Model name? MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_002 Stoichiometric species (literal list of strings)? ['Fe', 'Nb'] Prototype label? A2B_hP24_194_fgh_ef 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': 5.3629e-10, 'parameter-names.source-value': ['c/a', 'z1', 'z2', 'z3', 'x5'], 'parameter-values.source-value': [3.235078, 0.093238582, 0.1260202, 0.84441567, 0.16179553], 'meta.uuid': 'TE_825139981287_002-and-MO_072689718616_002-1711749617-tr'}] Runtime arguments (literal dictonary)? {} ==== Building ASE atoms object with: ==== representative atom symbols = ['Fe', 'Fe', 'Fe', 'Nb', 'Nb'] representative atom coordinates = [[0.33333333 0.66666667 0.6260202 ] [0.5 0. 0. ] [0.83820447 0.67640894 0.25 ] [0. 0. 0.09323858] [0.33333333 0.66666667 0.34441567]] spacegroup = 194 cell = [[5.3629, 0, 0], [-2.68145, 4.6444076379556, 0], [0, 0, 17.3494]] ========================================= 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 3 steps. Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 10 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.47333004e-11 5.32677515e-06 -2.34961650e-06] [ 7.02733725e-10 -5.32868710e-06 -1.68140257e-06] [-6.41332476e-11 -5.33022425e-06 1.35382874e-06] [ 2.82461610e-10 5.32914233e-06 1.95789420e-06] [ 6.64873731e-10 -2.58779488e-07 -7.06876548e-08] [ 2.22355250e-07 1.28267411e-07 -6.94399017e-08] [-2.23976380e-07 1.29971806e-07 -7.07359354e-08] [-8.41079681e-10 -7.45001972e-07 2.32922080e-07] [ 6.53783795e-07 3.75039275e-07 2.37270421e-07] [-6.52469555e-07 3.73310072e-07 2.36707042e-07] [ 5.37122569e-10 -9.92369724e-06 2.98966595e-08] [ 2.82962287e-08 -1.92568917e-05 3.02776008e-08] [-2.93290513e-08 -1.92556836e-05 2.99926820e-08] [-6.15162921e-11 9.68082854e-06 4.09620700e-08] [ 1.84107234e-07 1.93783050e-05 4.18911566e-08] [-1.84080725e-07 1.93782287e-05 4.20845216e-08] [ 8.09433076e-11 -1.96631871e-05 -1.02873536e-06] [-9.04540887e-11 1.96628126e-05 -1.03209805e-06] [ 6.71657729e-11 1.96632946e-05 1.03738964e-06] [-1.15441157e-10 -1.96635933e-05 1.03252549e-06] [ 7.72780173e-11 1.04257769e-05 1.68276334e-06] [ 2.81797361e-11 -1.04259069e-05 1.69535781e-06] [ 3.10553869e-12 -1.04259522e-05 -1.69528770e-06] [ 8.66999250e-11 1.04258524e-05 -1.68375980e-06]] Final stress: [ 6.82643799e-05 2.12796881e-05 -4.14590849e-05 -2.44758446e-12 1.26388388e-12 2.74063931e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.10989282e-11 -3.41461056e-05 -2.62962827e-05] [ 5.15865636e-10 3.41471034e-05 -2.64812065e-05] [-7.99840162e-10 3.41467324e-05 2.76205773e-05] [ 2.25502478e-10 -3.41444036e-05 2.68706643e-05] [ 1.06096618e-09 -1.12106261e-06 -2.62877886e-07] [ 9.65607589e-07 5.58228098e-07 -2.59371601e-07] [-9.67836729e-07 5.60736138e-07 -2.60928459e-07] [ 9.97556574e-10 4.64337664e-07 -1.90568957e-07] [-4.03788626e-07 -2.33355437e-07 -1.91124743e-07] [ 4.02557331e-07 -2.31501099e-07 -1.90960832e-07] [-1.36706574e-09 1.46008507e-05 -1.12999081e-07] [-4.16784271e-05 -4.84219762e-06 -1.12511742e-07] [ 4.16807982e-05 -4.84513800e-06 -1.13666348e-07] [-5.24077615e-10 -1.27027744e-05 -1.24995452e-08] [ 4.00313710e-05 3.89439453e-06 -1.13658818e-08] [-4.00304480e-05 3.89325367e-06 -1.13589715e-08] [ 1.77508647e-10 2.04371174e-05 -3.59042779e-06] [ 1.19930899e-10 -2.04369038e-05 -3.55448104e-06] [ 1.23556887e-10 -2.04366220e-05 3.55634170e-06] [ 8.04210032e-11 2.04369355e-05 3.57926441e-06] [-1.67687808e-10 -1.01235977e-05 -8.61435231e-06] [-2.54952849e-11 1.01237663e-05 -8.59185436e-06] [-9.26107696e-11 1.01238312e-05 8.60950785e-06] [-1.37041156e-10 -1.01236253e-05 8.62248326e-06]] Final stress: [-3.95986942e-05 7.74090045e-06 6.28880375e-05 -3.50930619e-12 3.05438125e-12 -4.32288093e-13] Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-2.94716338e-07 1.42224536e-04 -3.80187282e-04] [-2.71685533e-07 -1.49152492e-05 3.85025064e-04] [-2.36643256e-07 -1.43007323e-04 4.15009058e-04] [-2.56032878e-07 1.51111357e-05 -3.84396205e-04] [-2.83358571e-07 1.42258090e-05 2.74386102e-06] [-1.21532518e-05 -6.82830084e-06 2.67332289e-06] [ 1.27856852e-05 -7.52132588e-06 3.14726474e-06] [-1.98856837e-07 3.90095092e-05 -1.13711243e-05] [-3.26374207e-05 -1.89773232e-05 -1.05537557e-05] [ 3.31298112e-05 -1.94912187e-05 -1.09618668e-05] [-4.06685926e-07 -3.28453585e-05 -1.20429337e-04] [ 6.08541017e-06 5.78756346e-05 -6.08023950e-05] [-5.32926431e-06 5.69683215e-05 -6.07916368e-05] [-4.65870449e-07 6.42937808e-06 1.16478860e-04] [ 1.84598193e-05 -4.35281999e-05 5.74514530e-05] [-1.75971732e-05 -4.45638553e-05 5.73821339e-05] [-3.12296648e-08 1.74483291e-04 1.74712918e-04] [-2.36010859e-08 4.20704070e-06 1.78498125e-04] [-2.74440151e-08 -1.74440321e-04 -1.74518779e-04] [-2.09122150e-08 -4.28361362e-06 -1.79146022e-04] [-5.39594247e-08 3.77638837e-05 -6.55287201e-05] [-6.07074638e-08 -5.95898779e-05 -3.87307036e-05] [-5.91754569e-08 -3.78607093e-05 6.63376479e-05] [-5.27367181e-08 5.95541376e-05 3.79581194e-05]] Final stress: [ 1.25492747e-04 8.90274945e-05 6.31594189e-05 -4.81750146e-05 -2.10775135e-10 2.54551669e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-2.65944215e-07 -1.27998224e-05 2.69116688e-04] [-1.76939748e-07 -2.43091130e-05 4.14435909e-04] [-5.05665372e-07 1.31377763e-05 2.03093637e-04] [-1.53042774e-07 2.47001817e-05 4.99375870e-04] [-3.33925983e-08 -6.90258220e-04 -2.16599869e-04] [ 5.97477278e-04 3.45037615e-04 -2.17059846e-04] [-5.97329844e-04 3.44911942e-04 -2.16895030e-04] [-3.99085835e-07 3.84428154e-04 -1.19629084e-04] [-3.32187350e-04 -1.91665199e-04 -1.19216316e-04] [ 3.33144116e-04 -1.92681061e-04 -1.19982048e-04] [-6.19313148e-07 -2.16900213e-05 -7.48921374e-05] [ 5.46951845e-05 3.25199719e-05 -3.27856792e-05] [-5.35487055e-05 3.11406685e-05 -3.29832595e-05] [-2.34742064e-07 -1.14716815e-04 -4.90490145e-05] [ 6.13706669e-05 3.62534806e-05 -9.11601274e-05] [-6.09099453e-05 3.57166202e-05 -9.11232934e-05] [ 8.04954978e-09 2.60047287e-05 9.34025213e-05] [-4.37749743e-08 -5.12662886e-05 8.74162003e-05] [-5.04014441e-09 -2.61105322e-05 -9.80897620e-05] [-4.95589414e-08 5.13002496e-05 -9.64235144e-05] [-8.21847150e-08 4.18719069e-05 -6.16349064e-06] [-3.02085517e-08 -3.91248486e-05 -4.75422090e-06] [-4.31575520e-08 -4.18319091e-05 7.41276177e-06] [-7.73985830e-08 