228e-03] [ 3.99416183e-03 3.88458297e-03 2.54416228e-03] [ 7.68300939e-04 1.39311608e-03 3.52229032e-03] [-7.68300921e-04 -1.39311611e-03 3.52229033e-03]] Final stress: [-4.58194905e-06 -1.93610615e-06 -4.39085444e-05 1.09281138e-14 -1.64662678e-14 -5.17454802e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.70204241e-04 5.11157025e-04 2.43024070e-05] [ 5.70204239e-04 -5.11157030e-04 2.43024091e-05] [-6.47905069e-04 2.70588616e-04 1.96963369e-04] [ 6.47905072e-04 -2.70588616e-04 1.96963368e-04] [-9.36051000e-04 -4.85927173e-04 2.85265202e-04] [ 9.36051000e-04 4.85927174e-04 2.85265202e-04] [ 1.72698763e-03 -3.94768634e-04 4.03035269e-04] [-1.72698763e-03 3.94768638e-04 4.03035275e-04] [ 5.58269230e-04 1.14341296e-04 2.73464456e-05] [-5.58269230e-04 -1.14341285e-04 2.73464399e-05] [-2.48219869e-04 4.40592911e-04 -2.76671354e-04] [ 2.48219869e-04 -4.40592911e-04 -2.76671353e-04] [ 2.33561906e-04 2.08807991e-04 5.27289237e-04] [-2.33561910e-04 -2.08807988e-04 5.27289246e-04] [ 1.82828774e-03 1.20985886e-03 1.70335548e-03] [-1.82828774e-03 -1.20985886e-03 1.70335549e-03] [ 1.45910759e-04 2.42614502e-04 1.14969082e-05] [-1.45910759e-04 -2.42614501e-04 1.14969062e-05] [ 1.36525656e-04 -5.20239438e-04 3.12964472e-05] [-1.36525655e-04 5.20239438e-04 3.12964499e-05] [-1.82034471e-03 1.96373016e-04 1.12142311e-04] [ 1.82034472e-03 -1.96373010e-04 1.12142312e-04] [ 9.92911962e-04 5.69326795e-04 1.67521084e-04] [-9.92911964e-04 -5.69326785e-04 1.67521083e-04] [ 1.71949689e-04 -1.06302358e-04 -5.72857040e-04] [-1.71949685e-04 1.06302352e-04 -5.72857046e-04] [ 2.97153883e-04 -1.57531388e-03 -1.81887866e-03] [-2.97153882e-04 1.57531388e-03 -1.81887867e-03] [-1.38191797e-03 3.57849336e-04 1.08088879e-03] [ 1.38191797e-03 -3.57849342e-04 1.08088879e-03] [ 1.90149813e-04 -3.53287315e-04 -5.30718026e-04] [-1.90149816e-04 3.53287315e-04 -5.30718026e-04] [ 1.18785842e-03 -7.36727696e-04 -2.33550861e-04] [-1.18785842e-03 7.36727700e-04 -2.33550853e-04] [ 5.48857163e-04 -1.27018128e-03 6.60249123e-04] [-5.48857164e-04 1.27018129e-03 6.60249123e-04] [-1.16927255e-03 -1.23247491e-03 3.42146639e-04] [ 1.16927255e-03 1.23247490e-03 3.42146637e-04] [-5.31700652e-04 -1.06657616e-05 -7.84581025e-04] [ 5.31700649e-04 1.06657632e-05 -7.84581022e-04] [-1.40194964e-04 2.78611753e-04 1.51726096e-03] [ 1.40194962e-04 -2.78611757e-04 1.51726096e-03] [ 5.91198107e-04 2.87215970e-04 1.02067714e-03] [-5.91198103e-04 -2.87215967e-04 1.02067714e-03] [-6.02571622e-04 1.68954115e-03 -1.40076598e-03] [ 6.02571621e-04 -1.68954115e-03 -1.40076598e-03] [ 1.11301121e-03 -5.24643298e-04 -6.11200868e-04] [-1.11301122e-03 5.24643292e-04 -6.11200873e-04] [-1.25973173e-03 -1.33505416e-03 9.32235127e-04] [ 1.25973173e-03 1.33505416e-03 9.32235131e-04] [-1.49476441e-04 3.53826159e-04 2.33024757e-04] [ 1.49476438e-04 -3.53826158e-04 2.33024758e-04] [-2.91421843e-04 6.12678087e-04 -1.16547010e-03] [ 2.91421843e-04 -6.12678082e-04 -1.16547010e-03] [-2.24275884e-03 1.72164105e-04 -5.75729510e-04] [ 2.24275883e-03 -1.72164112e-04 -5.75729509e-04] [-6.84081242e-05 1.26640431e-03 2.28131415e-04] [ 6.84081274e-05 -1.26640431e-03 2.28131417e-04] [-1.24059852e-03 2.61551298e-04 1.14972780e-04] [ 1.24059853e-03 -2.61551298e-04 1.14972779e-04] [ 1.23451645e-03 -7.50806350e-04 -1.28567881e-04] [-1.23451645e-03 7.50806350e-04 -1.28567880e-04] [-7.74789050e-04 -2.64993290e-04 -2.82109790e-03] [ 7.74789053e-04 2.64993291e-04 -2.82109790e-03] [ 1.38632881e-04 -6.50687137e-04 1.70393743e-03] [-1.38632884e-04 6.50687142e-04 1.70393742e-03] [ 7.01442205e-04 -7.02560357e-04 1.51054561e-05] [-7.01442204e-04 7.02560352e-04 1.51054555e-05] [ 4.28949419e-04 9.09216879e-06 1.16498219e-03] [-4.28949429e-04 -9.09217100e-06 1.16498220e-03] [-2.43588147e-03 -6.12469834e-04 6.70304350e-04] [ 2.43588148e-03 6.12469831e-04 6.70304351e-04] [ 1.41894383e-03 -4.69118423e-04 -1.20375544e-03] [-1.41894383e-03 4.69118426e-04 -1.20375544e-03] [ 2.16240393e-04 1.00805481e-04 5.49988567e-04] [-2.16240398e-04 -1.00805482e-04 5.49988569e-04] [ 7.65237715e-04 -4.88123064e-04 -1.06806793e-03] [-7.65237716e-04 4.88123061e-04 -1.06806794e-03] [-8.19669784e-04 1.73693335e-04 -4.76338557e-04] [ 8.19669786e-04 -1.73693336e-04 -4.76338556e-04] [ 7.38004273e-04 8.67734542e-05 1.39729284e-04] [-7.38004272e-04 -8.67734542e-05 1.39729283e-04] [-5.53937685e-04 5.93630073e-04 -8.81290435e-04] [ 5.53937688e-04 -5.93630069e-04 -8.81290434e-04] [ 8.03615264e-04 4.32058779e-04 -1.68279148e-04] [-8.03615261e-04 -4.32058781e-04 -1.68279150e-04] [-5.73414426e-04 -6.98090399e-04 -1.43064124e-04] [ 5.73414427e-04 6.98090393e-04 -1.43064123e-04] [-1.32471253e-03 -1.53202676e-04 -3.91575210e-04] [ 1.32471253e-03 1.53202671e-04 -3.91575209e-04] [ 1.91408351e-03 -7.63897374e-04 4.06857199e-04] [-1.91408351e-03 7.63897378e-04 4.06857198e-04] [-4.83024941e-04 7.74181721e-05 1.88644365e-04] [ 4.83024945e-04 -7.74181798e-05 1.88644366e-04] [-5.71366979e-04 5.97384705e-04 4.66265689e-04] [ 5.71366981e-04 -5.97384703e-04 4.66265684e-04] [ 9.62083364e-04 1.68695678e-04 -5.04901079e-04] [-9.62083358e-04 -1.68695674e-04 -5.04901075e-04] [ 9.57149442e-04 1.87428335e-04 7.12922903e-04] [-9.57149438e-04 -1.87428332e-04 7.12922908e-04] [-1.42834588e-03 1.38333398e-03 1.19022797e-04] [ 1.42834587e-03 -1.38333398e-03 1.19022789e-04]] Final stress: [-7.50612995e-06 4.54008005e-06 -3.09935584e-05 -2.37110431e-15 -1.91218090e-16 3.14481901e-05] Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 2.75626967e-04 1.09418507e-04 -1.37978388e-04] [-2.75626970e-04 -1.09418483e-04 -1.37978393e-04] [ 2.03939136e-04 -8.41312499e-05 2.51708504e-04] [-2.03939137e-04 8.41312537e-05 2.51708507e-04] [ 3.40639703e-04 -1.47500862e-04 -7.81821441e-05] [-3.40639704e-04 1.47500862e-04 -7.81821426e-05] [-3.47079194e-04 -1.65609114e-04 2.89843970e-04] [ 3.47079189e-04 1.65609125e-04 2.89843980e-04] [-3.90785054e-05 1.44016404e-04 -8.46188254e-05] [ 3.90785040e-05 -1.44016407e-04 -8.46188287e-05] [ 4.95596002e-05 1.17533347e-04 -9.05324736e-05] [-4.95595999e-05 -1.17533349e-04 -9.05324730e-05] [-2.04789048e-04 -3.82387337e-05 -2.05815205e-04] [ 2.04789048e-04 3.82387336e-05 -2.05815215e-04] [-8.14865162e-04 -1.91902340e-04 1.89848699e-04] [ 8.14865159e-04 1.91902328e-04 1.89848702e-04] [-8.17025349e-05 2.19565858e-04 -1.58674594e-04] [ 8.17025355e-05 -2.19565862e-04 -1.58674598e-04] [ 1.90140698e-04 -7.93023169e-05 1.68676476e-04] [-1.90140698e-04 7.93023145e-05 1.68676463e-04] [ 6.36252997e-04 2.89020712e-05 1.48754409e-04] [-6.36252995e-04 -2.89020724e-05 1.48754405e-04] [-1.32758774e-04 -8.59658050e-05 2.24483691e-04] [ 1.32758774e-04 8.59657982e-05 2.24483692e-04] [-8.90818920e-05 -1.70462085e-04 -3.15722916e-04] [ 8.90818940e-05 1.70462098e-04 -3.15722897e-04] [-1.87096259e-05 2.22115264e-04 -2.90928170e-05] [ 1.87096268e-05 -2.22115266e-04 -2.90928093e-05] [ 3.65522688e-04 1.30046048e-04 4.75022928e-04] [-3.65522691e-04 -1.30046049e-04 4.75022929e-04] [-5.30287389e-05 -1.55900413e-04 -2.13947318e-04] [ 5.30287397e-05 1.55900413e-04 -2.13947319e-04] [-3.43706439e-04 -7.27278795e-05 -2.34124194e-04] [ 3.43706441e-04 7.27278778e-05 -2.34124191e-04] [-3.03462730e-04 3.55357973e-04 2.03074518e-04] [ 3.03462729e-04 -3.55357973e-04 2.03074519e-04] [ 3.27485123e-04 5.53067819e-04 2.42936616e-04] [-3.27485124e-04 -5.53067823e-04 2.42936612e-04] [ 1.35067567e-04 -3.51753231e-05 4.22183722e-04] [-1.35067554e-04 3.51753160e-05 4.22183711e-04] [-3.89956332e-04 -8.19295721e-06 -3.00662610e-04] [ 3.89956334e-04 8.19295882e-06 -3.00662610e-04] [-1.31252563e-06 -6.42342585e-04 -3.73262570e-04] [ 1.31252651e-06 6.42342585e-04 -3.73262570e-04] [ 1.98250133e-04 -4.13310250e-05 2.42604823e-04] [-1.98250132e-04 4.13310248e-05 2.42604822e-04] [-4.76077425e-05 3.30619652e-04 2.68401652e-04] [ 4.76077416e-05 -3.30619649e-04 2.68401654e-04] [-2.59563903e-04 6.18210169e-05 -2.49361253e-04] [ 2.59563898e-04 -6.18210159e-05 -2.49361249e-04] [ 7.06037007e-05 -3.36564453e-05 -2.77439966e-04] [-7.06037013e-05 3.36564438e-05 -2.77439964e-04] [-4.00873230e-05 -1.29028059e-04 -2.73099137e-05] [ 4.00873254e-05 1.29028057e-04 -2.73099159e-05] [ 4.53068041e-04 -1.30958756e-04 1.07843864e-04] [-4.53068040e-04 1.30958761e-04 1.07843862e-04] [-7.90392614e-05 -5.64743401e-04 3.96809081e-05] [ 7.90392592e-05 5.64743406e-04 3.96809105e-05] [ 5.06228002e-04 2.43328920e-04 -1.16201486e-04] [-5.06228002e-04 -2.43328921e-04 -1.16201486e-04] [-3.63482242e-04 -3.09981969e-04 1.07138844e-04] [ 3.63482243e-04 3.09981971e-04 1.07138843e-04] [-2.84210068e-05 2.23558323e-04 3.26168946e-04] [ 2.84210022e-05 -2.23558323e-04 3.26168941e-04] [-4.67631708e-04 3.96809222e-04 -3.00106320e-04] [ 4.67631707e-04 -3.96809215e-04 -3.00106321e-04] [-3.58675328e-05 2.04611581e-04 4.74225357e-04] [ 3.58675312e-05 -2.04611578e-04 4.74225361e-04] [ 3.26647163e-05 2.28602904e-04 -3.24857956e-04] [-3.26647168e-05 -2.28602902e-04 -3.24857960e-04] [ 6.62420124e-04 1.20501014e-04 -2.79038075e-04] [-6.62420126e-04 -1.20501008e-04 -2.79038078e-04] [-2.68048400e-04 4.59521748e-04 2.15818168e-04] [ 2.68048406e-04 -4.59521739e-04 2.15818169e-04] [ 1.52054154e-04 