3.94305357e-05 1.25531047e-05]] Final stress: [ 1.26774870e-04 8.59428035e-05 6.61232252e-05 4.63524691e-05 6.18989575e-10 -1.75823315e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.76581524e-05 -1.75778675e-04 -1.83332241e-04] [-8.69983260e-05 1.92015705e-03 9.19706620e-04] [ 1.22253551e-04 -2.81774970e-04 -2.24382153e-04] [ 1.47216261e-04 1.90603960e-03 9.71353473e-04] [-1.21335893e-04 -1.11564970e-03 9.72768347e-05] [ 1.16944230e-03 -3.59819217e-05 -8.55412454e-04] [-9.56600830e-04 -2.47981930e-04 -7.40198615e-04] [-1.49968909e-04 5.07270071e-04 6.97510127e-04] [ 4.86250624e-04 2.70093766e-04 -1.16907700e-03] [-2.23357588e-04 8.17322695e-05 -1.23038688e-03] [ 2.09759349e-04 -3.91447251e-04 -2.84505462e-04] [ 5.68594378e-04 -6.62670370e-04 2.60913918e-04] [-9.35227424e-04 -1.91402109e-04 5.23671461e-04] [ 3.39293992e-04 -3.32573586e-04 -7.46490643e-07] [ 5.00835470e-04 -8.04086391e-04 6.40274449e-04] [-1.10267833e-03 -2.35472937e-05 4.88055929e-04] [-2.54623924e-05 -3.29867152e-04 -4.77747318e-05] [-2.45006423e-05 1.79859838e-04 7.39814338e-05] [-1.00322868e-05 1.38304426e-04 6.88415765e-06] [-4.83178966e-06 4.41800328e-05 -1.16662087e-05] [ 2.13430970e-05 -2.90946347e-04 -6.09084880e-04] [ 3.76548929e-05 -9.45166977e-05 4.73518282e-04] [ 3.53634389e-05 -7.43542807e-05 3.80231104e-04] [ 2.06452056e-05 4.94161923e-06 -1.76810672e-04]] Final stress: [-2.81401214e-04 -4.04416676e-04 -2.44044852e-04 -3.27336012e-05 -1.13365960e-06 -7.46506876e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[ 1.93714539e-03 -8.80404445e-03 1.64302642e-02] [-1.32864198e-03 -9.88962879e-03 -1.35565044e-03] [ 3.15062701e-03 -9.01409267e-03 1.85623982e-02] [-6.34459279e-06 -8.84022858e-03 -1.23276343e-03] [ 2.13671131e-03 -1.30987540e-02 -1.79701632e-02] [ 5.29432534e-03 1.68855406e-02 -1.73014808e-02] [-7.69499902e-03 2.10909479e-02 -1.75406138e-02] [ 1.99801295e-04 1.92008270e-02 1.02223367e-02] [-9.46407143e-03 6.22138138e-03 3.15098717e-03] [ 6.86492702e-03 6.22194444e-03 5.79204718e-03] [ 1.61556798e-03 -6.11019351e-03 4.60425109e-03] [ 2.65044483e-03 -4.16287668e-03 -3.56378159e-03] [-5.36019135e-03 -1.68950531e-03 8.99217838e-04] [ 1.49331565e-03 -4.55270356e-03 3.70536487e-03] [ 2.86483386e-03 -3.42067636e-03 -2.98646281e-03] [-5.60175902e-03 2.43898500e-04 -1.28916807e-03] [ 5.43906171e-05 8.20663059e-04 3.65381391e-03] [ 4.04211426e-05 5.35701385e-03 -2.11558039e-03] [ 1.61126562e-04 4.96434705e-03 8.55878499e-04] [ 2.05254735e-04 1.17934744e-03 -2.07259680e-03] [ 3.44228073e-04 -3.81676440e-03 9.11728551e-03] [ 5.61804224e-05 -2.73445754e-03 -9.56763705e-03] [ 3.57860070e-04 -2.77392282e-03 -2.92105669e-03] [ 2.88460875e-05 -3.27806255e-03 2.92310981e-03]] Final stress: [-2.85497083e-04 -3.74752008e-04 -2.45773704e-04 1.04796784e-04 -7.27499768e-06 -1.10040826e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[-1.91166138e-04 4.86384236e-04 -1.26009030e-03] [ 5.35656406e-04 -3.07385534e-04 1.62970947e-03] [ 1.95555392e-04 -2.56256752e-04 -6.81829278e-05] [-8.78486391e-05 -8.65899716e-04 4.37743034e-04] [-2.37983533e-04 -1.29345696e-04 -2.41091466e-03] [-1.05266471e-03 1.22593331e-03 2.42948375e-04] [ 1.43237459e-03 6.02263998e-04 1.33708357e-04] [-9.17537652e-04 -5.68213328e-04 2.12244469e-04] [ 2.74018936e-03 1.59110754e-03 1.84977386e-03] [-9.95957701e-04 -6.26189805e-04 7.18251497e-04] [ 1.44354270e-03 1.07254410e-03 -1.73512361e-05] [-1.20480752e-03 -2.32629915e-03 1.51392387e-03] [-1.46467409e-03 7.62470761e-04 1.37988351e-03] [ 6.55758748e-04 1.04688775e-03 -1.72742026e-03] [-4.20391261e-04 -1.25543383e-03 -1.36381658e-03] [-5.85273929e-04 7.31007579e-05 -1.23721755e-03] [-5.55631178e-05 2.84713577e-04 1.72996954e-04] [-1.23260816e-04 -1.22689979e-04 -1.57743036e-04] [-5.86228325e-06 -1.21458199e-05 -1.96215148e-04] [-9.83546598e-05 -7.11689922e-05 9.37471878e-05] [ 1.95488232e-04 -5.87492486e-05 -2.87552427e-05] [ 1.25882846e-04 -1.68304890e-04 9.93250096e-05] [ 1.11011369e-05 -9.58262387e-05 2.08021867e-04] [ 1.05796638e-04 -2.81497048e-04 -2.24570521e-04]] Final stress: [-2.30960100e-04 -3.23963149e-05 -1.68654590e-04 4.27590031e-06 -3.59792187e-05 2.99635575e-07] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 5.91729191e-07 1.21447655e-05 3.78703663e-05] [ 8.97041799e-07 -1.15072992e-05 -2.37164077e-04] [-5.76896368e-07 -1.23176386e-05 -1.58590458e-04] [-1.11297482e-07 1.28686615e-05 3.92036455e-06] [ 8.57239459e-07 1.75434239e-04 5.44169418e-05] [-1.55629408e-04 -8.93460874e-05 5.63845746e-05] [ 1.53813320e-04 -8.73091135e-05 5.52045996e-05] [ 9.51666168e-08 -1.05437566e-04 3.15207996e-05] [ 9.26488322e-05 5.28647164e-05 3.20322159e-05] [-9.28504717e-05 5.30905383e-05 3.21124882e-05] [-9.42603671e-08 -2.00269650e-07 5.43718818e-05] [-2.24665428e-05 -4.15262041e-06 5.26059346e-05] [ 2.26634664e-05 -4.37532003e-06 5.65216508e-05] [-1.16152002e-07 3.98776716e-05 -2.39612900e-05] [-1.41605002e-05 -1.59081242e-05 -2.17514503e-05] [ 1.42253426e-05 -1.60795051e-05 -2.58920632e-05] [ 1.47780075e-05 -2.57666411e-05 -6.15991048e-05] [ 1.47030316e-05 2.58031707e-05 -6.59930885e-05] [-1.45799275e-05 2.59908432e-05 6.25711918e-05] [-1.46880752e-05 -2.59422478e-05 6.82438892e-05] [-5.06151106e-06 -3.08192834e-05 8.31899496e-06] [-5.04455313e-06 3.09483461e-05 3.95307599e-06] [ 5.05140220e-06 3.09022495e-05 -9.05467522e-06] [ 5.05501619e-06 -3.07634852e-05 -6.04276348e-06]] Final stress: [-1.00359443e-04 -5.39249270e-05 -4.59695654e-05 -1.62917098e-10 -4.43583483e-05 -7.17987470e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[ 6.72728533e-04 4.17539781e-04 -5.06674517e-04] [ 7.68868611e-06 9.17399296e-04 5.29504682e-05] [ 1.51570496e-04 -8.53509315e-05 -6.16211922e-04] [-2.89169261e-04 4.09884136e-04 3.56374296e-04] [-3.25464024e-04 4.15454060e-04 2.36561521e-04] [ 1.07740746e-03 2.67805229e-04 1.73068270e-03] [ 7.48148828e-05 -2.50794197e-04 1.29747767e-03] [-5.86444544e-04 6.43683458e-04 5.24435154e-05] [ 5.67550566e-04 1.02474936e-03 -7.78239741e-04] [-1.63441681e-04 -4.54257468e-04 -2.20566715e-03] [ 4.82329568e-04 -1.94264907e-03 -5.88571180e-04] [-1.51132561e-03 -4.32720610e-04 9.29747277e-06] [ 5.35897522e-04 7.29845264e-04 -2.68232553e-04] [ 1.02914165e-03 -1.92465804e-03 6.76675062e-04] [-2.03340848e-03 -9.98191672e-04 4.82546261e-04] [ 1.85741051e-04 1.27245318e-03 -4.80866738e-05] [-5.79733968e-05 3.12610100e-05 -1.12414119e-04] [-8.97298114e-05 1.75012996e-04 9.85133072e-05] [-1.77356462e-05 1.84556384e-05 -1.79559908e-05] [-3.19622153e-05 5.67839997e-05 3.85056293e-05] [ 1.25686068e-04 -7.34467856e-05 -1.35624958e-04] [ 1.13356366e-04 -1.86268590e-05 8.83975423e-05] [ 1.07487508e-04 -1.38069359e-04 -1.08462887e-04] [-2.47456763e-05 -6.15624256e-05 2.65716245e-04]] Final stress: [-2.81243090e-04 -4.03486091e-04 -2.43465813e-04 2.95528221e-06 5.72000387e-05 -3.38159226e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 41 steps. Final forces: [[ 5.09743007e-04 -6.82804053e-04 1.75943590e-04] [-5.13117758e-04 7.37989275e-04 -3.32723740e-04] [-4.70086515e-04 6.59605949e-04 -5.78542788e-04] [ 5.06479301e-04 -6.62527703e-04 3.81017746e-05] [ 2.02717595e-05 -1.25789616e-04 -1.54991930e-05] [ 2.58989510e-05 1.82644320e-05 5.15758965e-05] [-4.80382523e-05 5.35058684e-05 5.11750488e-05] [ 2.64941831e-05 1.35276243e-04 3.34167362e-05] [-1.43995437e-04 -9.56151297e-05 2.20955814e-05] [ 9.01559352e-05 -3.40250621e-05 6.05340274e-05] [-3.91551522e-03 1.87107090e-03 1.31494324e-04] [ 5.65088654e-04 -4.73451209e-03 1.73152249e-04] [ 2.64633396e-03 5.03375582e-03 2.12845240e-04] [ 3.93731493e-03 -1.92308258e-03 -3.30136959e-05] [-5.51886242e-04 4.73061678e-03 -2.67847834e-05] [-2.69773297e-03 -4.99036869e-03 -2.99159038e-05] [-3.40174183e-04 1.13233089e-03 -8.02084852e-04] [ 3.44344542e-04 -1.12724619e-03 -8.15141400e-04] [ 3.43293901e-04 -1.12565993e-03 8.16058014e-04] [-3.37142814e-04 1.12402576e-03 8.29640997e-04] [ 4.45928189e-04 3.10434918e-04 -5.44730885e-04] [-4.43994893e-04 -3.07683584e-04 -5.56420813e-04] [-4.44271030e-04 -3.12493335e-04 5.66682693e-04] [ 4.44608001e-04 3.14931116e-04 5.72141882e-04]] Final stress: [-1.58828476e-04 -2.00054901e-04 -9.06074795e-05 1.98222660e-07 -8.66504608e-08 -3.79391927e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[-1.09539363e-04 -6.64078064e-05 1.23269738e-04] [ 1.13436460e-04 7.07898514e-05 6.16126749e-06] [ 1.11387229e-04 7.29986882e-05 -1.27091983e-04] [-1.12838296e-04 -7.04479227e-05 -8.44300857e-05] [-2.49250816e-06 -3.33573580e-05 2.48042864e-06] [ 2.96489061e-05 1.79364115e-05 4.68541561e-06] [-2.54603302e-05 1.26822613e-05 6.57391168e-06] [ 4.37717991e-06 -7.37916964e-06 -1.61648490e-06] [ 6.70601752e-06 -2.82963503e-06 -8.50939749e-06] [-1.41576319e-05 6.63463209e-06 -4.62188817e-06] [ 7.63020621e-04 1.98650704e-04 2.85635958e-05] [-4.71457358e-04 1.07613625e-03 2.83593137e-05] [-3.07052868e-04 -9.56531595e-04 2.39365046e-05] [-7.60909737e-04 -2.00238083e-04 1.25797095e-06] [ 4.75579354e-04 -1.07773534e-03 -3.69331854e-06] [ 2.99210231e-04 9.59178122e-04 -2.45857987e-06] [ 1.33542610e-04 8.47493125e-05 -1.48954196e-04] [-1.33162776e-04 -8.52120383e-05 -1.52049367e-04] [-1.34102865e-04 -8.52224973e-05 1.52620435e-04] [ 1.34251551e-04 8.44304194e-05 1.53274486e-04] [ 7.76307667e-06 9.42071801e-05 -7.73065442e-05] [-7.76466302e-06 -9.36435618e-05 -7.59072505e-05] [-7.72264747e-06 -9.33929867e-05 7.57892800e-05] [ 7.73780759e-06 9.40041600e-05 7.96667473e-05]] Final stress: [-1.76599452e-04 -1.69604579e-04 -1.29210019e-04 8.64410068e-09 1.03703154e-08 3.07889412e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.73443603e-03 7.51749325e-04 4.46376747e-02] [ 5.47006930e-04 -3.32561711e-04 -5.14061345e-02] [ 8.45474071e-04 -6.34514077e-04 -5.13931568e-02] [-2.83579335e-05 -7.36478824e-06 4.41442537e-02] [-7.20222450e-05 -2.21694676e-03 5.48917646e-04] [ 1.36731766e-03 1.06400454e-03 7.94428810e-04] [-1.56519186e-03 1.08827282e-03 3.89010552e-04] [-5.63367124e-04 2.54488058e-03 3.64555051e-04] [-1.25486170e-04 -4.49201370e-04 1.10125867e-03] [ 1.39905514e-03 -1.83748737e-03 1.32169672e-04] [-1.79008356e-02 -1.30298455e-04 1.87702165e-02] [ 6.84081379e-03 -6.40674441e-03 1.85623692e-02] [ 7.37278231e-03 1.21984011e-02 1.91965754e-02] [ 1.77639194e-02 6.74492655e-04 -1.50712217e-02] [-6.52809647e-03 6.36576489e-03 -1.52098117e-02] [-7.44991843e-03 -1.25257971e-02 -1.67782496e-02] [ 1.71188323e-03 -2.63332991e-03 3.50473879e-04] [-1.77251250e-03 2.59460147e-03 -1.93304651e-03] [-1.69033193e-03 2.64323746e-03 -4.33314822e-05] [ 1.60545197e-03 -2.70721974e-03 2.23852746e-03] [-1.31192299e-03 1.16418586e-03 -8.08946214e-05] [ 1.42335374e-03 -1.24458540e-03 -1.49272140e-03] [ 1.22460936e-03 -1.15387916e-03 3.68109169e-04] [-1.35918837e-03 1.19033964e-03 1.81002796e-03]] Final stress: [-1.49064508e-04 -5.75918102e-04 -2.35024752e-04 3.88704875e-07 5.78626948e-07 -9.24786159e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.91960210e-04 -1.95899770e-04 -3.40477812e-04] [ 1.46511906e-04 2.24163093e-04 -3.65856253e-04] [ 1.97895166e-04 2.25497715e-04 1.95958547e-04] [-2.13031880e-04 -2.17364656e-04 3.08195904e-04] [-3.22152812e-05 -1.13729027e-05 -8.32454931e-06] [ 5.37556965e-05 4.51455085e-05 -3.38051736e-05] [ 2.32716624e-05 -3.66869463e-05 2.80348832e-05] [-5.51966173e-05 -2.27323462e-04 5.63562542e-05] [ 1.81845677e-04 1.54467132e-04 3.23566564e-05] [-1.04893450e-04 4.62652825e-05 1.23093341e-05] [ 1.08726340e-03 -2.44445077e-06 2.67917968e-05] [-1.00960897e-03 6.55591990e-04 6.22459950e-06] [-8.74044057e-04 -9.41558195e-04 5.85395522e-05] [-1.10907413e-03 2.80012360e-06 1.77557863e-05] [ 1.00705167e-03 -6.37568683e-04 -4.09576284e-06] [ 9.17953825e-04 9.10626133e-04 1.49189411e-05] [ 5.63711291e-05 -1.02928602e-04 -7.14982641e-05] [-6.76181079e-05 1.04985697e-04 -7.39820776e-05] [-6.69899193e-05 1.01242455e-04 7.53180654e-05] [ 5.85110536e-05 -1.00941645e-04 7.52442682e-05] [-1.18819779e-05 8.67459591e-05 -1.38426523e-04] [ 8.29958732e-06 -8.38975067e-05 -1.33920173e-04] [ 1.02396506e-05 -8.40152795e-05 1.27634062e-04] [-1.24558162e-05 8.44710108e-05 1.34747938e-04]] Final stress: [-2.71502077e-04 -3.50456069e-04 -2.74367831e-04 5.07559615e-08 -9.15375984e-08 4.42483308e-05] Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.03126671e-10 -7.92296612e-06 -1.15077710e-06] [-1.75858351e-10 7.92220081e-06 2.20326400e-07] [ 4.34175643e-10 7.92107988e-06 -7.12655503e-07] [-7.97415439e-10 -7.92218618e-06 -8.77343742e-08] [-9.14090953e-10 -3.50793878e-07 -7.58298952e-08] [ 3.04118809e-07 1.76364653e-07 -7.62063229e-08] [-3.02020047e-07 1.74102209e-07 -7.45882085e-08] [-2.06620028e-09 -1.52684423e-06 4.71688947e-07] [ 1.32999532e-06 7.66689348e-07 4.74613387e-07] [-1.32661963e-06 7.62348944e-07 4.73042009e-07] [ 1.98387895e-09 8.47953219e-06 1.93769698e-08] [-8.82738936e-06 1.72229101e-05 1.91956893e-08] [ 8.82398591e-06 1.72271507e-05 2.00250650e-08] [-7.57526819e-11 -8.43316438e-06 1.53276438e-07] [ 8.78748187e-06 -1.72477220e-05 1.52852479e-07] [-8.78718919e-06 -1.72479629e-05 1.53446663e-07] [-1.55256197e-10 2.18237499e-05 -1.23449785e-06] [-2.12409368e-10 -2.18238916e-05 -1.22522870e-06] [-1.25720157e-10 -2.18236601e-05 1.24478173e-06] [-2.22823482e-10 2.18234657e-05 1.23686501e-06] [ 2.22731444e-10 -9.94243606e-06 1.35097095e-06] [-4.29761058e-11 9.94224768e-06 1.38117861e-06] [-3.62057799e-12 9.94215004e-06 -1.37587889e-06] [ 1.90788496e-10 -9.94236475e-06 -1.35824351e-06]] Final stress: [ 2.12330359e-05 6.82911249e-05 -4.14389047e-05 1.42469444e-12 -6.25188061e-13 9.01870764e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 3.40047679e-09 3.81091932e-05 -4.66789071e-06] [ 3.57030245e-10 -3.81116889e-05 -3.83686059e-06] [ 2.98005142e-09 -3.81115855e-05 5.56496760e-06] [ 3.64529518e-11 3.81106417e-05 6.04739158e-06] [-1.32656795e-09 -1.81306205e-06 -5.55939766e-07] [ 1.56981704e-06 9.07835190e-07 -5.56781761e-07] [-1.56735981e-06 9.04882769e-07 -5.55347694e-07] [ 4.64834283e-09 5.34418968e-07 -1.90209015e-07] [-4.61677719e-07 -2.71585415e-07 -1.91254543e-07] [ 4.51585502e-07 -2.60410542e-07 -1.83940294e-07] [ 2.61187244e-09 -3.73718987e-06 -1.73347280e-07] [-2.16323558e-05 -8.79074461e-06 -1.74680190e-07] [ 2.16275036e-05 -8.78492992e-06 -1.74250124e-07] [ 2.71109801e-09 3.79724659e-06 -1.12063763e-07] [ 2.15826545e-05 8.75599719e-06 -1.12317041e-07] [-2.15877032e-05 8.76204418e-06 -1.11085862e-07] [-1.80509191e-10 -1.46082594e-05 -1.18411112e-05] [ 5.70405112e-10 1.46079569e-05 -1.18365773e-05] [-2.13556228e-10 1.46082470e-05 1.18242552e-05] [ 5.39708028e-10 -1.46084025e-05 1.18208117e-05] [ 4.08733769e-10 1.22633750e-05 -1.06214153e-05] [ 3.04593978e-10 -1.22637075e-05 -1.06016471e-05] [ 4.07445740e-10 -1.22638328e-05 1.06127170e-05] [ 2.80284795e-10 1.22635603e-05 1.06265765e-05]] Final stress: [ 7.39142440e-06 -3.97188947e-05 6.33869503e-05 -4.66714842e-12 2.07708300e-12 -2.68076697e-14] Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-3.19574016e-06 7.86239239e-04 2.20741123e-03] [ 4.57703562e-06 -6.44455369e-04 8.60876757e-04] [-1.45192788e-06 -7.80100938e-04 2.34128407e-03] [ 4.06065671e-06 6.51157626e-04 1.24876218e-03] [ 4.59705751e-06 -6.12504698e-04 -3.06435769e-04] [ 5.06456104e-04 2.97465789e-04 -2.91905087e-04] [-5.17552063e-04 3.09155050e-04 -3.00796341e-04] [-4.25423670e-06 4.44543140e-03 -1.30344137e-03] [-3.85236590e-03 -2.22316995e-03 -1.29724661e-03] [ 3.86233687e-03 -2.23380254e-03 -1.30496018e-03] [ 4.66720173e-06 -1.17409762e-03 -3.85916058e-04] [ 8.78993201e-04 6.22460954e-04 -4.54417036e-04] [-8.87233322e-04 6.32558949e-04 -4.56750246e-04] [ 1.39041783e-06 -8.30557589e-04 -2.20932401e-04] [ 8.62520342e-04 3.71732700e-04 -1.49934850e-04] [-8.64919707e-04 3.74716782e-04 -1.53612267e-04] [ 5.90035649e-07 5.49682463e-04 7.66117529e-04] [-6.35578656e-07 -4.32322396e-04 7.90887107e-04] [ 6.78055303e-07 -5.47737151e-04 -7.69322611e-04] [-6.13893496e-07 4.28970105e-04 -8.56582521e-04] [ 3.41131168e-07 5.98723964e-05 -8.14768999e-04] [ 3.24437140e-07 1.90367219e-04 -8.79093378e-04] [-1.32502706e-08 -5.07023403e-05 8.91527701e-04] [ 7.03076142e-07 -1.90360077e-04 8.39249140e-04]] Final stress: [ 9.13790669e-05 8.50167210e-05 3.64496952e-05 -4.52020600e-05 -3.55282723e-09 1.42220456e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.88367300e-06 3.75781468e-04 1.54456186e-03] [ 3.01099521e-06 -4.66218528e-04 1.88714813e-04] [ 1.53618284e-06 -3.66967551e-04 1.80444547e-03] [ 2.66247384e-06 4.66931675e-04 2.33297852e-04] [ 3.84757397e-06 3.92724122e-04 3.89037186e-05] [-3.49243089e-04 -2.02075927e-04 4.34961637e-05] [ 3.40558456e-04 -1.92633747e-04 3.69857880e-05] [ 1.90913549e-06 3.11348170e-03 -9.26572633e-04] [-2.71538038e-03 -1.56500086e-03 -9.30781479e-04] [ 2.71087762e-03 -1.56019603e-03 -9.27276081e-04] [ 2.14993860e-06 -6.18649342e-04 -1.09215203e-04] [ 4.40011125e-04 3.48689453e-04 -5.37441457e-05] [-4.44334093e-04 3.53653395e-04 -5.45617474e-05] [ 2.15752960e-06 -4.12106202e-04 -2.47292964e-04] [ 4.53061060e-04 1.60963114e-04 -3.05632942e-04] [-4.57393151e-04 1.65943281e-04 -3.05690364e-04] [ 4.66766223e-07 2.17392509e-04 5.09404807e-04] [ 2.05581464e-07 -3.18540985e-04 4.55725623e-04] [ 4.35687371e-07 -2.17634548e-04 -5.14815793e-04] [ 1.74871469e-07 3.18234144e-04 -4.93174832e-04] [ 3.31037786e-07 -1.96435069e-04 -4.02322137e-04] [ 3.78386588e-07 9.32696072e-06 -4.45676037e-04] [ 3.23400675e-07 2.01684559e-04 4.58162202e-04] [ 3.69219755e-07 -8.34759144e-06 4.03058056e-04]] Final stress: [ 9.42821356e-05 9.88980597e-05 4.77679076e-05 4.46036737e-05 2.01340997e-09 -1.27302867e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.55294042e-04 -1.15328867e-03 6.77631632e-04] [-3.62941860e-04 5.19736710e-04 -8.85219200e-04] [-1.78283278e-04 -9.63639287e-04 6.72917003e-04] [-2.17469748e-04 6.47214765e-04 -8.38777715e-04] [ 2.18361392e-04 1.03177513e-03 1.34266290e-03] [-9.80914748e-04 -1.20852422e-03 2.53163616e-05] [ 1.27221151e-03 -1.70014575e-03 7.50054071e-04] [ 2.61471331e-04 1.18174104e-03 -5.71144584e-04] [-1.83895469e-03 7.42020968e-04 1.36898109e-04] [ 1.81704149e-03 1.04802305e-03 -2.21682586e-04] [ 3.15094970e-04 6.58068701e-04 1.25782427e-03] [-1.18593571e-04 -6.96615147e-04 -8.98920730e-04] [-1.50114900e-04 -1.03544448e-04 -7.99182113e-04] [ 1.55561221e-04 6.50336309e-04 8.58139960e-04] [-5.64412449e-05 -1.10604061e-04 -5.86564421e-04] [-5.17749427e-06 -5.58500701e-04 -6.07502418e-04] [ 2.85298272e-06 -1.39226152e-04 -2.65405120e-04] [ 2.41103148e-05 3.28916315e-04 1.36170357e-04] [ 2.12475510e-06 -7.81994682e-05 2.03469767e-04] [ 3.47023629e-05 3.41707228e-04 -1.92530788e-04] [ 1.22161904e-05 -4.62040145e-04 -3.20388258e-04] [-3.58179888e-05 6.91855427e-05 1.71393136e-04] [-2.43756478e-05 -2.23705538e-04 2.33614056e-04] [ 8.63068539e-06 1.79307833e-04 -2.78773682e-04]] Final