3.64753708e-05 -2.48715002e-04] [-1.52054148e-04 -3.64753682e-05 -2.48714998e-04] [-1.37300387e-04 8.55546307e-05 4.53943914e-05] [ 1.37300388e-04 -8.55546328e-05 4.53943875e-05] [ 3.10136251e-04 5.89988108e-05 2.32789937e-06] [-3.10136252e-04 -5.89988204e-05 2.32789330e-06] [ 2.10240845e-04 1.33427634e-05 1.25558180e-04] [-2.10240846e-04 -1.33427640e-05 1.25558180e-04] [ 2.00405314e-04 3.05674933e-05 -2.23428864e-04] [-2.00405317e-04 -3.05674918e-05 -2.23428866e-04] [-1.52919955e-04 -2.90369430e-05 -1.28618501e-04] [ 1.52919955e-04 2.90369356e-05 -1.28618506e-04] [-6.99752745e-04 2.30167191e-04 -1.32096949e-04] [ 6.99752753e-04 -2.30167211e-04 -1.32096948e-04] [ 1.21527325e-04 -5.16014387e-05 -2.12980557e-04] [-1.21527324e-04 5.16014389e-05 -2.12980557e-04] [-4.86302021e-04 -7.05646704e-05 -4.17256773e-05] [ 4.86302023e-04 7.05646730e-05 -4.17256786e-05] [-4.28510855e-05 -9.83142835e-05 1.65428004e-04] [ 4.28510747e-05 9.83142911e-05 1.65428006e-04] [ 2.01835852e-04 8.49362299e-05 -2.63286846e-04] [-2.01835848e-04 -8.49362361e-05 -2.63286851e-04] [ 3.40743904e-05 5.11328155e-05 3.72167002e-04] [-3.40743914e-05 -5.11328215e-05 3.72167001e-04] [-3.59408191e-04 -1.45443284e-04 -4.68130283e-05] [ 3.59408187e-04 1.45443282e-04 -4.68130386e-05] [ 3.49310847e-04 -2.90952341e-04 -1.46971097e-05] [-3.49310845e-04 2.90952339e-04 -1.46971032e-05]] Final stress: [-2.09812948e-06 7.02019549e-07 -1.72508011e-05 1.25247849e-15 -4.84976880e-15 -1.12232802e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-1.73036684e-04 9.26566931e-05 -7.19068149e-05] [ 1.73036685e-04 -9.26566699e-05 -7.19068201e-05] [-1.44604911e-04 -2.30554297e-05 1.58719384e-04] [ 1.44604911e-04 2.30554273e-05 1.58719387e-04] [-2.45379974e-04 -1.24451786e-04 -2.03784666e-05] [ 2.45379973e-04 1.24451786e-04 -2.03784638e-05] [ 2.72995560e-04 -9.54941270e-05 1.47304656e-04] [-2.72995562e-04 9.54941204e-05 1.47304649e-04] [ 4.24740161e-05 7.56362127e-05 -4.97203076e-05] [-4.24740163e-05 -7.56362125e-05 -4.97203081e-05] [-3.66871446e-05 9.49197060e-05 -7.25694024e-05] [ 3.66871446e-05 -9.49197064e-05 -7.25694037e-05] [ 1.47345702e-04 -2.28774103e-05 -8.98554308e-05] [-1.47345701e-04 2.28774132e-05 -8.98554303e-05] [ 5.39259734e-04 -2.41382107e-05 1.86324889e-04] [-5.39259734e-04 2.41382054e-05 1.86324882e-04] [ 3.57531694e-05 1.34291560e-04 -8.09327875e-05] [-3.57531703e-05 -1.34291557e-04 -8.09327837e-05] [-8.43992091e-05 -7.28821609e-05 1.03512559e-04] [ 8.43992099e-05 7.28821650e-05 1.03512562e-04] [-4.48661597e-04 1.61023157e-05 8.00289361e-05] [ 4.48661597e-04 -1.61023189e-05 8.00289399e-05] [ 1.68505885e-04 -2.37652175e-05 1.32452837e-04] [-1.68505884e-04 2.37652303e-05 1.32452830e-04] [ 4.99282491e-05 -9.71496101e-05 -1.87072218e-04] [-4.99282497e-05 9.71496025e-05 -1.87072227e-04] [ 1.35638110e-05 1.68799990e-05 -1.07249148e-04] [-1.35638105e-05 -1.68799995e-05 -1.07249148e-04] [-2.55389037e-04 8.24618506e-05 3.55289524e-04] [ 2.55389037e-04 -8.24618490e-05 3.55289525e-04] [ 4.70122891e-06 -9.71205506e-05 -1.57044337e-04] [-4.70122751e-06 9.71205525e-05 -1.57044336e-04] [ 2.54124172e-04 -8.00131428e-05 -1.46837780e-04] [-2.54124172e-04 8.00131412e-05 -1.46837777e-04] [ 1.97482116e-04 -3.71826881e-04 1.95432377e-04] [-1.97482117e-04 3.71826880e-04 1.95432375e-04] [-2.08544417e-04 -2.35124572e-04 1.23981616e-04] [ 2.08544419e-04 2.35124572e-04 1.23981617e-04] [-2.31034306e-04 -9.54818231e-06 -1.81386384e-04] [ 2.31034303e-04 9.54818200e-06 -1.81386384e-04] [ 4.01287872e-05 4.54242645e-05 3.14537696e-04] [-4.01287848e-05 -4.54242621e-05 3.14537696e-04] [ 1.51822006e-04 4.66851180e-05 1.70262036e-04] [-1.51822008e-04 -4.66851202e-05 1.70262035e-04] [-2.98196960e-05 4.70703483e-04 -2.95249970e-04] [ 2.98196976e-05 -4.70703486e-04 -2.95249970e-04] [-7.90957303e-05 -5.16862329e-05 -1.53929176e-04] [ 7.90957312e-05 5.16862380e-05 -1.53929180e-04] [-9.29244969e-05 -2.49012461e-04 1.89672439e-04] [ 9.29244960e-05 2.49012465e-04 1.89672441e-04] [-3.59273155e-05 7.18379972e-05 -1.95750390e-05] [ 3.59273161e-05 -7.18379953e-05 -1.95750390e-05] [ 4.99731278e-05 2.10741785e-05 -2.14312675e-04] [-4.99731272e-05 -2.10741802e-05 -2.14312675e-04] [-1.44451763e-04 2.88085337e-04 -3.14775358e-05] [ 1.44451764e-04 -2.88085340e-04 -3.14775354e-05] [ 2.35688599e-04 1.15114745e-04 6.66951233e-05] [-2.35688600e-04 -1.15114748e-04 6.66951212e-05] [-2.58412463e-04 1.96891419e-04 7.01798454e-05] [ 2.58412463e-04 -1.96891418e-04 7.01798459e-05] [ 3.48943912e-04 -1.81421595e-04 -5.65330881e-05] [-3.48943912e-04 1.81421594e-04 -5.65330878e-05] [-2.71819068e-04 -2.20369020e-04 -3.49112814e-04] [ 2.71819071e-04 2.20369025e-04 -3.49112812e-04] [-4.98887947e-05 -1.67416280e-04 2.74682291e-04] [ 4.98887904e-05 1.67416286e-04 2.74682287e-04] [ 3.84219034e-05 -1.46132652e-04 -1.71618129e-04] [-3.84219007e-05 1.46132652e-04 -1.71618131e-04] [ 3.67066929e-05 -9.71903439e-05 3.32305619e-04] [-3.67066930e-05 9.71903438e-05 3.32305622e-04] [-2.93065835e-04 -2.51768723e-04 1.39943461e-04] [ 2.93065836e-04 2.51768722e-04 1.39943462e-04] [ 4.66267514e-04 -6.69569534e-05 -1.95516372e-04] [-4.66267513e-04 6.69569517e-05 -1.95516374e-04] [-6.08229065e-05 -4.00110444e-05 4.17452578e-05] [ 6.08229053e-05 4.00110427e-05 4.17452573e-05] [ 1.41971511e-04 -5.07974888e-05 -2.04683676e-04] [-1.41971510e-04 5.07974880e-05 -2.04683674e-04] [-2.19226811e-04 5.39197452e-05 -3.73164864e-05] [ 2.19226809e-04 -5.39197427e-05 -3.73164875e-05] [-7.67614746e-05 1.99680428e-05 8.39176418e-05] [ 7.67614755e-05 -1.99680416e-05 8.39176394e-05] [-1.13036938e-04 5.87859019e-05 -1.79607528e-04] [ 1.13036938e-04 -5.87858994e-05 -1.79607528e-04] [ 1.18548092e-04 -8.76333334e-06 -6.50167292e-05] [-1.18548093e-04 8.76333679e-06 -6.50167261e-05] [ 3.21963832e-04 7.96885992e-05 -7.51589660e-05] [-3.21963832e-04 -7.96886198e-05 -7.51589660e-05] [-1.17056737e-04 -4.58939848e-05 -1.44457230e-04] [ 1.17056738e-04 4.58939873e-05 -1.44457230e-04] [ 3.72707933e-04 -9.07692138e-05 4.59053738e-06] [-3.72707934e-04 9.07692136e-05 4.59053789e-06] [-3.49669538e-05 -3.17394715e-05 1.07085612e-04] [ 3.49669544e-05 3.17394603e-05 1.07085612e-04] [ 2.12265659e-05 1.19413597e-05 2.44401374e-04] [-2.12265644e-05 -1.19413618e-05 2.44401378e-04] [ 1.56936953e-04 -4.49599186e-05 -1.51999333e-04] [-1.56936955e-04 4.49599170e-05 -1.51999341e-04] [ 2.39687082e-04 1.39022659e-04 2.36048208e-05] [-2.39687082e-04 -1.39022660e-04 2.36048277e-05] [-2.51349660e-04 1.33020822e-04 -3.61526968e-05] [ 2.51349658e-04 -1.33020823e-04 -3.61527016e-05]] Final stress: [-2.04777158e-06 1.20528218e-07 -1.35137837e-05 -5.49752008e-17 -1.46520861e-15 8.33900994e-06] Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90453 0.54239 0.43128 -0. 0.00001 0.00003] [ 0.54239 0.9106 0.49789 -0.00002 -0.00001 0.00005] [ 0.43128 0.49789 0.77682 -0. 0. 0.02844] [-0. -0.00002 -0. 0.2476 0. 0. ] [ 0.00001 -0.00001 0. 0. 0.2061 0. ] [ 0.00003 0.00005 0.02844 0. 0. -0.0104 ]] 95%% Error estimate [ASE units]: [[0.00025 0.00046 0.00063 0. 0.00001 0.00398] [0.00046 0.00013 0.00037 0.00002 0.00003 0.02517] [0.00063 0.00037 0.00021 0.00001 0.00001 0.09926] [0. 0.00002 0.00001 0.00003 0. 0. ] [0.00001 0.00003 0.00001 0. 0.00008 0. ] [0.00398 0.02517 0.09926 0. 0. 0.60962]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.304809 is too big compared to maximum elastic constant component 0.910605 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.028435 WARNING: Maximum deviation from material symmetry according to space group 31 is too big compared to maximum elastic constant component 0.910605 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 5 steps. Minimization converged after 49 steps. Minimization converged after 54 steps. Minimization converged after 66 steps. Minimization converged after 52 steps. Minimization converged after 55 steps. Minimization converged after 56 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 77 steps. Minimization converged after 77 steps. Minimization converged after 122 steps. Minimization converged after 123 steps. Minimization converged after 47 steps. Minimization converged after 49 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 53 steps. Minimization converged after 52 steps. Minimization converged after 62 steps. Minimization converged after 63 steps. Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 113 steps. Minimization converged after 115 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 63 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 60 steps. Minimization converged after 112 steps. Minimization converged after 110 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 44 steps. Minimization converged after 50 steps. Minimization converged after 48 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 59 steps. Minimization converged after 62 steps. Minimization converged after 110 steps. Minimization converged after 110 steps. Minimization converged after 41 steps. Minimization converged after 45 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 47 steps. Minimization converged after 41 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 58 steps. Minimization converged after 61 steps. Minimization converged after 108 steps. Minimization converged after 108 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 45 steps. Minimization converged after 36 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 59 steps. Minimization converged after 55 steps. Minimization converged after 111 steps. Minimization converged after 110 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 32 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 112 steps. Minimization converged after 114 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 42 steps. Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 43 steps. Minimization converged after 36 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 107 steps. Minimization converged after 109 steps. Minimization converged after 42 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 36 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 5.25675911e-03 7.58975221e-03 3.74532191e-04] [-5.25675912e-03 -7.58975216e-03 3.74532179e-04] [ 4.27845698e-03 -1.26054303e-04 -1.99085343e-03] [-4.27845698e-03 1.26054298e-04 -1.99085343e-03] [ 5.88183821e-03 -1.18567022e-03 -9.11490339e-05] [-5.88183821e-03 1.18567022e-03 -9.11490379e-05] [-9.89121978e-03 2.94001844e-03 -2.65956025e-03] [ 9.89121978e-03 -2.94001845e-03 -2.65956028e-03] [-3.26373463e-03 6.38407500e-04 6.48364793e-04] [ 3.26373463e-03 -6.38407508e-04 6.48364800e-04] [ 8.42108566e-04 1.70575124e-04 -2.97281359e-04] [-8.42108566e-04 -1.70575128e-04 -2.97281363e-04] [ 3.02393182e-04 -1.44485201e-04 -1.25386305e-03] [-3.02393182e-04 1.44485205e-04 -1.25386304e-03] [-1.03399069e-02 -3.14058203e-03 5.33709477e-04] [ 1.03399069e-02 3.14058202e-03 5.33709470e-04] [-1.53413923e-03 -3.13092945e-04 -7.46443161e-04] [ 1.53413923e-03 3.13092947e-04 -7.46443158e-04] [-1.48476945e-03 2.25019617e-07 1.15022407e-03] [ 1.48476945e-03 -2.25013233e-07 1.15022408e-03] [ 1.00845291e-02 -1.46720580e-04 -1.25061209e-03] [-1.00845291e-02 1.46720578e-04 -1.25061208e-03] [-1.82317777e-03 -6.95109540e-04 9.20290471e-05] [ 1.82317777e-03 6.95109577e-04 9.20290362e-05] [-5.11012808e-04 -4.13592537e-03 3.80678261e-03] [ 5.11012808e-04 4.13592535e-03 3.80678258e-03] [-3.46879269e-03 1.78687105e-03 -5.68369284e-04] [ 3.46879268e-03 -1.78687105e-03 -5.68369289e-04] [ 8.27275062e-03 1.44687335e-03 4.44048818e-05] [-8.27275062e-03 -1.44687335e-03 4.44048850e-05] [-4.27015136e-03 -7.56526210e-04 -6.58769914e-04] [ 4.27015136e-03 7.56526214e-04 -6.58769912e-04] [-7.35107569e-03 -2.36647023e-03 -3.45269361e-04] [ 7.35107569e-03 2.36647022e-03 -3.45269357e-04] [-8.67168118e-03 7.23012669e-03 7.83081600e-04] [ 8.67168118e-03 -7.23012669e-03 7.83081599e-04] [ 3.04277540e-03 9.35046664e-03 -4.64897961e-04] [-3.04277540e-03 -9.35046665e-03 -4.64897961e-04] [ 3.72202098e-03 -1.01959706e-03 7.93249606e-03] [-3.72202098e-03 1.01959707e-03 7.93249606e-03] [-4.28315893e-03 -1.28597692e-03 -7.71643060e-03] [ 4.28315893e-03 1.28597693e-03 -7.71643060e-03] [-3.43591410e-03 -6.08218269e-03 -5.16912429e-03] [ 3.43591411e-03 6.08218269e-03 -5.16912429e-03] [ 2.15898839e-03 -2.23053813e-03 8.58883286e-03] [-2.15898839e-03 2.23053813e-03 8.58883286e-03] [-3.79245817e-03 6.56969143e-03 8.23105342e-03] [ 3.79245817e-03 -6.56969142e-03 8.23105341e-03] [ 5.76804594e-03 3.77323443e-03 -4.91365913e-03] [-5.76804594e-03 -3.77323442e-03 -4.91365912e-03] [-3.15502289e-03 -3.37526525e-03 -4.82948202e-03] [ 3.15502289e-03 3.37526525e-03 -4.82948202e-03] [-1.85134537e-04 -5.33214894e-03 5.42560560e-03] [ 1.85134537e-04 5.33214894e-03 5.42560560e-03] [ 6.45541368e-03 -6.82700079e-03 2.28315004e-03] [-6.45541368e-03 6.82700079e-03 2.28315004e-03] [-6.19037935e-03 -8.29827557e-03 -5.15139597e-04] [ 6.19037935e-03 8.29827556e-03 -5.15139602e-04] [ 7.96847343e-03 2.74375401e-03 -1.22495782e-03] [-7.96847343e-03 -2.74375401e-03 -1.22495782e-03] [-8.44918025e-03 1.26652719e-03 2.24866101e-04] [ 8.44918025e-03 -1.26652719e-03 2.24866101e-04] [ 7.69354198e-03 6.23690290e-03 7.67245940e-03] [-7.69354197e-03 -6.23690289e-03 7.67245940e-03] [-7.07729110e-03 4.56582186e-03 -1.15157703e-02] [ 7.07729109e-03 -4.56582185e-03 -1.15157703e-02] [-6.77408090e-04 2.33482107e-03 3.48100573e-03] [ 6.77408096e-04 -2.33482107e-03 3.48100572e-03] [ 1.52436659e-03 2.26264895e-03 -2.83172418e-03] [-1.52436659e-03 -2.26264895e-03 -2.83172418e-03] [ 9.12595953e-03 5.11586973e-03 -6.93357787e-03] [-9.12595953e-03 -5.11586974e-03 -6.93357786e-03] [-9.78110987e-03 4.93044948e-03 5.84746282e-03] [ 9.78110987e-03 -4.93044948e-03 5.84746282e-03] [ 3.29948015e-04 1.46599269e-03 -5.02175213e-03] [-3.29948014e-04 -1.46599269e-03 -5.02175214e-03] [-3.28921860e-04 1.71874565e-03 4.02365469e-03] [ 3.28921857e-04 -1.71874565e-03 4.02365469e-03] [ 4.01042286e-03 9.55407141e-04 9.98851406e-04] [-4.01042286e-03 -9.55407131e-04 9.98851415e-04] [-3.74053268e-03 2.50913484e-04 3.63545310e-04] [ 3.74053268e-03 -2.50913484e-04 3.63545309e-04] [ 5.10913258e-03 -7.57341176e-04 -4.25865817e-04] [-5.10913258e-03 7.57341176e-04 -4.25865820e-04] [-3.10111732e-03 -6.73088981e-04 -3.01610630e-04] [ 3.10111732e-03 6.73088993e-04 -3.01610625e-04] [-4.02263760e-03 -1.05451907e-02 -1.59742914e-03] [ 4.02263760e-03 1.05451907e-02 -1.59742914e-03] [ 9.06863943e-03 -5.34662663e-04 -2.36143000e-04] [-9.06863943e-03 5.34662665e-04 -2.36143002e-04] [-1.20673899e-02 1.26945882e-03 1.00588899e-04] [ 1.20673899e-02 -1.26945881e-03 1.00588896e-04] [-1.98359701e-03 2.17591493e-03 6.26046798e-04] [ 1.98359701e-03 -2.17591496e-03 6.26046800e-04] [ 5.37701104e-03 -2.65363960e-03 -2.08725075e-03] [-5.37701104e-03 2.65363959e-03 -2.08725073e-03] [-5.03349782e-03 -1.83893647e-03 3.82152735e-03] [ 5.03349782e-03 1.83893647e-03 3.82152733e-03] [-8.80138627e-03 -7.17417003e-03 -8.56875785e-04] [ 8.80138627e-03 7.17417003e-03 -8.56875769e-04] [ 9.15194571e-03 -7.31808089e-03 -5.50413138e-04] [-9.15194571e-03 7.31808089e-03 -5.50413153e-04]] Final stress: [-7.12433331e-05 5.29692818e-05 -1.81682193e-06 -6.52531767e-16 -1.10906498e-15 -1.42502084e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.64813991e-03 7.37781452e-03 1.18297057e-03] [ 2.64813991e-03 -7.37781442e-03 1.18297054e-03] [-2.10260075e-03 -2.48599405e-04 -7.81049299e-04] [ 2.10260075e-03 2.48599394e-04 -7.81049291e-04] [-2.87351691e-03 -2.21001709e-04 1.50575204e-04] [ 2.87351691e-03 2.21001706e-04 1.50575201e-04] [ 4.85915662e-03 -2.53182875e-04 1.18272536e-03] [-4.85915662e-03 2.53182844e-04 1.18272532e-03] [ 1.56426156e-03 1.27681501e-04 -2.33593627e-04] [-1.56426157e-03 -1.27681501e-04 -2.33593624e-04] [-7.28087837e-04 -2.24939281e-04 3.49855687e-04] [ 7.28087837e-04 2.24939276e-04 3.49855678e-04] [-3.17937898e-04 -7.46596689e-05 2.28248766e-04] [ 3.17937898e-04 7.46596748e-05 2.28248772e-04] [ 5.15052949e-03 -2.48823308e-03 1.14566279e-03] [-5.15052949e-03 2.48823306e-03 1.14566277e-03] [ 9.72835258e-04 1.42132662e-04 -2.00976764e-04] [-9.72835258e-04 -1.42132657e-04 -2.00976761e-04] [ 5.57278669e-04 3.96196146e-04 1.77922724e-04] [-5.57278670e-04 -3.96196133e-04 1.77922733e-04] [-5.08116846e-03 2.02959195e-04 -2.51748713e-04] [ 5.08116846e-03 -2.02959197e-04 -2.51748712e-04] [ 6.22038386e-04 7.12022038e-04 3.19091360e-04] [-6.22038385e-04 -7.12021994e-04 3.19091345e-04] [ 4.57760887e-04 -4.45889540e-04 6.19908823e-04] [-4.57760887e-04 4.45889518e-04 6.19908798e-04] [ 1.79752651e-03 4.29159777e-04 -6.77524573e-04] [-1.79752651e-03 -4.29159777e-04 -6.77524584e-04] [-3.95885033e-03 1.51288218e-04 5.52718987e-04] [ 3.95885033e-03 -1.51288213e-04 5.52718994e-04] [ 2.31511620e-03 -2.29855712e-04 -1.99658219e-04] [-2.31511619e-03 2.29855715e-04 -1.99658216e-04] [ 3.75446044e-03 -1.46406850e-03 -5.28814247e-04] [-3.75446044e-03 1.46406848e-03 -5.28814238e-04] [ 2.11343726e-03 -4.63865942e-03 -2.02416209e-04] [-2.11343726e-03 4.63865941e-03 -2.02416211e-04] [-3.58671681e-03 -3.87208502e-03 5.60023248e-04] [ 3.58671681e-03 3.87208502e-03 5.60023250e-04] [-2.22437495e-03 1.15477944e-03 -4.61150751e-03] [ 2.22437494e-03 -1.15477943e-03 -4.61150751e-03] [ 2.43588420e-03 4.78980224e-04 3.50215696e-03] [-2.43588418e-03 -4.78980216e-04 3.50215696e-03] [ 9.68965883e-04 1.78838231e-03 3.63456460e-03] [-9.68965884e-04 -1.78838231e-03 3.63456460e-03] [-1.40761180e-03 2.39579324e-03 -3.01307402e-03] [ 1.40761181e-03 -2.39579325e-03 -3.01307402e-03] [ 2.14194961e-03 -1.55309775e-03 -2.19790909e-03] [-2.14194960e-03 1.55309776e-03 -2.19790910e-03] [-1.09441843e-03 -3.66767221e-03 4.84433808e-03] [ 1.09441843e-03 3.66767222e-03 4.84433810e-03] [ 4.57453609e-04 2.47165787e-03 2.65897865e-03] [-4.57453611e-04 -2.47165787e-03 2.65897865e-03] [-1.03357829e-03 2.16910000e-03 -2.71950372e-03] [ 1.03357829e-03 -2.16910000e-03 -2.71950372e-03] [-3.56088761e-03 3.52701963e-03 -5.94907306e-04] [ 3.56088760e-03 -3.52701964e-03 -5.94907301e-04] [ 3.14247687e-03 4.01453989e-03 6.13914165e-04] [-3.14247686e-03 -4.01453990e-03 6.13914159e-04] [-4.28842115e-03 -7.60389780e-04 2.11843018e-04] [ 4.28842115e-03 7.60389777e-04 2.11843018e-04] [ 4.20938533e-03 -1.23219323e-03 -4.62154277e-04] [-4.20938533e-03 1.23219322e-03 -4.62154279e-04] [-3.25807319e-03 -1.40614665e-03 -5.77126321e-03] [ 3.25807321e-03 1.40614667e-03 -5.77126320e-03] [ 4.69274025e-03 -4.00102190e-03 2.93657769e-03] [-4.69274026e-03 4.00102192e-03 2.93657767e-03] [ 7.36926792e-04 -1.36262076e-03 -1.34585275e-03] [-7.36926788e-04 1.36262076e-03 -1.34585276e-03] [-6.97946625e-04 -1.25872443e-03 1.90984870e-03] [ 6.97946621e-04 1.25872443e-03 1.90984871e-03] [-4.78397029e-03 -3.00857675e-03 3.23660960e-03] [ 4.78397029e-03 3.00857675e-03 3.23660961e-03] [ 4.92035696e-03 -1.96988076e-03 -3.54268357e-03] [-4.92035696e-03 1.96988076e-03 -3.54268357e-03] [-3.97542081e-04 -7.37460533e-04 2.50091980e-03] [ 3.97542081e-04 7.37460533e-04 2.50091979e-03] [-1.79353005e-04 -7.01834631e-04 -2.27714720e-03] [ 1.79353007e-04 7.01834631e-04 -2.27714719e-03] [-1.88477661e-03 2.57493564e-04 9.42365215e-05] [ 1.88477661e-03 -2.57493555e-04 9.42365293e-05] [ 1.78903776e-03 1.61454123e-04 -2.63764733e-05] [-1.78903776e-03 -1.61454121e-04 -2.63764779e-05] [-2.64703716e-03 -2.18029087e-04 -1.41776892e-04] [ 2.64703716e-03 2.18029087e-04 -1.41776892e-04] [ 1.75566199e-03 4.63423137e-04 -7.77036537e-04] [-1.75566199e-03 -4.63423119e-04 -7.77036521e-04] [ 2.85718624e-03 -6.81532110e-03 -5.81577004e-04] [-2.85718624e-03 6.81532102e-03 -5.81577000e-04] [-4.71838786e-03 1.40697646e-05 -1.32027564e-04] [ 4.71838786e-03 -1.40697638e-05 -1.32027566e-04] [ 5.87853176e-03 4.14445640e-04 1.21092477e-04] [-5.87853176e-03 -4.14445639e-04 1.21092476e-04] [ 1.59634912e-03 -1.46577848e-04 5.79340575e-05] [-1.59634912e-03 1.46577811e-04 5.79340577e-05] [-2.32561954e-03 2.95942679e-04 5.16747210e-04] [ 2.32561954e-03 -2.95942692e-04 5.16747241e-04] [ 3.07286549e-03 2.09689165e-03 -2.52156502e-03] [-3.07286549e-03 -2.09689166e-03 -2.52156505e-03] [ 4.36532351e-03 3.53778353e-03 3.43959431e-04] [-4.36532351e-03 -3.53778354e-03 3.43959452e-04] [-4.71490813e-03 4.05603420e-03 1.38719353e-04] [ 4.71490813e-03 -4.05603419e-03 1.38719332e-04]] Final stress: [-2.06671028e-05 1.55817192e-05 -6.46596764e-06 -1.12340634e-16 4.19006662e-15 6.71219194e-05] Minimization converged after 29 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 4.22155802e-03 -6.55995921e-03 -2.21193222e-03] [-4.22155803e-03 6.55995918e-03 -2.21193221e-03] [ 4.14131657e-03 8.45570801e-04 -6.85034726e-04] [-4.14131657e-03 -8.45570795e-04 -6.85034724e-04] [ 5.01078143e-03 -1.32963819e-03 -2.00563280e-04] [-5.01078143e-03 1.32963818e-03 -2.00563274e-04] [-9.67210920e-03 2.43630714e-03 -4.03335029e-03] [ 9.67210920e-03 -2.43630705e-03 -4.03335019e-03] [-3.35446115e-03 3.09936312e-04 9.63751606e-04] [ 3.35446115e-03 -3.09936323e-04 9.63751593e-04] [ 1.20257650e-03 1.10600242e-03 -1.22224021e-03] [-1.20257650e-03 -1.10600242e-03 -1.22224020e-03] [ 8.69196003e-04 -4.60639205e-05 -5.78798974e-04] [-8.69196002e-04 4.60639089e-05 -5.78799018e-04] [-9.47773459e-03 2.28864260e-03 6.52994817e-05] [ 9.47773460e-03 -2.28864261e-03 6.52995204e-05] [-1.04703378e-03 -6.45643994e-04 -1.97476931e-04] [ 1.04703377e-03 6.45643966e-04 -1.97476949e-04] [-1.63549587e-03 -1.15988752e-03 2.23878550e-04] [ 1.63549587e-03 1.15988750e-03 2.23878507e-04] [ 8.39523581e-03 -2.34414160e-04 -3.03330360e-04] [-8.39523581e-03 2.34414151e-04 -3.03330374e-04] [-1.74424679e-03 -3.14545104e-03 -8.74371030e-04] [ 1.74424679e-03 3.14545103e-03 -8.74371017e-04] [-1.54873044e-04 -2.31691102e-03 3.43406959e-04] [ 1.54873044e-04 2.31691112e-03 3.43407074e-04] [-2.86171148e-03 5.29223084e-04 -1.72732303e-03] [ 2.86171149e-03 -5.29223113e-04 -1.72732298e-03] [ 7.95867324e-03 1.81614093e-03 -4.93425641e-04] [-7.95867324e-03 -1.81614093e-03 -4.93425651e-04] [-4.26510362e-03 -6.42752480e-04 -1.10529913e-03] [ 4.26510362e-03 6.42752479e-04 -1.10529915e-03] [-6.39285188e-03 -3.74566271e-04 6.51547255e-04] [ 6.39285188e-03 3.74566276e-04 6.51547253e-04] [-7.25380582e-03 6.85954187e-03 7.84441101e-04] [ 7.25380582e-03 -6.85954188e-03 7.84441120e-04] [ 2.60701314e-03 7.44828235e-03 1.02718169e-04] [-2.60701315e-03 -7.44828235e-03 1.02718150e-04] [ 3.05657138e-03 -2.19671333e-03 8.67387110e-03] [-3.05657136e-03 2.19671332e-03 8.67387109e-03] [-3.78949784e-03 -2.65364969e-04 -4.84524261e-03] [ 3.78949781e-03 2.65364961e-04 -4.84524260e-03] [-3.20747535e-03 -6.27723416e-03 -4.60841071e-03] [ 3.20747536e-03 6.27723417e-03 -4.60841071e-03] [ 2.20061494e-03 -1.88775618e-03 7.46713142e-03] [-2.20061494e-03 1.88775619e-03 7.46713142e-03] [-5.78397368e-03 4.22656994e-03 4.87674032e-03] [ 5.78397368e-03 -4.22656994e-03 4.87674033e-03] [ 5.89544716e-03 5.10597694e-03 -6.59149205e-03] [-5.89544715e-03 -5.10597693e-03 -6.59149206e-03] [-3.58911816e-03 -3.37040746e-03 -5.07133199e-03] [ 3.58911815e-03 3.37040745e-03 -5.07133197e-03] [ 5.95728796e-05 -4.84669057e-03 4.79014354e-03] [-5.95728780e-05 4.84669056e-03 4.79014352e-03] [ 4.21879424e-03 -7.03368892e-03 1.36156222e-03] [-4.21879421e-03 7.03368896e-03 1.36156220e-03] [-6.24664474e-03 -7.41527151e-03 -5.23188972e-04] [ 6.24664471e-03 7.41527156e-03 -5.23188951e-04] [ 6.81718754e-03 2.14283453e-03 -8.92450716e-04] [-6.81718755e-03 -2.14283452e-03 -8.92450723e-04] [-7.69230262e-03 8.56975402e-04 -9.12991776e-05] [ 7.69230262e-03 -8.56975398e-04 -9.12991701e-05] [ 6.00281943e-03 2.78730459e-03 8.79098860e-03] [-6.00281946e-03 -2.78730460e-03 8.79098859e-03] [-7.61476452e-03 5.90071499e-03 -8.47472386e-03] [ 7.61476454e-03 -5.90071500e-03 -8.47472384e-03] [ 9.61975473e-05 1.65031512e-03 2.41211925e-03] [-9.61975682e-05 -1.65031511e-03 2.41211928e-03] [ 9.65439223e-04 2.11387700e-03 -2.61241026e-03] [-9.65439207e-04 -2.11387699e-03 -2.61241030e-03] [ 6.91276898e-03 6.25057691e-03 -5.98541799e-03] [-6.91276900e-03 -6.25057687e-03 -5.98541801e-03] [-9.94334313e-03 2.47857901e-03 5.48521942e-03] [ 9.94334315e-03 -2.47857896e-03 5.48521944e-03] [ 6.99542687e-04 1.58573956e-03 -4.59972042e-03] [-6.99542675e-04 -1.58573956e-03 -4.59972038e-03] [ 7.55202609e-04 1.18985152e-03 3.30601387e-03] [-7.55202626e-04 -1.18985152e-03 3.30601384e-03] [ 3.51911120e-03 -4.74281157e-04 1.59835854e-03] [-3.51911120e-03 4.74281094e-04 1.59835849e-03] [-4.03251055e-03 -1.01285216e-04 4.89004435e-04] [ 4.03251055e-03 1.01285206e-04 4.89004440e-04] [ 4.75670657e-03 -1.63717452e-04 -8.31751064e-04] [-4.75670657e-03 1.63717461e-04 -8.31751070e-04] [-1.92681849e-03 -3.06079697e-04 2.77297622e-04] [ 1.92681849e-03 3.06079628e-04 2.77297559e-04] [-2.37363182e-03 1.08771437e-03 -7.03935205e-04] [ 2.37363182e-03 -1.08771435e-03 -7.03935205e-04] [ 8.78371744e-03 -7.68930547e-04 -1.10690166e-04] [-8.78371744e-03 7.68930537e-04 -1.10690162e-04] [-1.05963269e-02 2.74259030e-04 2.34496943e-04] [ 1.05963269e-02 -2.74259029e-04 2.34496941e-04] [-1.12255811e-03 3.91196037e-03 6.80508476e-04] [ 1.12255810e-03 -3.91196036e-03 6.80508478e-04] [ 4.14560021e-03 -2.36032539e-04 -2.69051509e-05] [-4.14560019e-03 2.36032520e-04 -2.69052035e-05] [-5.93068923e-03 -4.15816362e-03 4.77292374e-03] [ 5.93068921e-03 4.15816360e-03 4.77292379e-03] [-8.34044606e-03 -7.05025126e-03 4.62363146e-04] [ 8.34044604e-03 7.05025124e-03 4.62363087e-04] [ 8.25769498e-03 -6.65799313e-03 7.88330368e-04] [-8.25769495e-03 6.65799311e-03 7.88330432e-04]] Final stress: [-4.82095656e-05 3.00456311e-05 -2.71208297e-06 4.83184221e-15 2.25876373e-15 -1.25678691e-04] Minimization converged after 111 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 23 steps. Minimization converged after 20 steps. Minimization converged after 22 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 3.04910324e-04 -2.01850141e-03 -4.24884710e-04] [-3.04910324e-04 2.01850140e-03 -4.24884707e-04] [ 4.21582391e-04 2.51892585e-04 1.68004591e-04] [-4.21582391e-04 -2.51892590e-04 1.68004593e-04] [ 6.46029745e-04 -4.51095465e-05 -1.54737799e-05] [-6.46029745e-04 4.51095447e-05 -1.54737835e-05] [-1.24933894e-03 1.78928993e-04 -5.44795571e-04] [ 1.24933894e-03 -1.78928986e-04 -5.44795561e-04] [-4.46126262e-04 -3.35873045e-05 1.41976140e-04] [ 4.46126262e-04 3.35873020e-05 1.41976138e-04] [ 1.99815985e-04 1.48175913e-04 -2.23552896e-04] [-1.99815985e-04 -1.48175913e-04 -2.23552897e-04] [ 1.05107206e-04 1.29827134e-05 1.01378961e-05] [-1.05107206e-04 -1.29827116e-05 1.01378960e-05] [-8.79326973e-04 8.37282696e-04 3.38100171e-05] [ 8.79326973e-04 -8.37282693e-04 3.38100236e-05] [ 7.79149455e-05 -6.16191110e-05 6.51506888e-05] [-7.79149461e-05 6.16191092e-05 6.51506868e-05] [-6.16474367e-04 -2.44500462e-04 -8.10999225e-05] [ 6.16474367e-04 2.44500462e-04 -8.10999221e-05] [ 7.54342958e-04 -9.35913121e-06 8.58426969e-05] [-7.54342958e-04 9.35913036e-06 8.58426958e-05] [-5.88803606e-04 -1.00371954e-03 -2.73439951e-04] [ 5.88803605e-04 1.00371957e-03 -2.73439957e-04] [-3.32468899e-04 1.26416774e-05 -3.56516854e-04] [ 3.32468900e-04 -1.26416767e-05 -3.56516856e-04] [-4.54527918e-04 -3.49953176e-05 -3.40385370e-04] [ 4.54527919e-04 3.49953075e-05 -3.40385375e-04] [ 9.11733076e-04 1.36906566e-04 -4.27827292e-05] [-9.11733076e-04 -1.36906567e-04 -4.27827310e-05] [-1.18252817e-04 -2.20392406e-06 -1.65342526e-04] [ 1.18252816e-04 2.20392468e-06 -1.65342524e-04] [-7.50942183e-04 1.96689350e-04 1.93278838e-04] [ 7.50942183e-04 -1.96689350e-04 1.93278840e-04] [-5.29276865e-04 8.24423624e-04 6.50335994e-05] [ 5.29276865e-04 -8.24423624e-04 6.50336000e-05] [ 4.86676534e-04 6.79678195e-04 3.17057625e-05] [-4.86676534e-04 -6.79678195e-04 3.17057615e-05] [ 1.21723352e-04 -4.53882281e-04 1.13053121e-03] [-1.21723353e-04 4.53882288e-04 1.13053122e-03] [-1.23539984e-04 1.40767590e-04 -2.83579508e-04] [ 1.23539987e-04 -1.40767583e-04 -2.83579515e-04] [-4.15112715e-04 -5.24057595e-04 -7.99823133e-04] [ 4.15112715e-04 5.24057595e-04 -7.99823133e-04] [ 3.59971643e-04 -2.04868818e-04 7.99567766e-04] [-3.59971643e-04 2.04868818e-04 7.99567766e-04] [-1.31742506e-03 2.91887056e-04 2.32154079e-04] [ 1.31742505e-03 -2.91887052e-04 2.32154075e-04] [ 1.17953471e-03 8.78602532e-04 -1.08716661e-03] [-1.17953471e-03 -8.78602528e-04 -1.08716661e-03] [-3.11155481e-04 -4.58667606e-04 -7.12198034e-04] [ 3.11155481e-04 4.58667604e-04 -7.12198033e-04] [ 1.32349737e-04 -5.38603233e-04 5.94316224e-04] [-1.32349737e-04 5.38603231e-04 5.94316224e-04] [ 4.30032152e-04 -4.43556329e-04 2.65840848e-04] [-4.30032150e-04 4.43556335e-04 2.65840847e-04] [-7.63930934e-04 -6.09875659e-04 -2.61137043e-04] [ 7.63930933e-04 6.09875665e-04 -2.61137043e-04] [ 7.37137754e-04 4.27402981e-04 7.45148957e-05] [-7.37137753e-04 -4.27402982e-04 7.45148951e-05] [-8.53181978e-04 3.82550592e-04 -5.41746551e-05] [ 8.53181978e-04 -3.82550593e-04 -5.41746544e-05] [ 4.89705268e-05 -1.26545811e-04 1.91277640e-03] [-4.89705273e-05 1.26545809e-04 1.91277640e-03] [-4.41066895e-04 6.26259246e-04 -1.33065790e-03] [ 4.41066895e-04 -6.26259248e-04 -1.33065790e-03] [ 1.64885548e-04 -1.63415227e-04 -7.33557781e-05] [-1.64885550e-04 1.63415228e-04 -7.33557773e-05] [-2.79553000e-05 -5.55749777e-05 6.58669766e-05] [ 2.79553015e-05 5.55749771e-05 6.58669755e-05] [ 5.58910042e-04 8.04118449e-04 -5.18146602e-04] [-5.58910042e-04 -8.04118449e-04 -5.18146601e-04] [-9.82528768e-04 3.38496216e-04 5.03869821e-04] [ 9.82528769e-04 -3.38496216e-04 5.03869821e-04] [ 3.69698385e-05 2.08303378e-04 -7.23467698e-04] [-3.69698371e-05 -2.08303378e-04 -7.23467695e-04] [ 3.12737956e-04 9.64369389e-05 4.49174988e-04] [-3.12737957e-04 -9.64369378e-05 4.49174986e-04] [ 6.94013604e-04 -9.68189143e-05 4.57946221e-05] [-6.94013605e-04 9.68189130e-05 4.57946213e-05] [-9.33909726e-04 -6.68451536e-05 3.76560993e-05] [ 9.33909726e-04 6.68451519e-05 3.76560995e-05] [ 3.56689186e-04 8.19874489e-05 -1.38177520e-04] [-3.56689187e-04 -8.19874489e-05 -1.38177522e-04] [-2.64517206e-04 -1.17253853e-04 2.32564870e-04] [ 2.64517206e-04 1.17253848e-04 2.32564865e-04] [ 1.31078483e-03 1.42335513e-03 8.90863322e-05] [-1.31078483e-03 -1.42335512e-03 8.90863328e-05] [ 1.05977260e-03 -6.42374450e-05 -8.47067773e-08] [-1.05977259e-03 6.42374446e-05 -8.47078353e-08] [-1.27337434e-03 -1.56067986e-04 4.10980670e-05] [ 1.27337434e-03 1.56067986e-04 4.10980671e-05] [ 2.87594498e-04 8.91882215e-04 5.39367018e-05] [-2.87594498e-04 -8.91882243e-04 5.39367030e-05] [ 5.37115009e-04 3.83473414e-05 1.99537378e-04] [-5.37115008e-04 -3.83473404e-05 1.99537373e-04] [-8.00249091e-04 -6.52999121e-04 4.73095319e-04] [ 8.00249091e-04 6.52999122e-04 4.73095323e-04] [-7.62379862e-04 -6.56756916e-04 -4.28099330e-05] [ 7.62379859e-04 6.56756910e-04 -4.28099294e-05] [ 8.41426992e-04 -8.00948514e-04 4.96730606e-04] [-8.41426988e-04 8.00948508e-04 4.96730602e-04]] Final stress: [-1.77322568e-06 -1.88426086e-06 -4.63654868e-06 -1.76757223e-15 -1.54886654e-15 -1.41620359e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-3.11588919e-04 -2.03356839e-03 -4.28111460e-04] [ 3.11588917e-04 2.03356838e-03 -4.28111456e-04] [-4.21527930e-04 2.54648072e-04 1.71620958e-04] [ 4.21527930e-04 -2.54648069e-04 1.71620956e-04] [-6.22489449e-04 -4.56267216e-05 -1.73765815e-05] [ 6.22489449e-04 4.56267223e-05 -1.73765802e-05] [ 1.26007967e-03 1.69819388e-04 -5.39297363e-04] [-1.26007967e-03 -1.69819381e-04 -5.39297355e-04] [ 4.56808496e-04 -3.48836365e-05 1.39969714e-04] [-4.56808495e-04 3.48836372e-05 1.39969713e-04] [-2.21459579e-04 1.49997155e-04 -2.23626739e-04] [ 2.21459579e-04 -1.49997155e-04 -2.23626739e-04] [-1.05176484e-04 8.78949589e-06 1.53338176e-05] [ 1.05176484e-04 -8.78949796e-06 1.53338159e-05] [ 8.77049814e-04 8.37839814e-04 3.37887561e-05] [-8.77049813e-04 -8.37839817e-04 3.37887575e-05] [-9.21118260e-05 -6.28844534e-05 6.69309971e-05] [ 9.21118261e-05 6.28844517e-05 6.69309955e-05] [ 6.03776763e-04 -2.42853906e-04 -8.71695296e-05] [-6.03776763e-04 2.42853905e-04 -8.71695316e-05] [-7.71308270e-04 -9.57174265e-06 9.00799026e-05] [ 7.71308270e-04 9.57174271e-06 9.00799017e-05] [ 6.22935252e-04 -1.02748222e-03 -2.79457628e-04] [-6.22935253e-04 1.02748220e-03 -2.79457625e-04] [ 2.86786433e-04 2.67613662e-05 -3.75944174e-04] [-2.86786434e-04 -2.67613598e-05 -3.75944166e-04] [ 4.44035936e-04 -2.63623697e-05 -3.44173380e-04] [-4.44035936e-04 2.63623754e-05 -3.44173376e-04] [-9.08155956e-04 1.37929444e-04 -4.42897597e-05] [ 9.08155957e-04 -1.37929445e-04 -4.42897606e-05] [ 1.23392071e-04 -1.49718547e-06 -1.67630153e-04] [-1.23392073e-04 1.49718501e-06 -1.67630155e-04] [ 7.50706742e-04 2.00411202e-04 1.93616954e-04] [-7.50706741e-04 -2.00411200e-04 1.93616953e-04] [ 4.64872558e-04 -6.63300690e-04 6.00624665e-05] [-4.64872558e-04 6.63300690e-04 6.00624665e-05] [-5.07106124e-04 -8.09530991e-04 4.04551326e-05] [ 5.07106124e-04 8.09530991e-04 4.04551322e-05] [-9.59951415e-05 -1.15746915e-04 -3.01764889e-04] [ 9.59951454e-05 1.15746912e-04 -3.01764892e-04] [ 1.01938076e-04 4.90669992e-04 1.15991080e-03] [-1.01938080e-04 -4.90669997e-04 1.15991080e-03] [ 3.66001628e-04 2.37116304e-04 7.79311601e-04] [-3.66001628e-04 -2.37116303e-04 7.79311600e-04] [-4.19092866e-04 5.55700663e-04 -7.78522780e-04] [ 4.19092867e-04 -5.55700662e-04 -7.78522780e-04] [ 1.14842251e-03 -8.99540944e-04 -1.06760086e-03] [-1.14842251e-03 8.99540941e-04 -1.06760085e-03] [-1.28642014e-03 -3.04125086e-04 2.02149137e-04] [ 1.28642014e-03 3.04125082e-04 2.02149137e-04] [ 1.37005959e-04 5.22587615e-04 5.96845552e-04] [-1.37005959e-04 -5.22587615e-04 5.96845553e-04] [-3.16532315e-04 4.41046796e-04 -7.18276800e-04] [ 3.16532315e-04 -4.41046795e-04 -7.18276800e-04] [-7.38154114e-04 5.89608708e-04 -2.48727202e-04] [ 7.38154113e-04 -5.89608707e-04 -2.48727202e-04] [ 4.01306699e-04 4.28195179e-04 2.47339996e-04] [-4.01306700e-04 -4.28195177e-04 2.47339997e-04] [-8.41324837e-04 -3.53547542e-04 -6.11002153e-05] [ 8.41324836e-04 3.53547544e-04 -6.11002150e-05] [ 7.25327833e-04 -3.95880046e-04 7.98056822e-05] [-7.25327832e-04 3.95880047e-04 7.98056820e-05] [-4.71844491e-04 -5.96883237e-04 -1.32876200e-03] [ 4.71844489e-04 5.96883236e-04 -1.32876200e-03] [ 8.35701877e-05 1.59335570e-04 1.91705287e-03] [-8.35701844e-05 -1.59335572e-04 1.91705287e-03] [-5.26560237e-06 4.39002921e-05 5.56284592e-05] [ 5.26560340e-06 -4.39002924e-05 5.56284604e-05] [ 1.35587784e-04 1.51702920e-04 -7.03114499e-05] [-1.35587784e-04 -1.51702920e-04 -7.03114523e-05] [-9.96283100e-04 -3.45066389e-04 4.88857297e-04] [ 9.96283099e-04 3.45066391e-04 4.88857296e-04] [ 5.67501597e-04 -8.22989131e-04 -4.98157505e-04] [-5.67501596e-04 8.22989134e-04 -4.98157503e-04] [ 2.91645060e-04 -9.35203358e-05 4.56075634e-04] [-2.91645058e-04 9.35203360e-05 4.56075636e-04] [ 5.51171649e-05 -2.05906990e-04 -7.25905505e-04] [-5.51171664e-05 2.05906990e-04 -7.25905507e-04] [-7.06152381e-04 -1.04908789e-04 5.35223516e-05] [ 7.06152380e-04 1.04908785e-04 5.35223488e-05] [ 9.66754845e-04 -6.72740185e-05 3.83295052e-05] [-9.66754844e-04 6.72740174e-05 3.83295057e-05] [-3.41629399e-04 8.18008974e-05 -1.38667303e-04] [ 3.41629399e-04 -8.18008987e-05 -1.38667303e-04] [ 2.66199030e-04 -1.12265782e-04 2.27927000e-04] [-2.66199029e-04 1.12265777e-04 2.27926996e-04] [-1.25625591e-03 1.43468995e-03 8.98077892e-05] [ 1.25625591e-03 -1.43468995e-03 8.98077894e-05] [-1.11130920e-03 -6.51588519e-05 5.08929654e-07] [ 1.11130919e-03 6.51588508e-05 5.08930914e-07] [ 1.26280367e-03 -1.55263515e-04 4.13286209e-05] [-1.26280367e-03 1.55263516e-04 4.13286212e-05] [-2.85383090e-04 9.09623102e-04 5.47540871e-05] [ 2.85383090e-04 -9.09623087e-04 5.47540869e-05] [-7.88758785e-04 6.42312226e-04 4.84941008e-04] [ 7.88758786e-04 -6.42312226e-04 4.84941003e-04] [ 5.20965427e-04 -5.77025100e-05 1.82220658e-04] [-5.20965428e-04 5.77025102e-05 1.82220664e-04] [ 8.37221600e-04 7.92427568e-04 4.85925437e-04] [-8.37221598e-04 -7.92427566e-04 4.85925432e-04] [-7.59679384e-04 6.46521589e-04 -9.22785417e-06] [ 7.59679385e-04 -6.46521589e-04 -9.22784785e-06]] Final stress: [-1.73904344e-06 -1.90150306e-06 -4.61623282e-06 -3.34631660e-17 4.89996359e-16 1.41091872e-05] Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 2.26115357e-03 4.58102679e-03 6.69515262e-04] [-2.26115357e-03 -4.58102672e-03 6.69515259e-04] [ 3.73399438e-03 -7.81431788e-05 -8.38455659e-04] [-3.73399438e-03 7.81431675e-05 -8.38455654e-04] [ 2.84054955e-03 -1.32694300e-03 7.78150237e-04] [-2.84054955e-03 1.32694299e-03 7.78150232e-04] [-8.54521090e-03 -3.07819988e-03 4.03090654e-03] [ 8.54521090e-03 