stress: [-4.00389908e-04 -2.10483532e-04 -2.74077640e-04 -6.75482612e-05 -2.49743752e-07 -3.34534708e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-1.16977589e-03 1.63171381e-03 2.88839621e-04] [ 1.93753269e-04 -3.67764651e-04 1.89821526e-03] [-1.09718819e-03 1.42249172e-03 3.00764326e-04] [ 1.17438890e-04 -5.69272893e-04 1.78979378e-03] [ 3.80142376e-04 -1.02005602e-03 -6.08090664e-04] [ 6.59731584e-04 -1.39908938e-04 -3.55527492e-04] [-7.83918440e-04 1.55072467e-03 2.24871627e-04] [ 6.15765535e-04 1.88389333e-03 -1.29263999e-03] [ 1.22092720e-04 -2.46625941e-03 1.74767112e-03] [ 1.45259402e-04 -2.46604227e-03 4.11852276e-04] [-1.92526928e-05 1.32358458e-04 -1.55347017e-03] [ 1.14730171e-03 9.51050445e-05 3.25530418e-04] [-7.94654484e-04 -3.04992107e-05 -1.11533772e-03] [-1.81149108e-04 9.26403937e-05 -1.19076578e-03] [ 1.19606603e-03 -6.43064745e-05 1.44571964e-04] [-6.04929513e-04 1.36823865e-04 -1.29302798e-03] [ 1.61745104e-04 1.12579123e-04 2.55812317e-04] [-3.76713747e-06 -7.65486753e-05 -4.29560660e-04] [ 1.68593508e-04 1.39294515e-04 -3.50093015e-04] [-1.05160857e-05 -1.80842172e-04 3.13249329e-04] [-1.66906865e-05 2.51454994e-04 7.73766693e-04] [-1.05219992e-04 -4.81013342e-06 -5.99691877e-04] [-1.66697691e-05 1.15266680e-04 -2.28638312e-04] [-1.04158141e-04 -1.78035762e-04 5.41904926e-04]] Final stress: [-3.96052980e-04 -2.09483532e-04 -2.71051857e-04 5.96647664e-05 1.11009297e-08 5.68325000e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-2.40467047e-04 1.15169343e-03 1.00774568e-03] [-2.41568116e-04 -1.15321467e-03 -3.93990464e-05] [ 2.42155578e-04 -1.15290257e-03 -8.94048614e-04] [ 2.41413994e-04 1.15396624e-03 -3.04912678e-05] [-1.03667113e-07 4.09207635e-05 1.24568210e-05] [-3.75645317e-05 -2.07713139e-05 1.32438429e-05] [ 3.78079066e-05 -2.10354339e-05 1.34878290e-05] [-2.83646466e-08 4.78048098e-05 -2.05840907e-05] [-4.13476300e-05 -2.38832346e-05 -2.04513846e-05] [ 4.04728844e-05 -2.34150748e-05 -1.90638468e-05] [ 6.06194285e-07 -9.99447941e-04 1.68299173e-04] [-5.18550221e-05 4.91822883e-04 8.32718927e-04] [ 5.09216707e-05 4.93053563e-04 -4.97700277e-04] [ 4.95576162e-07 1.09637115e-03 -1.75770010e-04] [-3.11922181e-05 -5.41171551e-04 -8.39776210e-04] [ 2.99392287e-05 -5.39880098e-04 4.92034005e-04] [ 3.13033235e-04 4.76161461e-04 3.04169176e-04] [ 3.13143011e-04 -4.76454823e-04 2.83627943e-04] [-3.13138972e-04 -4.75893432e-04 -3.06232270e-04] [-3.13095250e-04 4.76412043e-04 -2.82782457e-04] [-1.15066814e-04 -1.24392442e-04 -1.08378629e-04] [-1.15110253e-04 1.24004921e-04 -1.24977005e-04] [ 1.15318508e-04 1.24288317e-04 1.08206958e-04] [ 1.15230098e-04 -1.24036988e-04 1.23664751e-04]] Final stress: [ 8.60179335e-05 1.10426730e-04 5.35215396e-05 -2.36653114e-08 -1.28627460e-05 3.97817746e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[-1.16246444e-03 1.53731167e-03 -1.55376407e-04] [ 6.35568743e-04 4.14352290e-04 -1.61959214e-04] [ 9.48745534e-05 8.63993927e-05 6.25685054e-04] [-3.90879553e-05 -5.57365335e-04 -8.76777029e-04] [ 6.63494059e-04 -1.09679724e-04 6.86360481e-05] [-1.78221873e-03 -1.80708375e-04 -1.80978382e-04] [ 1.60783917e-03 5.04600992e-04 1.62994618e-03] [ 8.66657436e-04 8.92787412e-05 -3.94346095e-04] [-2.51997760e-04 -1.75048499e-03 1.53363879e-03] [ 1.57248001e-03 1.29171715e-04 2.41490774e-03] [ 2.97854564e-03 2.22500081e-03 -6.19644352e-04] [-2.31016828e-03 -4.23543321e-03 7.43276198e-04] [-3.09107402e-03 2.20629139e-03 7.87111626e-04] [ 1.54695236e-04 1.91574561e-03 -1.65943948e-03] [ 1.20416376e-04 -1.33003241e-03 -2.56713508e-03] [-4.89646708e-04 -8.13914304e-04 -1.19053529e-03] [ 1.32107774e-04 2.30104731e-04 3.26680852e-05] [ 1.91513035e-04 -2.07159677e-04 -1.79689266e-04] [-1.14612762e-05 2.75058430e-04 -1.89151112e-04] [-1.68821110e-05 -1.38634460e-04 1.36373765e-04] [ 3.55555661e-04 2.41501961e-05 -4.03942870e-05] [ 1.52777732e-04 -1.88439634e-04 1.76606119e-04] [-4.04154866e-04 1.27418077e-04 1.46085566e-04] [ 3.26307136e-05 -2.53031929e-04 -7.95091828e-05]] Final stress: [-1.03995827e-04 -2.29049359e-04 -1.30990481e-04 -1.27159681e-06 9.98699272e-05 7.37568155e-07] Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[ 8.31345502e-04 -4.75956832e-03 3.74966486e-03] [ 1.04967434e-03 2.45908939e-03 6.77118558e-04] [ 1.10744207e-03 -4.42443643e-03 4.36277252e-04] [ 1.24788248e-03 2.44446715e-03 4.17859627e-03] [-2.58237795e-03 1.58957158e-03 1.15795781e-03] [-4.48675822e-03 -1.57580891e-03 4.74367978e-03] [ 4.38673732e-03 -4.17780919e-03 6.56388009e-04] [ 2.07961685e-03 1.29870764e-03 2.24609450e-03] [-2.29347958e-03 3.39463321e-04 4.61275123e-05] [-1.10597379e-03 5.22738096e-03 1.62515194e-03] [ 9.04818388e-06 3.52356397e-06 -3.72851400e-03] [ 2.27447455e-03 3.78374646e-04 -3.65380632e-03] [-2.76705284e-03 9.03220612e-04 -2.56958728e-03] [-1.68360926e-03 -1.47643015e-04 -3.20633204e-03] [ 3.37194810e-03 1.92044307e-03 -2.89408466e-03] [-1.50120187e-03 -7.08972404e-04 -2.27562807e-03] [-2.04871241e-04 -3.43023557e-05 -4.69479267e-04] [ 4.67052927e-04 6.08734350e-05 -3.41211781e-04] [-4.94252333e-04 -1.12831750e-04 -1.04836659e-04] [ 1.59711922e-04 1.14567198e-04 -2.05643331e-04] [ 7.38010037e-05 -6.78276370e-04 3.59118653e-05] [ 3.06927441e-04 2.78899708e-04 -4.79725807e-05] [-4.36081060e-04 -7.19084242e-04 -2.09838595e-04] [ 1.89995457e-04 3.20150713e-04 1.53966214e-04]] Final stress: [-3.98336755e-04 -2.14916773e-04 -2.70352401e-04 1.12292046e-06 2.70009375e-05 1.70515418e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-2.77429640e-04 -5.99387253e-04 5.65941224e-06] [ 2.77429854e-04 5.99387327e-04 5.78007992e-06] [ 2.77430185e-04 5.99387571e-04 -5.54744182e-06] [-2.77430034e-04 -5.99387512e-04 -5.57084957e-06] [-1.89394688e-10 -1.88194258e-07 -5.70283266e-08] [ 1.63771162e-07 9.44832778e-08 -5.74892126e-08] [-1.63430920e-07 9.40227481e-08 -5.69962373e-08] [ 4.87820204e-10 3.34088226e-08 -1.68497666e-08] [-3.01451049e-08 -1.74202686e-08 -1.75764325e-08] [ 2.91403945e-08 -1.63059200e-08 -1.68267297e-08] [-2.78049086e-04 4.60721691e-05 -2.86924285e-08] [ 4.98998313e-05 -1.45544755e-04 -2.87808393e-08] [-2.69969674e-04 -3.38173353e-04 -2.86688723e-08] [ 2.78049053e-04 -4.59926899e-05 -2.93106965e-09] [-4.99690560e-05 1.45504959e-04 -3.05526439e-09] [ 2.70038793e-04 