3.07819993e-03 4.03090659e-03] [-2.72354396e-03 1.36501957e-04 -6.59280123e-04] [ 2.72354396e-03 -1.36501957e-04 -6.59280131e-04] [ 2.25582759e-04 1.00482236e-03 1.18520140e-04] [-2.25582759e-04 -1.00482237e-03 1.18520127e-04] [-2.79583696e-04 3.16312218e-04 2.51682939e-03] [ 2.79583694e-04 -3.16312217e-04 2.51682936e-03] [-9.40305701e-03 7.57631859e-04 3.85171977e-03] [ 9.40305701e-03 -7.57631900e-04 3.85171979e-03] [-1.08147130e-03 1.68465031e-04 1.48828267e-04] [ 1.08147130e-03 -1.68465049e-04 1.48828251e-04] [ 8.07560646e-04 -3.40150519e-04 -8.97583306e-04] [-8.07560646e-04 3.40150513e-04 -8.97583329e-04] [ 7.19686943e-03 6.17721798e-04 3.51586595e-04] [-7.19686943e-03 -6.17721805e-04 3.51586588e-04] [-1.61994123e-03 5.45389368e-03 9.35963524e-04] [ 1.61994123e-03 -5.45389360e-03 9.35963510e-04] [-2.53883074e-04 1.60053201e-03 -2.52993672e-03] [ 2.53883072e-04 -1.60053196e-03 -2.52993667e-03] [ 7.49643853e-05 -3.71861599e-03 -4.12141318e-03] [-7.49643857e-05 3.71861596e-03 -4.12141314e-03] [ 6.12877424e-03 9.61649717e-04 1.38191013e-03] [-6.12877424e-03 -9.61649721e-04 1.38191013e-03] [-3.34248684e-03 -8.90601163e-04 -7.14000328e-04] [ 3.34248685e-03 8.90601158e-04 -7.14000331e-04] [-4.15386261e-03 -2.20140745e-03 -7.77872557e-04] [ 4.15386261e-03 2.20140744e-03 -7.77872554e-04] [-5.08121711e-03 4.20110205e-03 3.78389839e-04] [ 5.08121711e-03 -4.20110205e-03 3.78389849e-04] [ 1.83384620e-03 4.18286654e-03 1.86809043e-03] [-1.83384621e-03 -4.18286655e-03 1.86809041e-03] [ 5.82811458e-04 -9.40674410e-04 6.27176324e-03] [-5.82811442e-04 9.40674416e-04 6.27176324e-03] [-1.28480911e-03 -2.27179424e-03 -6.80513023e-03] [ 1.28480911e-03 2.27179425e-03 -6.80513023e-03] [-2.11080109e-03 -5.02580222e-03 -4.10524787e-03] [ 2.11080109e-03 5.02580223e-03 -4.10524788e-03] [ 1.28702854e-03 -2.74234995e-03 5.03913167e-03] [-1.28702854e-03 2.74234995e-03 5.03913167e-03] [-4.88184390e-03 5.29153871e-03 7.03835356e-03] [ 4.88184389e-03 -5.29153869e-03 7.03835355e-03] [ 4.94674347e-03 2.14383149e-03 -3.81535221e-03] [-4.94674346e-03 -2.14383147e-03 -3.81535219e-03] [-2.21693484e-03 -4.56613291e-03 -3.96491810e-03] [ 2.21693484e-03 4.56613291e-03 -3.96491809e-03] [ 2.93535471e-04 -3.47883463e-03 1.94507209e-03] [-2.93535463e-04 3.47883462e-03 1.94507208e-03] [ 1.02219499e-04 -9.04658145e-03 2.13061260e-04] [-1.02219476e-04 9.04658150e-03 2.13061243e-04] [-7.19182371e-03 -2.44613436e-03 -2.23400245e-03] [ 7.19182368e-03 2.44613441e-03 -2.23400243e-03] [ 3.90542048e-03 8.29550947e-04 -1.95346305e-03] [-3.90542047e-03 -8.29550942e-04 -1.95346306e-03] [-4.31003985e-03 -5.97960544e-04 9.17438750e-04] [ 4.31003985e-03 5.97960546e-04 9.17438754e-04] [ 5.64500547e-03 2.13194924e-03 6.08737407e-03] [-5.64500548e-03 -2.13194924e-03 6.08737407e-03] [-4.64190574e-03 -2.39186230e-04 -1.05833359e-02] [ 4.64190575e-03 2.39186236e-04 -1.05833359e-02] [-8.69296088e-04 -4.18248923e-04 2.97762247e-03] [ 8.69296079e-04 4.18248923e-04 2.97762250e-03] [ 2.45404055e-03 1.22108012e-03 -1.66055657e-03] [-2.45404054e-03 -1.22108012e-03 -1.66055659e-03] [ 4.63782011e-03 3.13589553e-03 -3.32057307e-03] [-4.63782013e-03 -3.13589549e-03 -3.32057309e-03] [-8.18249486e-03 1.47114242e-03 3.05668683e-03] [ 8.18249487e-03 -1.47114238e-03 3.05668684e-03] [ 9.94057715e-04 -1.06702299e-04 -2.55912643e-03] [-9.94057700e-04 1.06702301e-04 -2.55912640e-03] [-5.37298883e-04 -1.45418629e-03 3.93628337e-03] [ 5.37298865e-04 1.45418629e-03 3.93628335e-03] [ 3.20864457e-03 -1.26714501e-03 5.08388164e-04] [-3.20864456e-03 1.26714499e-03 5.08388137e-04] [-3.25276954e-03 3.31239450e-04 -2.30267239e-05] [ 3.25276953e-03 -3.31239460e-04 -2.30267228e-05] [ 2.43502130e-03 8.32997689e-04 -1.17200239e-03] [-2.43502130e-03 -8.32997686e-04 -1.17200240e-03] [-3.63739331e-03 3.57870613e-03 -2.66910814e-03] [ 3.63739331e-03 -3.57870618e-03 -2.66910817e-03] [ 2.35306923e-04 -5.25808740e-03 -6.48749418e-04] [-2.35306923e-04 5.25808736e-03 -6.48749411e-04] [ 7.53831133e-03 -1.86845727e-04 -4.85878749e-04] [-7.53831134e-03 1.86845712e-04 -4.85878747e-04] [-5.25356849e-03 -7.65355149e-04 8.81669438e-04] [ 5.25356850e-03 7.65355162e-04 8.81669425e-04] [-8.69709679e-04 -3.14616029e-03 1.12783109e-04] [ 8.69709676e-04 3.14616023e-03 1.12783122e-04] [ 3.55579314e-03 -1.68568888e-03 -3.78176043e-03] [-3.55579312e-03 1.68568886e-03 -3.78176045e-03] [-3.95358319e-03 -2.76984875e-03 4.31622006e-04] [ 3.95358317e-03 2.76984872e-03 4.31622026e-04] [-7.16853737e-03 -7.70377675e-03 8.00728794e-04] [ 7.16853736e-03 7.70377671e-03 8.00728766e-04] [ 4.28338987e-03 -2.23917239e-03 3.07238470e-03] [-4.28338985e-03 2.23917236e-03 3.07238473e-03]] Final stress: [-1.58909920e-05 5.47794304e-06 -1.64372362e-05 -1.51898871e-15 -7.46945666e-15 -8.25624042e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.38642415e-03 1.91060376e-03 2.48199455e-04] [ 2.38642415e-03 -1.91060376e-03 2.48199459e-04] [-2.50290823e-03 1.67369920e-04 -5.70521867e-04] [ 2.50290823e-03 -1.67369922e-04 -5.70521868e-04] [-2.89104918e-03 -1.17004708e-03 6.92675943e-04] [ 2.89104918e-03 1.17004708e-03 6.92675935e-04] [ 7.11018411e-03 -3.46813774e-03 4.18619363e-03] [-7.11018410e-03 3.46813773e-03 4.18619363e-03] [ 2.75348997e-03 -3.58488836e-05 -7.46435260e-04] [-2.75348998e-03 3.58488825e-05 -7.46435255e-04] [-7.99543154e-04 1.06846548e-03 3.21333246e-05] [ 7.99543155e-04 -1.06846548e-03 3.21333167e-05] [-1.28204721e-03 4.22601074e-04 2.90089000e-03] [ 1.28204721e-03 -4.22601069e-04 2.90089001e-03] [ 6.63334615e-03 1.75844192e-03 3.94914049e-03] [-6.63334615e-03 -1.75844192e-03 3.94914048e-03] [ 1.61050309e-03 1.27526735e-04 3.07842469e-04] [-1.61050309e-03 -1.27526728e-04 3.07842477e-04] [-1.98265779e-04 -5.67359311e-04 -1.21904288e-03] [ 1.98265780e-04 5.67359316e-04 -1.21904288e-03] [-5.68350209e-03 7.35576926e-04 7.98539701e-04] [ 5.68350209e-03 -7.35576943e-04 7.98539717e-04] [ 3.81917352e-04 4.69763273e-03 6.35674100e-04] [-3.81917353e-04 -4.69763273e-03 6.35674100e-04] [ 5.11177273e-04 2.39127135e-03 -3.80968353e-03] [-5.11177272e-04 -2.39127137e-03 -3.80968355e-03] [ 1.88953641e-03 -3.94369029e-03 -4.60185242e-03] [-1.88953641e-03 3.94369030e-03 -4.60185242e-03] [-6.30412937e-03 9.26562541e-04 1.24504236e-03] [ 6.30412938e-03 -9.26562540e-04 1.24504236e-03] [ 3.83825261e-03 -7.86816624e-04 -8.60808572e-04] [-3.83825261e-03 7.86816625e-04 -8.60808568e-04] [ 3.43339517e-03 -1.80678948e-03 -5.02108709e-04] [-3.43339517e-03 1.80678947e-03 -5.02108706e-04] [ 1.98873529e-03 -4.77554200e-03 7.24921124e-04] [-1.98873529e-03 4.77554201e-03 7.24921111e-04] [-4.95461189e-03 -5.38941307e-03 1.63692190e-03] [ 4.95461188e-03 5.38941307e-03 1.63692191e-03] [-2.39026971e-03 1.13158679e-03 -4.75266737e-03] [ 2.39026971e-03 -1.13158679e-03 -4.75266737e-03] [ 1.96292035e-03 2.80420301e-04 4.91681057e-03] [-1.96292034e-03 -2.80420297e-04 4.91681057e-03] [ 1.35431210e-03 1.42958844e-03 4.29900376e-03] [-1.35431211e-03 -1.42958844e-03 4.29900376e-03] [-2.08083687e-03 3.71859483e-03 -3.58614403e-03] [ 2.08083687e-03 -3.71859483e-03 -3.58614403e-03] [ 4.54970211e-03 -2.29436683e-03 -2.15951389e-03] [-4.54970210e-03 2.29436684e-03 -2.15951388e-03] [-4.89752509e-03 -4.59616603e-03 4.28963704e-03] [ 4.89752509e-03 4.59616603e-03 4.28963703e-03] [ 6.17844370e-04 2.83596703e-03 2.11970837e-03] [-6.17844373e-04 -2.83596703e-03 2.11970837e-03] [-2.58596976e-03 4.14889527e-03 -4.36957403e-03] [ 2.58596975e-03 -4.14889526e-03 -4.36957402e-03] [-8.32075291e-03 1.57993670e-03 -1.86458151e-03] [ 8.32075291e-03 -1.57993672e-03 -1.86458150e-03] [ 4.14664060e-04 8.68818580e-03 -5.63939047e-04] [-4.14664064e-04 -8.68818582e-03 -5.63939050e-04] [-4.83007740e-03 -1.08177998e-05 3.31250456e-05] [ 4.83007740e-03 1.08177971e-05 3.31250491e-05] [ 4.26689992e-03 -1.32441862e-03 -1.00096111e-03] [-4.26689993e-03 1.32441861e-03 -1.00096111e-03] [-4.29699846e-03 -1.12692917e-03 -7.76114274e-03] [ 4.29699847e-03 1.12692916e-03 -7.76114274e-03] [ 5.27609228e-03 -2.70113266e-03 4.07343057e-03] [-5.27609229e-03 2.70113266e-03 4.07343057e-03] [ 2.16955669e-03 -2.91286387e-03 -1.57199752e-03] [-2.16955669e-03 2.91286388e-03 -1.57199753e-03] [-8.44623207e-04 -1.12522382e-03 2.59303942e-03] [ 8.44623201e-04 1.12522382e-03 2.59303943e-03] [-7.60590268e-03 -1.60663916e-03 4.14828448e-03] [ 7.60590268e-03 1.60663914e-03 4.14828449e-03] [ 3.35149434e-03 -4.15311290e-03 -4.24405129e-03] [-3.35149434e-03 4.15311288e-03 -4.24405130e-03] [ 3.55065381e-05 1.15092723e-04 3.22990038e-03] [-3.55065388e-05 -1.15092722e-04 3.22990037e-03] [ 5.21040170e-04 -1.34939271e-03 -1.67516369e-03] [-5.21040168e-04 1.34939271e-03 -1.67516368e-03] [-2.13216486e-03 -1.72470318e-03 8.00398318e-04] [ 2.13216486e-03 1.72470321e-03 8.00398331e-04] [ 2.63593744e-03 1.76735584e-04 -3.64195212e-05] [-2.63593743e-03 -1.76735576e-04 -3.64195266e-05] [-3.84755577e-03 8.99767770e-04 -1.28300873e-03] [ 3.84755577e-03 -8.99767769e-04 -1.28300873e-03] [ 2.40982458e-03 3.80821994e-03 -2.75519509e-03] [-2.40982458e-03 -3.80821994e-03 -2.75519508e-03] [ 7.76025906e-04 -2.99533996e-03 -3.66478235e-04] [-7.76025902e-04 2.99533996e-03 -3.66478236e-04] [-6.21186001e-03 -1.83112708e-04 -3.41308847e-04] [ 6.21186001e-03 1.83112715e-04 -3.41308850e-04] [ 6.19254963e-03 -8.92216992e-04 9.26180826e-04] [-6.19254963e-03 8.92216985e-04 9.26180835e-04] [ 4.20026152e-04 -2.69775296e-03 -4.76226840e-06] [-4.20026159e-04 2.69775295e-03 -4.76226841e-06] [-4.56969597e-03 2.38122979e-03 -3.30394203e-04] [ 4.56969596e-03 -2.38122978e-03 -3.30394200e-04] [ 3.42009759e-03 4.47983547e-04 -2.96526200e-03] [-3.42009759e-03 -4.47983541e-04 -2.96526201e-03] [ 3.80488392e-03 1.84267797e-03 2.85934756e-03] [-3.80488392e-03 -1.84267796e-03 2.85934757e-03] [-7.12563419e-03 7.47852975e-03 2.29597751e-03] [ 7.12563419e-03 -7.47852975e-03 2.29597750e-03]] Final stress: [-9.25158239e-06 -5.16057768e-07 -1.31464823e-05 -5.04935270e-15 2.41890884e-15 7.62856860e-05] Minimization converged after 19 steps. Minimization converged after 17 steps. Minimization converged after 20 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 27 steps. Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.04020430e-03 4.41020495e-04 -1.05258860e-05] [-1.04020430e-03 -4.41020477e-04 -1.05258899e-05] [ 9.32986340e-04 8.16879353e-05 6.73735866e-05] [-9.32986339e-04 -8.16879403e-05 6.73735866e-05] [ 1.35198429e-03 -2.90532492e-04 1.27433784e-04] [-1.35198429e-03 2.90532488e-04 1.27433783e-04] [-2.19464663e-03 -4.33958654e-04 5.61153933e-04] [ 2.19464663e-03 4.33958647e-04 5.61153925e-04] [-6.80643097e-04 1.15571060e-04 -3.90749562e-05] [ 6.80643099e-04 -1.15571058e-04 -3.90749578e-05] [ 3.35577459e-04 2.63060106e-04 -1.42024137e-04] [-3.35577459e-04 -2.63060106e-04 -1.42024141e-04] [-1.19346495e-04 1.22053225e-04 3.19413725e-04] [ 1.19346495e-04 -1.22053226e-04 3.19413726e-04] [-2.58436790e-03 4.61590382e-04 1.03103130e-03] [ 2.58436791e-03 -4.61590390e-04 1.03103130e-03] [-3.71964839e-04 1.75024677e-04 -4.64957345e-05] [ 3.71964839e-04 -1.75024679e-04 -4.64957386e-05] [-1.69872743e-04 -2.60436892e-04 -2.47079283e-05] [ 1.69872742e-04 2.60436893e-04 -2.47079227e-05] [ 2.40450258e-03 1.59723588e-04 1.45266544e-04] [-2.40450258e-03 -1.59723590e-04 1.45266545e-04] [-6.06422350e-04 4.82547745e-04 1.52773077e-04] [ 6.06422351e-04 -4.82547734e-04 1.52773073e-04] [-4.47292208e-04 -1.47897817e-05 -5.44479129e-04] [ 4.47292209e-04 1.47897795e-05 -5.44479137e-04] [-5.98050878e-04 -7.47307265e-04 -1.08089548e-03] [ 5.98050880e-04 7.47307265e-04 -1.08089547e-03] [ 1.84895662e-03 2.63803751e-04 6.07462902e-04] [-1.84895662e-03 -2.63803751e-04 6.07462903e-04] [-6.23278939e-04 -2.55254365e-04 -3.42013583e-04] [ 6.23278941e-04 2.55254367e-04 -3.42013581e-04] [-1.71678705e-03 -4.65386337e-04 -1.77709740e-04] [ 1.71678705e-03 4.65386331e-04 -1.77709741e-04] [-1.64647792e-03 1.93496251e-03 3.69627597e-04] [ 1.64647792e-03 -1.93496251e-03 3.69627597e-04] [ 1.10997546e-03 1.95728525e-03 2.84125195e-04] [-1.10997546e-03 -1.95728525e-03 2.84125194e-04] [ 6.36719901e-04 -2.51469108e-04 1.86514295e-03] [-6.36719904e-04 2.51469109e-04 1.86514295e-03] [-9.99469039e-04 -2.37233940e-04 -1.53945070e-03] [ 9.99469044e-04 2.37233946e-04 -1.53945070e-03] [-6.83294252e-04 -1.58679923e-03 -1.59565097e-03] [ 6.83294248e-04 1.58679923e-03 -1.59565097e-03] [ 6.21658132e-04 -6.30350675e-04 1.56095702e-03] [-6.21658131e-04 6.30350676e-04 1.56095702e-03] [-1.06671673e-03 1.52084799e-03 1.64065226e-03] [ 1.06671673e-03 -1.52084799e-03 1.64065226e-03] [ 9.26144925e-04 9.38135485e-04 -1.35340698e-03] [-9.26144927e-04 -9.38135482e-04 -1.35340697e-03] [-4.33697372e-04 -9.70657056e-04 -1.40868486e-03] [ 4.33697374e-04 9.70657057e-04 -1.40868486e-03] [ 2.54427035e-05 -8.14934630e-04 8.16965355e-04] [-2.54427026e-05 8.14934627e-04 8.16965354e-04] [ 8.52825732e-04 -1.83154382e-03 3.01006013e-04] [-8.52825735e-04 1.83154382e-03 3.01006014e-04] [-2.22298243e-03 -1.11718913e-03 -4.47746456e-04] [ 2.22298243e-03 1.11718913e-03 -4.47746458e-04] [ 1.82198146e-03 7.06758113e-04 -2.10861451e-04] [-1.82198146e-03 -7.06758112e-04 -2.10861452e-04] [-1.86142851e-03 5.98649054e-05 1.05582628e-04] [ 1.86142851e-03 -5.98649053e-05 1.05582627e-04] [ 1.01927976e-03 1.07831541e-03 2.07073859e-03] [-1.01927976e-03 -1.07831540e-03 2.07073860e-03] [-1.35097031e-03 9.23632949e-04 -2.74715937e-03] [ 1.35097031e-03 -9.23632947e-04 -2.74715937e-03] [ 2.75907830e-05 3.66012046e-04 1.09261305e-03] [-2.75907883e-05 -3.66012045e-04 1.09261305e-03] [ 5.01353183e-04 7.80747257e-04 -5.07415539e-04] [-5.01353180e-04 -7.80747256e-04 -5.07415538e-04] [ 1.92259436e-03 1.18032676e-03 -1.62741905e-03] [-1.92259436e-03 -1.18032676e-03 -1.62741905e-03] [-2.54752907e-03 1.18419662e-03 1.34081706e-03] [ 2.54752907e-03 -1.18419661e-03 1.34081705e-03] [ 3.42248914e-04 4.26739360e-04 -1.17364931e-03] [-3.42248918e-04 -4.26739363e-04 -1.17364931e-03] [ 5.94872999e-05 1.46976143e-04 1.02223904e-03] [-5.94873015e-05 -1.46976142e-04 1.02223904e-03] [ 1.00290623e-03 -3.57816016e-05 -9.75237483e-05] [-1.00290622e-03 3.57816052e-05 -9.75237489e-05] [-7.55524949e-04 5.09013553e-05 7.61847609e-05] [ 7.55524951e-04 -5.09013571e-05 7.61847609e-05] [ 1.05488384e-03 2.57775168e-04 -4.87458378e-04] [-1.05488384e-03 -2.57775168e-04 -4.87458379e-04] [-9.52635219e-04 4.36045608e-04 -3.25122233e-04] [ 9.52635220e-04 -4.36045605e-04 -3.25122228e-04] [-5.54632831e-04 -5.17168389e-04 -1.45717953e-04] [ 5.54632830e-04 5.17168377e-04 -1.45717952e-04] [ 1.87104514e-03 -9.74316115e-05 -2.32101535e-04] [-1.87104514e-03 9.74316108e-05 -2.32101535e-04] [-2.65280484e-03 -3.46158673e-04 2.04745261e-04] [ 2.65280484e-03 3.46158674e-04 2.04745255e-04] [-1.25364704e-04 -1.68575968e-04 1.19789826e-04] [ 1.25364703e-04 1.68575958e-04 1.19789828e-04] [ 1.19596360e-03 -3.54909440e-04 -9.13465234e-04] [-1.19596360e-03 3.54909439e-04 -9.13465229e-04] [-1.11275599e-03 -6.17716070e-04 6.76236458e-04] [ 1.11275599e-03 6.17716067e-04 6.76236451e-04] [-2.04709670e-03 -1.90378208e-03 6.52905010e-05] [ 2.04709671e-03 1.90378208e-03 6.52905060e-05] [ 1.61821971e-03 -1.14004461e-03 5.96137922e-04] [-1.61821971e-03 1.14004461e-03 5.96137916e-04]] Final stress: [-5.73336678e-06 2.14645152e-06 -1.69427879e-05 9.75212259e-16 -4.62269733e-15 -3.52471617e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-8.06616743e-04 -3.76359690e-03 -8.31930593e-04] [ 8.06616748e-04 3.76359690e-03 -8.31930594e-04] [-9.92201567e-04 7.79501163e-04 3.38005913e-04] [ 9.92201568e-04 -7.79501161e-04 3.38005909e-04] [-1.61142238e-03 -3.09783670e-04 6.77416430e-05] [ 1.61142238e-03 3.09783671e-04 6.77416418e-05] [ 2.96932342e-03 7.12500974e-04 -1.56182772e-03] [-2.96932342e-03 -7.12500975e-04 -1.56182770e-03] [ 1.00740465e-03 -5.49883130e-06 4.78750942e-04] [-1.00740465e-03 5.49884164e-06 4.78750938e-04] [-4.65928011e-04 4.79247210e-04 -6.43890189e-04] [ 4.65928012e-04 -4.79247209e-04 -6.43890180e-04] [ 2.08681484e-05 1.60634892e-04 4.62832406e-05] [-2.08681483e-05 -1.60634899e-04 4.62832275e-05] [ 2.63094104e-03 2.43054466e-03 8.47263413e-04] [-2.63094104e-03 -2.43054466e-03 8.47263416e-04] [-1.09629191e-04 -7.33138236e-05 9.99089042e-05] [ 1.09629189e-04 7.33138253e-05 9.99089063e-05] [ 1.03555350e-03 -8.04624675e-04 6.28889640e-06] [-1.03555350e-03 8.04624680e-04 6.28890125e-06] [-2.23844952e-03 4.25613905e-05 5.61276613e-05] [ 2.23844952e-03 -4.25613945e-05 5.61276652e-05] [ 1.47710718e-03 -2.39836072e-03 -6.60437549e-04] [-1.47710717e-03 2.39836070e-03 -6.60437544e-04] [ 8.52247520e-04 -5.85496918e-04 -3.96356846e-04] [-8.52247526e-04 5.85496926e-04 -3.96356843e-04] [ 8.95671287e-04 -8.10787767e-04 -1.59009465e-03] [-8.95671282e-04 8.10787764e-04 -1.59009464e-03] [-2.38831701e-03 4.89658615e-04 3.37615115e-04] [ 2.38831702e-03 -4.89658613e-04 3.37615112e-04] [ 1.31375726e-04 -1.64580619e-04 -5.87641114e-04] [-1.31375726e-04 1.64580617e-04 -5.87641113e-04] [ 1.84075987e-03 -3.10310966e-05 4.05314973e-04] [-1.84075987e-03 3.10310977e-05 4.05314971e-04] [ 1.19122165e-03 -1.92136353e-03 2.64417220e-04] [-1.19122164e-03 1.92136353e-03 2.64417222e-04] [-1.80140684e-03 -2.13245115e-03 2.09452664e-04] [ 1.80140684e-03 2.13245115e-03 2.09452665e-04] [-5.25617464e-04 -6.14906187e-04 -5.35295850e-04] [ 5.25617462e-04 6.14906187e-04 -5.35295847e-04] [ 2.06671245e-04 9.74527653e-04 2.84607618e-03] [-2.06671239e-04 -9.74527652e-04 2.84607617e-03] [ 9.65618676e-04 4.04310767e-04 2.00427122e-03] [-9.65618677e-04 -4.04310767e-04 2.00427121e-03] [-1.11606712e-03 1.87895212e-03 -2.03588377e-03] [ 1.11606712e-03 -1.87895212e-03 -2.03588377e-03] [ 2.89849064e-03 -1.94450553e-03 -2.14873006e-03] [-2.89849064e-03 1.94450552e-03 -2.14873006e-03] [-2.92558192e-03 -1.04596812e-03 4.49158736e-04] [ 2.92558192e-03 1.04596812e-03 4.49158739e-04] [ 5.78469776e-06 1.09008618e-03 1.16433434e-03] [-5.78469474e-06 -1.09008618e-03 1.16433434e-03] [-7.77972507e-04 9.41740881e-04 -1.66307786e-03] [ 7.77972506e-04 -9.41740886e-04 -1.66307787e-03] [-2.46110731e-03 1.39313527e-03 -6.15542308e-04] [ 2.46110731e-03 -1.39313526e-03 -6.15542317e-04] [ 7.71257444e-04 1.15693595e-03 7.53355364e-04] [-7.71257449e-04 -1.15693593e-03 7.53355377e-04] [-2.11093672e-03 -4.77391173e-04 -3.46189032e-06] [ 2.11093672e-03 4.77391174e-04 -3.46189199e-06] [ 1.86653608e-03 -1.00767560e-03 6.04817186e-05] [-1.86653608e-03 1.00767560e-03 6.04817197e-05] [-8.62510744e-04 -1.31844420e-03 -3.66160976e-03] [ 8.62510743e-04 1.31844419e-03 -3.66160976e-03] [-3.34858267e-04 8.23546500e-05 4.34212692e-03] [ 3.34858277e-04 -8.23546570e-05 4.34212692e-03] [ 3.55249665e-04 -3.83064818e-04 1.37793452e-04] [-3.55249668e-04 3.83064821e-04 1.37793453e-04] [ 6.89390572e-04 1.94335805e-04 5.57252531e-04] [-6.89390576e-04 -1.94335809e-04 5.57252526e-04] [-2.86865248e-03 -1.02123447e-03 1.12741093e-03] [ 2.86865249e-03 1.02123447e-03 1.12741093e-03] [ 1.47893008e-03 -1.84633690e-03 -1.59940688e-03] [-1.47893008e-03 1.84633690e-03 -1.59940687e-03] [ 7.69231871e-04 -1.39549253e-04 7.98491049e-04] [-7.69231869e-04 1.39549248e-04 7.98491057e-04] [ 6.34385537e-04 -6.78020254e-04 -1.89363076e-03] [-6.34385534e-04 6.78020249e-04 -1.89363077e-03] [-1.73097730e-03 1.45531789e-04 -2.50871248e-04] [ 1.73097730e-03 -1.45531785e-04 -2.50871249e-04] [ 1.75307501e-03 -8.12983266e-05 1.55895835e-04] [-1.75307501e-03 8.12983264e-05 1.55895834e-04] [-9.59727498e-04 4.67912971e-04 -7.45077392e-04] [ 9.59727493e-04 -4.67912966e-04 -7.45077393e-04] [ 8.01781363e-04 -3.57442316e-04 6.81823420e-04] [-8.01781362e-04 3.57442305e-04 6.81823409e-04] [-2.81244324e-03 2.14268744e-03 7.43904986e-05] [ 2.81244324e-03 -2.14268743e-03 7.43905016e-05] [-2.16932910e-03 -2.54546023e-04 -1.54859005e-04] [ 2.16932910e-03 2.54546016e-04 -1.54859000e-04] [ 3.19557226e-03 -6.95054752e-04 3.08038121e-04] [-3.19557226e-03 6.95054756e-04 3.08038116e-04] [-8.95842425e-04 2.57882023e-03 2.19697040e-04] [ 8.95842419e-04 -2.57882023e-03 2.19697036e-04] [-1.63268148e-03 1.35104415e-03 1.47524668e-03] [ 1.63268147e-03 -1.35104415e-03 1.47524668e-03] [ 1.33491106e-03 -1.88567624e-04 3.50917430e-04] [-1.33491107e-03 1.88567620e-04 3.50917434e-04] [ 1.97097640e-03 1.58179389e-03 1.17236973e-03] [-1.97097639e-03 -1.58179389e-03 1.17236972e-03] [-1.76296185e-03 1.54587141e-03 -2.56676334e-04] [ 1.76296184e-03 -1.54587141e-03 -2.56676319e-04]] Final stress: [-1.05351351e-05 5.13257767e-06 -1.95855339e-05 8.11720792e-15 6.30063607e-15 4.44425026e-05] Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 118 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-1.04117733e-04 -4.46899184e-05 -1.60271527e-06] [ 1.04117733e-04 4.46899128e-05 -1.60271472e-06] [-1.75592030e-04 7.91437344e-05 3.12225446e-05] [ 1.75592029e-04 -7.91437337e-05 3.12225445e-05] [-1.89411124e-04 -5.50958723e-05 5.73766396e-05] [ 1.89411124e-04 5.50958727e-05 5.73766400e-05] [ 4.14169384e-04 9.43506783e-07 -3.15534660e-05] [-4.14169383e-04 -9.43508738e-07 -3.15534684e-05] [ 1.10581640e-04 5.16410773e-06 3.67735477e-05] [-1.10581640e-04 -5.16410665e-06 3.67735482e-05] [-9.48739698e-05 6.06711348e-05 -6.37454757e-05] [ 9.48739698e-05 -6.06711347e-05 -6.37454765e-05] [ 4.64615065e-06 4.47154267e-05 7.57246473e-05] [-4.64615058e-06 -4.47154261e-05 7.57246486e-05] [ 3.85256407e-04 2.83644780e-04 2.73354114e-04] [-3.85256407e-04 -2.83644775e-04 2.73354113e-04] [ 7.66807434e-06 2.32151672e-05 1.82532287e-05] [-7.66807446e-06 -2.32151674e-05 1.82532280e-05] [ 1.29274609e-04 -1.01682376e-04 8.07146333e-06] [-1.29274608e-04 1.01682374e-04 8.07146370e-06] [-2.89586445e-04 3.57700196e-05 6.26535381e-06] [ 2.89586445e-04 -3.57700187e-05 6.26535410e-06] [ 1.95594582e-04 -2.15191099e-05 -2.24050546e-05] [-1.95594581e-04 2.15191071e-05 -2.24050533e-05] [ 1.30888721e-04 -4.73756306e-05 -5.10665371e-05] [-1.30888721e-04 4.73756322e-05 -5.10665347e-05] [ 7.39400800e-05 -2.81191132e-04 -3.22011048e-04] [-7.39400802e-05 2.81191131e-04 -3.22011048e-04] [-2.82474117e-04 4.70690992e-05 1.44937269e-04] [ 2.82474118e-04 -4.70690998e-05 1.44937270e-04] [ 3.18722945e-05 -4.14955452e-05 -8.20822298e-05] [-3.18722936e-05 4.14955456e-05 -8.20822300e-05] [ 2.83099353e-04 -1.05167619e-04 1.52314213e-06] [-2.83099352e-04 1.05167620e-04 1.52314113e-06] [ 1.51484774e-04 -2.28577313e-04 7.49554485e-05] [-1.51484775e-04 2.28577314e-04 7.49554485e-05] [-2.14859284e-04 -2.48299361e-04 3.86847085e-05] [ 2.14859284e-04 2.48299361e-04 3.86847084e-05] [-1.12530484e-04 4.01709043e-06 -1.39082179e-04] [ 1.12530483e-04 -4.01709102e-06 -1.39082180e-04] [ 3.12091365e-06 1.01771859e-04 3.10772587e-04] [-3.12091462e-06 -1.01771859e-04 3.10772587e-04] [ 1.25999953e-04 5.99416197e-05 2.47576083e-04] [-1.25999954e-04 -5.99416199e-05 2.47576083e-04] [-1.48482099e-04 2.58718050e-04 -3.28498665e-04] [ 1.48482099e-04 -2.58718050e-04 -3.28498665e-04] [ 3.72647047e-04 -1.57664825e-04 -2.92533181e-04] [-3.72647047e-04 1.57664824e-04 -2.92533179e-04] [-3.57637363e-04 -2.20252857e-04 2.61126876e-04] [ 3.57637363e-04 2.20252855e-04 2.61126876e-04] [ 1.22612073e-05 1.49840809e-04 1.37567773e-04] [-1.22612072e-05 -1.49840808e-04 1.37567771e-04] [-7.62162622e-05 1.93670639e-04 -2.56261003e-04] [ 7.62162627e-05 -1.93670639e-04 -2.56261003e-04] [-4.46445815e-04 1.14993476e-04 -9.93728091e-05] [ 4.46445815e-04 -1.14993479e-04 -9.93728073e-05] [ 4.92924812e-05 2.32716692e-04 7.44738134e-05] [-4.92924796e-05 -2.32716695e-04 7.44738119e-05] [-2.99562166e-04 -5.06591854e-05 2.17079729e-05] [ 2.99562166e-04 5.06591846e-05 2.17079720e-05] [ 2.78613593e-04 -1.75344877e-04 -4.72050708e-06] [-2.78613593e-04 1.75344877e-04 -4.72050681e-06] [-1.15560441e-04 -6.22200459e-05 -5.82364114e-04] [ 1.15560440e-04 6.22200444e-05 -5.82364116e-04] [-6.84554607e-06 -8.07824775e-05 4.66768844e-04] [ 6.84554565e-06 8.07824774e-05 4.66768843e-04] [ 4.82164079e-05 -5.30672076e-05 7.48012439e-05] [-4.82164084e-05 5.30672074e-05 7.48012444e-05] [ 1.78533728e-04 7.13763503e-05 1.41600078e-04] [-1.78533727e-04 -7.13763504e-05 1.41600077e-04] [-4.60470027e-04 -1.34848873e-04 1.64717689e-04] [ 4.60470029e-04 1.34848873e-04 1.64717690e-04] [ 2.67100051e-04 -1.02867469e-04 -2.78887829e-04] [-2.67100052e-04 1.02867469e-04 -2.78887828e-04] [ 1.35853469e-04 3.67455008e-05 1.43446139e-04] [-1.35853471e-04 -3.67455012e-05 1.43446137e-04] [ 7.87060944e-05 -6.76043798e-05 -2.81171651e-04] [-7.87060934e-05 6.76043795e-05 -2.81171649e-04] [-1.80875376e-04 4.94320135e-05 -1.19536253e-04] [ 1.80875375e-04 -4.94320147e-05 -1.19536255e-04] [ 2.21497178e-04 8.22751340e-06 1.15788139e-05] [-2.21497177e-04 -8.22751337e-06 1.15788142e-05] [-1.13663651e-04 1.06535990e-04 -1.36720157e-04] [ 1.13663650e-04 -1.06535990e-04 -1.36720157e-04] [ 1.42655871e-04 1.96662665e-05 4.93346486e-05] [-1.42655870e-04 -1.96662643e-05 4.93346516e-05] [-3.32320056e-04 -2.58737171e-05 -4.56873203e-06] [ 3.32320058e-04 2.58737198e-05 -4.56873306e-06] [-2.97820426e-04 -2.48623608e-05 -4.87027207e-05] [ 2.97820425e-04 2.48623611e-05 -4.87027203e-05] [ 3.89036433e-04 -1.43718255e-04 7.39663056e-05] [-3.89036434e-04 1.43718253e-04 7.39663065e-05] [-9.97404015e-05 1.23153136e-04 2.44780887e-05] [ 9.97404010e-05 -1.23153133e-04 2.44780887e-05] [-1.82711181e-04 1.72606353e-04 9.84051605e-05] [ 1.82711180e-04 -1.72606351e-04 9.84051615e-05] [ 2.47041110e-04 1.05056219e-04 -4.37077369e-05] [-2.47041110e-04 -1.05056217e-04 -4.37077364e-05] [ 2.61435553e-04 1.68970768e-04 1.95329985e-04] [-2.61435553e-04 -1.68970767e-04 1.95329985e-04] [-2.86865365e-04 3.04215364e-04 -7.42001442e-05] [ 2.86865364e-04 -3.04215363e-04 -7.42001441e-05]] Final stress: [-2.09983330e-06 -1.06833222e-06 -6.60871169e-06 1.27877098e-15 -1.05408972e-15 5.97779622e-06] Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.90413 0.54232 0.43122 0. -0. 0. ] [ 0.54232 0.91059 0.49799 -0. 0. 0. ] [ 0.43122 0.49799 0.77683 0. -0. 0. ] [ 0. -0. 0. 0.24759 -0. 0. ] [-0. 0. -0. -0. 0.20614 0. ] [ 0. 0. 0. 0. 0. 0.18349]] 95%% Error estimate [ASE units]: [[0.00004 0.00008 0.00006 0. 0. 0. ] [0.00008 0.00005 0.00013 0. 0. 0. ] [0.00006 0.00013 0.00006 0. 0. 0. ] [0. 0. 0. 0. 0. 0. ] [0. 0. 0. 0. 0.00002 0. ] [0. 0. 0. 0. 0. 0.00003]] Maximum deviation from material symmetry [ASE units]: 0.000001 R E S U L T S Elastic constants [GPa]: [[144.85826 86.88855 69.08942 0.00004 -0.00001 0.00005] [ 86.88855 145.89226 79.78623 -0.0001 0.00005 0.00007] [ 69.08942 79.78623 124.4616 0.00003 -0.00008 0.0002 ] [ 0.00004 -0.0001 0.00003 39.66865 -0. 0. ] [ -0.00001 0.00005 -0.00008 -0. 33.02665 0.00006] [ 0.00005 0.00007 0.0002 0. 0.00006 29.39912]] 95 %% Error estimate [GPa]: [[0.00612 0.01272 0.01031 0.00072 0.00066 0.00053] [0.01272 0.00777 0.02123 0.00065 0.0004 0.00032] [0.01031 0.02123 0.00922 0.00016 0.0007 0.00013] [0.00072 0.00065 0.00016 0.00027 0. 0.00003] [0.00066 0.0004 0.0007 0. 0.00246 0.00004] [0.00053 0.00032 0.00013 0.00003 0.00004 0.00427]] Maximum deviation from material symmetry [GPa] = 0.00020 Bulk modulus [GPa] = 96.94969 Unique elastic constants for space group 31 [GPa] ['c11', 'c12', 'c13', 'c22', 'c23', 'c33', 'c44', 'c55', 'c66'] [144.85826066539505, 86.88855407319008, 69.08941623088901, 145.8922603851359, 79.78623385772944, 124.46160127391855, 39.668654991905996, 33.026646230650606, 29.399123561446995] Nearest matrix of isotropic elastic constants: Distance to isotropic state [-] = 0.33805 Isotropic bulk modulus [GPa] = 98.13347 Isotropic shear modulus [GPa] = 32.02610