3.38133538e-04 -2.89482666e-09] [-1.61698235e-04 5.88259521e-05 2.33391965e-05] [ 1.61698236e-04 -5.88259282e-05 2.33420695e-05] [ 1.61698124e-04 -5.88259731e-05 -2.33423984e-05] [-1.61698111e-04 5.88259866e-05 -2.33428305e-05] [-2.27500223e-06 -3.87896205e-05 1.61569887e-04] [ 2.27505828e-06 3.87896078e-05 1.61573466e-04] [ 2.27502384e-06 3.87896475e-05 -1.61571974e-04] [-2.27495559e-06 -3.87896679e-05 -1.61570827e-04]] Final stress: [ 8.38350545e-05 1.26923628e-04 6.43834593e-05 2.24705359e-13 -2.82730301e-13 3.85204210e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 5.28650950e-05 2.90729051e-05 -4.00206620e-04] [-5.51871129e-05 -3.23364648e-05 -3.21188886e-04] [-5.32114191e-05 -2.79667846e-05 1.59476364e-04] [ 5.04017337e-05 2.68949177e-05 2.12296953e-04] [-5.43707189e-06 1.07562886e-04 4.01934098e-05] [-7.40251531e-05 -4.46679257e-05 2.87093202e-05] [ 8.49610198e-05 -5.72829067e-05 3.73002236e-05] [-4.71746274e-08 3.49859099e-06 2.50967554e-05] [-5.67273395e-06 -2.09764532e-06 2.40075993e-05] [ 6.25819066e-06 -2.48386929e-06 2.34311720e-05] [ 1.86204353e-03 6.38086742e-04 2.46264007e-05] [-1.13415254e-03 2.10220216e-03 2.26720395e-05] [-1.52745446e-03 -8.69049677e-04 2.28198466e-05] [-1.86418270e-03 -9.06950610e-04 2.79897074e-05] [ 1.37219079e-03 -1.96529177e-03 2.78339946e-05] [ 1.29200458e-03 1.00197757e-03 2.84565768e-05] [ 2.82416365e-05 -4.70025602e-04 -1.74328929e-05] [-2.90043352e-05 4.69418458e-04 -2.13726155e-05] [-2.97784263e-05 4.68698782e-04 2.62374376e-05] [ 2.89480732e-05 -4.69120604e-04 2.16791187e-05] [-2.64033678e-05 2.35603610e-04 -8.02955307e-05] [ 2.65867923e-05 -2.35740736e-04 -8.28276562e-05] [ 2.67235871e-05 -2.35518002e-04 8.67102667e-05] [-2.66685323e-05 2.35515976e-04 8.37870148e-05]] Final stress: [-6.91190111e-05 -2.11380381e-04 -1.70970173e-04 -5.69327839e-09 2.02363915e-09 4.16149130e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 2.99289549e-04 -5.74433261e-04 -1.39702091e-04] [-2.99287882e-04 5.74432208e-04 -1.39163366e-04] [-2.99288024e-04 5.74431172e-04 1.39626177e-04] [ 2.99289115e-04 -5.74433088e-04 1.39404534e-04] [ 1.26105679e-10 -2.32381956e-07 -6.35971836e-08] [ 2.01171493e-07 1.16026932e-07 -6.40180298e-08] [-2.02277662e-07 1.16770264e-07 -6.47460966e-08] [ 1.65742523e-09 -4.00437825e-08 1.37031743e-08] [ 3.83480310e-08 1.91199945e-08 1.51026621e-08] [-4.18700521e-08 2.32162916e-08 1.76138550e-08] [-7.09878555e-05 -7.07198828e-05 -7.22184052e-08] [ 3.62844462e-05 -1.07035803e-04 -7.16495977e-08] [ 3.61628800e-04 -4.18606485e-04 -7.21715429e-08] [ 7.09883782e-05 7.06711718e-05 6.42668721e-08] [-3.62408858e-05 1.07059937e-04 6.38198098e-08] [-3.61673733e-04 4.18632023e-04 6.38586875e-08] [-2.35841987e-04 -1.73878886e-04 3.51296573e-05] [ 2.35842089e-04 1.73878636e-04 3.51373703e-05] [ 2.35841959e-04 1.73878840e-04 -3.51285662e-05] [-2.35841732e-04 -1.73879081e-04 -3.51383069e-05] [ 1.34914431e-05 1.32595239e-05 -4.19743587e-04] [-1.34911995e-05 -1.32596490e-05 -4.19733431e-04] [-1.34912497e-05 -1.32597042e-05 4.19742169e-04] [ 1.34916131e-05 1.32596225e-05 4.19739475e-04]] Final stress: [-7.13645260e-05 -1.03620971e-04 -4.78374170e-05 1.80161199e-13 -2.51565845e-12 3.41421067e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-3.66559724e-04 -4.97177174e-04 -1.00596680e-04] [ 3.66559925e-04 4.97177407e-04 -1.00547431e-04] [ 3.66559558e-04 4.97177317e-04 1.00730635e-04] [-3.66559294e-04 -4.97177291e-04 1.00541757e-04] [ 4.26620617e-10 -1.04190294e-07 -2.31338222e-08] [ 8.95148807e-08 5.14913759e-08 -2.25820073e-08] [-9.05710828e-08 5.26080944e-08 -2.35555507e-08] [-9.55858447e-11 -3.91705139e-08 -3.08118053e-09] [ 3.35079331e-08 1.96481238e-08 -3.11114468e-09] [-3.31904171e-08 1.93335105e-08 -3.36374952e-09] [-8.24183182e-05 8.57552350e-05 -2.90552323e-08] [-1.35914175e-04 -3.20895940e-04 -2.89008676e-08] [-9.55223926e-05 -2.83356587e-04 -2.89706848e-08] [ 8.24187314e-05 -8.54172929e-05 1.36690866e-08] [ 1.35621279e-04 3.20726576e-04 1.36782466e-08] [ 9.58147081e-05 2.83187935e-04 1.35536203e-08] [ 1.18474045e-04 -7.78621491e-05 -8.51127857e-06] [-1.18473951e-04 7.78621641e-05 -8.50332761e-06] [-1.18473888e-04 7.78621400e-05 8.50491861e-06] [ 1.18473961e-04 -7.78621308e-05 8.50740191e-06] [-2.11814912e-05 -1.00695590e-05 -1.94481263e-04] [ 2.11814714e-05 1.00695930e-05 -1.94475708e-04] [ 2.11814404e-05 1.00695880e-05 1.94477149e-04] [-2.11814773e-05 -1.00695509e-05 1.94478679e-04]] Final stress: [-5.97480022e-05 -9.96500277e-05 -4.64799546e-05 2.41836080e-13 3.69486064e-13 -4.38105817e-05] Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 174 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-0.00110368 -0.00515918 0.00686647] [ 0.00071401 0.00522982 0.00981298] [ 0.00141656 0.00523026 -0.00377811] [-0.00179092 -0.00511212 0.01870284] [-0.00082082 -0.03174864 -0.0081668 ] [ 0.02822465 0.01689168 -0.00839122] [-0.02615712 0.01474476 -0.00724748] [ 0.00030903 0.01664132 -0.00300668] [-0.0148555 -0.00874458 -0.00313162] [ 0.01407945 -0.00793862 -0.00277369] [ 0.01445672 0.00431893 0.00166996] [-0.00254841 0.02727977 0.00154547] [-0.01623794 -0.01274218 0.00175208] [-0.01476386 -0.01592414 -0.00187744] [ 0.01272284 -0.02118166 -0.00197369] [ 0.00665167 0.01816466 -0.00177776] [ 0.00138906 -0.00171921 -0.00077555] [-0.00146285 0.00174627 -0.00118305] [-0.00155673 0.00175871 0.00109746] [ 0.00151664 -0.00174228 0.00115968] [ 0.00195492 0.00170004 -0.00355043] [-0.00206302 -0.00169303 -0.00355567] [-0.00182403 -0.00168935 0.00414872] [ 0.00174931 0.00168875 0.00443352]] Final stress: [ 8.84640794e-05 -6.79873965e-04 -6.49824061e-05 8.98754374e-08 -7.76696524e-07 4.77843361e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 8.63129083e-05 -3.43150329e-04 7.14562883e-05] [-8.63145992e-05 3.43150582e-04 6.88754905e-05] [-8.63126315e-05 3.43149295e-04 -6.99417315e-05] [ 8.63116182e-05 -3.43149819e-04 -7.44707771e-05] [-1.30503047e-09 3.73062382e-06 1.22106111e-06] [-3.23206410e-06 -1.86367889e-06 1.22315879e-06] [ 3.23777971e-06 -1.86848265e-06 1.22220372e-06] [-2.83945685e-10 6.64590360e-07 -2.46317701e-07] [-5.68844061e-07 -3.30928947e-07 -2.44542437e-07] [ 5.69681584e-07 -3.31715454e-07 -2.43905716e-07] [ 1.85421704e-06 -1.14931085e-04 1.34534910e-08] [-9.59749068e-05 -1.27536233e-04 1.27649112e-08] [-1.04843754e-04 -1.42316328e-05 1.40734127e-08] [-1.85577319e-06 1.17601635e-04 3.62876644e-07] [ 9.36641845e-05 1.26202520e-04 3.61955767e-07] [ 1.07156596e-04 1.28949330e-05 3.62337473e-07] [-1.43631983e-04 -8.29436485e-05 3.86818785e-05] [ 1.43631833e-04 8.29435644e-05 3.87454258e-05] [ 1.43632239e-04 8.29439789e-05 -3.87013920e-05] [-1.43632041e-04 -8.29441386e-05 -3.86826835e-05] [ 3.73081578e-06 2.35948226e-06 -1.20031619e-04] [-3.73238070e-06 -2.35948602e-06 -1.20056049e-04] [-3.73123520e-06 -2.35953508e-06 1.20061649e-04] [ 3.72992748e-06 2.35950813e-06 1.20004400e-04]] Final stress: [-4.73817336e-05 -4.93334914e-05 -1.02367130e-04 2.15140583e-12 -8.93917830e-12 3.73074797e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.19200848e-05 -2.20206596e-05 -4.30249738e-05] [ 6.19197409e-05 2.20203845e-05 -4.15289684e-05] [ 6.19206360e-05 2.20206537e-05 4.47298415e-05] [-6.19209659e-05 -2.20206405e-05 4.59115755e-05] [-1.75112388e-09 -3.90213122e-06 -1.15661306e-06] [ 3.38122009e-06 1.95314469e-06 -1.15674202e-06] [-3.37768660e-06 1.94911793e-06 -1.15683525e-06] [ 6.78942359e-10 1.08593876e-06 -3.58776945e-07] [-9.40675176e-07 -5.43688526e-07 -3.58737576e-07] [ 9.39336223e-07 -5.42133821e-07 -3.58576216e-07] [ 1.84775263e-05 -1.23209987e-04 -2.85346077e-07] [-1.69991060e-04 4.11057487e-05 -2.85692066e-07] [ 2.28387821e-04 3.01344393e-05 -2.85543329e-07] [-1.84768063e-05 1.23633650e-04 -2.29261324e-07] [ 1.69623975e-04 -4.13181752e-05 -2.29344590e-07] [-2.28021460e-04 -3.03455912e-05 -2.29176149e-07] [ 5.47618385e-05 -1.26787791e-05 -3.27110833e-05] [-5.47616893e-05 1.26787446e-05 -3.27009574e-05] [-5.47615517e-05 1.26787687e-05 3.26783494e-05] [ 5.47616814e-05 -1.26787776e-05 3.26812472e-05] [-1.66524861e-05 1.73103289e-05 -1.71414274e-05] [ 1.66521315e-05 -1.73103479e-05 -1.71011339e-05] [ 1.66527283e-05 -1.73103345e-05 1.71315898e-05] [-1.66530965e-05 1.73103258e-05 1.71665853e-05]] Final stress: [-4.59443441e-05 -4.71328631e-05 -9.99614913e-05 -8.42590614e-13 3.73897285e-13 -4.62781820e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-6.27733687e-05 2.54520450e-04 2.73401590e-03] [ 2.38750142e-06 -4.29002188e-04 5.00742060e-03] [ 5.90632053e-05 -2.53045354e-04 3.27571457e-03] [ 3.57717445e-08 4.30658793e-04 4.42828669e-03] [-3.23207096e-06 -7.62610747e-03 -2.33410413e-03] [ 6.59824654e-03 3.81169987e-03 -2.33749355e-03] [-6.60680259e-03 3.81288857e-03 -2.32315601e-03] [ 1.40632769e-06 4.86688033e-03 -1.48722918e-03] [-4.21302245e-03 -2.43236836e-03 -1.49426877e-03] [ 4.22048632e-03 -2.43505840e-03 -1.48827195e-03] [-1.69618766e-03 -2.20286687e-04 -4.77712431e-04] [ 1.10563299e-03 -1.32275825e-03 -1.45323607e-04] [ 9.06197679e-04 1.54914075e-03 -1.21096667e-03] [ 1.69506061e-03 -2.84541432e-04 -8.47101954e-04] [-6.69914723e-04 1.57515768e-03 -1.17855570e-03] [-1.34012564e-03 -1.29942389e-03 -1.13975359e-04] [ 3.28673984e-04 -1.72599330e-04 3.52421842e-04] [-5.23836024e-05 2.55799443e-04 2.98007861e-04] [-3.32855525e-04 1.72922569e-04 -4.13589131e-04] [ 5.53908446e-05 -2.55447353e-04 -3.74699783e-04] [ 2.66623579e-04 1.04877512e-04 -5.04085991e-04] [-2.76060181e-05 2.09892015e-06 -4.46603657e-04] [-2.74450679e-04 -1.05299489e-04 5.37470588e-04] [ 4.01489721e-05 -7.06682981e-07 5.43799823e-04]] Final stress: [ 1.49957873e-06 -1.50067090e-06 -7.02188565e-06 -4.90405175e-05 2.86643069e-05 2.26693992e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.51920361e-05 3.08412483e-06 1.03125607e-05] [ 7.12685343e-06 3.04016943e-06 1.06039375e-05] [-1.28086951e-05 2.14204032e-06 7.24540490e-06] [-8.17397537e-06 1.04746105e-05 2.57364523e-06] [ 5.98172303e-06 -7.96149541e-07 -2.17200413e-06] [-1.07232890e-05 2.59250115e-06 3.06990373e-06] [-5.71506747e-06 9.41434132e-07 6.73830000e-06] [ 5.47081221e-07 -3.07235275e-07 -7.33716229e-07] [ 7.96247978e-06 2.58332163e-06 -1.26956690e-05] [ 6.57593810e-06 -3.55149991e-06 -1.02631327e-05] [ 3.98656305e-06 -1.29852599e-05 -5.23940537e-06] [-8.64282221e-09 1.06211209e-05 -2.33664117e-06] [-4.54055325e-06 -4.82739394e-06 5.97228606e-06] [-1.16043201e-05 1.88190667e-05 -5.14904729e-06] [-5.90531427e-07 -8.61695777e-06 -5.39494316e-06] [ 9.54279839e-06 5.56043859e-06 -4.00349493e-06] [-3.63981917e-06 -4.71660953e-06 -1.39693980e-06] [-8.07092791e-06 3.20517330e-06 3.73499804e-06] [ 2.92962175e-06 -6.43956912e-06 -9.93281075e-06] [-4.65537112e-07 1.55359083e-06 -7.14640305e-06] [ 5.02949840e-06 -3.64983339e-06 4.76911450e-07] [ 2.37942954e-06 -6.80759829e-06 8.87483888e-06] [ 2.72317297e-06 -8.46719886e-08 -5.37938293e-06] [-3.63583711e-06 -1.18348137e-05 1.22408040e-05]] Final stress: [ 3.18822350e-02 3.37446268e-02 1.34817583e-01 3.76588938e-05 -2.02281177e-07 -8.42746378e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.85043943e-05 -8.42145067e-07 -5.26434526e-05] [-5.14267731e-05 -7.83480641e-05 2.22420752e-05] [ 1.37288304e-05 7.10484742e-05 -3.24758727e-05] [-6.58733622e-05 -7.88391790e-05 1.79002920e-05] [-1.92021122e-05 2.84117869e-05 1.75159071e-05] [ 5.37487729e-05 -4.18325250e-05 -1.33733514e-05] [ 3.96336733e-05 -1.81829158e-05 4.64748655e-05] [-6.08508498e-05 3.18006654e-05 -1.44454021e-05] [-1.62452148e-05 1.09333873e-04 -1.51949038e-05] [-5.39954827e-05 8.28532242e-06 -2.95608037e-05] [ 2.79883116e-05 3.53289453e-05 7.38954406e-06] [-6.36492092e-05 -1.02190805e-04 4.90996484e-05] [ 9.40218709e-05 -4.35505633e-05 1.44573327e-05] [ 6.01318660e-06 2.44894664e-05 -2.87653833e-05] [ 2.38171560e-05 -3.49434019e-05 3.64310695e-05] [ 2.97690582e-05 3.78416094e-05 -4.33340604e-05] [ 4.00159613e-05 6.92022202e-05 1.67698736e-05] [ 1.87229903e-05 2.69851411e-08 -1.11544801e-05] [ 2.07771574e-05 3.26414888e-05 9.09485905e-05] [ 3.80684583e-06 2.36916755e-05 -1.40286529e-05] [ 7.62315564e-06 4.39813355e-05 -1.09488069e-05] [-7.12488355e-05 -9.72726693e-05 -5.89814879e-05] [ 3.17138862e-05 -3.73614322e-05 -1.61657257e-05] [-2.73934113e-05 1.72798527e-05 2.18431850e-05]] Final stress: [ 3.18820087e-02 3.37442002e-02 1.34817353e-01 -3.80722558e-05 9.15325061e-07 8.40688992e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 6.32290651e-06 -2.55604965e-06 1.58080449e-06] [ 1.20206508e-05 -5.34628377e-06 -1.13348567e-06] [ 8.21744889e-06 -1.63000310e-06 -1.81179009e-07] [ 3.69494846e-06 3.99198925e-06 -3.97545978e-06] [-1.93804522e-05 1.00929959e-05 -1.06141288e-05] [-1.23498931e-08 -1.11636838e-05 8.98450026e-06] [ 6.04461942e-06 4.16253991e-08 -1.58188316e-05] [ 1.61008991e-05 1.64216645e-05 1.81695353e-05] [-1.31864639e-05 -1.10593582e-05 1.87632375e-05] [ 1.36180641e-05 -1.24752736e-05 -1.01941534e-05] [ 1.41946048e-05 2.63683718e-06 3.09153645e-06] [-9.37844549e-07 -9.83651767e-07 -1.40787660e-06] [-1.02404349e-05 -1.42360477e-05 -1.11391213e-06] [ 1.52659078e-05 -2.58531471e-06 -2.30137445e-06] [ 2.62540419e-06 1.99859118e-06 1.63579827e-06] [-5.44062071e-06 3.89562099e-06 -1.56878417e-05] [-2.78408164e-07 9.56211786e-06 2.42091658e-07] [-4.23196862e-06 8.24531193e-06 7.19928538e-06] [-1.03709544e-05 1.52644358e-05 -7.75095779e-06] [-1.41504227e-05 9.79545215e-06 6.30595225e-06] [-1.14391366e-06 7.04314252e-06 9.15093442e-06] [-3.18765424e-06 -1.76108542e-05 -4.20332695e-06] [-9.90998622e-06 1.06370801e-05 5.22801335e-06] [-5.63398008e-06 -1.99803444e-05 -5.96916144e-06]] Final stress: [ 0.03275231 0.0333105 0.13515487 0.00082944 -0.00049816 -0.000563 ] Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-4.46379849e-05 7.26007148e-04 1.90929804e-03] [ 1.64778433e-04 -7.99666662e-04 -2.18810122e-03] [ 4.72789542e-05 -7.26374339e-04 -7.09388003e-04] [-1.67382029e-04 8.00111553e-04 -7.17147762e-04] [-3.39696443e-07 7.88044617e-04 3.86414939e-04] [-6.81133782e-04 -3.93036339e-04 3.86037824e-04] [ 6.84554583e-04 -3.95398980e-04 3.87618037e-04] [ 8.15931061e-07 -5.76835945e-04 3.34206846e-05] [ 4.98476868e-04 2.87355982e-04 3.33073002e-05] [-5.00522106e-04 2.89488722e-04 3.33032578e-05] [ 2.38412719e-03 2.33712284e-03 -1.73890757e-03] [-3.45278403e-03 1.21783663e-03 -9.37466209e-04] [ 1.05715272e-03 -3.12206033e-03 -9.40457801e-04] [-2.39097213e-03 2.09235631e-03 1.88628328e-03] [-3.80016175e-04 -3.42653954e-03 1.08411048e-03] [ 2.78216129e-03 9.01690601e-04 1.08933769e-03] [ 8.09090625e-05 6.53579486e-05 -6.68877187e-05] [ 9.62276644e-05 1.76062517e-04 3.65737529e-04] [-8.25537999e-05 -6.54155336e-05 6.42132718e-06] [-9.66528958e-05 -1.76123736e-04 -2.89518496e-04] [ 9.52487607e-05 1.19383539e-04 -8.30856058e-05] [-1.31381468e-04 5.34014690e-05 -3.33346166e-04] [-9.34682028e-05 -1.19567323e-04 5.57579174e-05] [ 1.30112846e-04 -5.32011452e-05 3.47258244e-04]] Final stress: [ 4.75830424e-06 5.68042029e-06 -9.69542685e-07 2.50499664e-05 -5.17238027e-05 2.64256314e-05] Minimization converged after 177 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.24747799e-06 -2.12385837e-05 -4.00374424e-05] [-7.88140176e-06 -3.36205639e-05 5.52291487e-05] [-1.90879743e-06 -2.12679779e-06 4.32958843e-05] [-2.69921106e-05 -7.29877606e-06 -9.54998277e-06] [ 1.22631514e-05 1.77655302e-05 -6.35311003e-06] [ 1.62524949e-06 7.26687253e-06 1.07767027e-05] [ 2.16343907e-05 -4.81414529e-06 -2.26427404e-06] [-1.53661847e-05 9.28976306e-07 -1.78600775e-05] [ 1.92334960e-05 8.02434741e-06 -2.02989969e-05] [ 2.78688944e-06 3.69477380e-06 8.69803802e-06] [-4.59718293e-05 8.36793729e-06 1.80774089e-06] [ 1.67148671e-05 -5.15809003e-05 -6.34977068e-06] [ 1.99229004e-05 2.23705067e-05 -1.93388671e-05] [ 3.36724211e-05 -1.93727635e-06 2.09349837e-05] [ 1.25775463e-05 2.72318163e-05 1.07960524e-05] [-3.78653944e-05 -2.78489737e-05 4.01053301e-06] [ 7.87192716e-06 -1.98046445e-06 8.89244417e-06] [ 7.63790513e-06 3.55964573e-06 -1.07098609e-05] [ 8.17558110e-06 -5.61186518e-06 -1.17892155e-05] [-2.11979022e-07 1.34058904e-05 -1.01408506e-05] [-3.93830383e-06 3.14038522e-06 -6.41044298e-06] [-1.18424102e-05 1.69813351e-05 4.73510794e-06] [-9.61965143e-06 2.09494904e-05 -3.56452347e-06] [-6.76574077e-06 4.37083934e-06 -4.50922078e-06]] Final stress: [ 3.35825509e-02 3.24727928e-02 1.35151623e-01 -1.83449865e-06 9.62965151e-04 8.15795876e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 7.89510489e-05 2.60647668e-05 -5.24510750e-03] [-2.38974521e-05 -1.11458921e-03 -5.66522937e-03] [-9.85681167e-05 -2.64061043e-05 -9.83193727e-03] [ 3.77652969e-05 1.11752040e-03 -1.08796547e-03] [ 7.55821085e-07 5.45916560e-03 1.67656274e-03] [-4.74306682e-03 -2.73837877e-03 1.67879284e-03] [ 4.71988705e-03 -2.72410194e-03 1.68006608e-03] [ 2.01795595e-06 -1.20218935e-02 3.70130603e-03] [ 1.04333608e-02 6.02319052e-03 3.68448082e-03] [-1.03924147e-02 6.00188387e-03 3.71052464e-03] [-4.72926122e-03 -6.10568080e-04 -3.79507202e-03] [ 2.63031107e-03 -3.45772451e-03 -3.11374337e-03] [ 1.57687486e-03 4.35364466e-03 -3.13072905e-03] [ 4.73309900e-03 -7.51723778e-04 5.68632241e-03] [-1.45489215e-03 4.13523630e-03 5.00991182e-03] [-2.75777224e-03 -3.67048511e-03 5.01599435e-03] [-1.29695403e-04 -4.51021842e-04 3.26806279e-04] [ 1.80054380e-04 8.52735243e-04 1.45020252e-03] [ 1.25315507e-04 4.50842469e-04 -2.05394535e-04] [-1.71981491e-04 -8.51809238e-04 -1.37116781e-03] [ 2.00046428e-06 2.66937115e-04 -1.19552140e-03] [-4.79616793e-05 7.76233930e-05 -1.94221551e-03] [-3.30741652e-05 -2.69011570e-04 1.03272863e-03] [ 6.21921967e-05 -7.71306681e-05 1.93038414e-03]] Final stress: [-2.40318358e-05 -2.53845076e-05 -2.51961227e-05 4.37962286e-05 5.36318891e-05 -3.86301065e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 7.34203868e-06 1.23767557e-03 -3.34707390e-04] [-7.34209406e-06 -1.23767555e-03 -3.34724496e-04] [-7.34207897e-06 -1.23767555e-03 3.34718266e-04] [ 7.34212914e-06 1.23767556e-03 3.34726619e-04] [ 7.00322265e-12 -4.29314612e-09 -1.01829006e-09] [ 3.70435355e-09 2.12903347e-09 -1.00105438e-09] [-3.72341313e-09 2.15130536e-09 -1.01998865e-09] [ 4.14898909e-12 7.80128429e-09 -2.42611409e-09] [-6.74228406e-09 -3.91872235e-09 -2.43176346e-09] [ 6.76786704e-09 -3.89949251e-09 -2.44111092e-09] [-1.69655368e-04 -3.24255049e-04 1.81312404e-09] [-3.05600511e-04 6.29111064e-04 1.80836724e-09] [ 2.12617635e-04 4.51301811e-04 1.82354154e-09] [ 1.69655370e-04 3.24260592e-04 -2.73633096e-09] [ 3.05595725e-04 -6.29113826e-04 -2.70426804e-09] [-2.12612861e-04 -4.51304586e-04 -2.79682812e-09] [-1.89587010e-04 -2.02823771e-04 5.00309881e-04] [ 1.89587012e-04 2.02823770e-04 5.00309673e-04] [ 1.89587011e-04 2.02823769e-04 -5.00310000e-04] [-1.89587009e-04 -2.02823772e-04 -5.00309622e-04] [ 9.15404245e-06 3.06787825e-05 -4.38800672e-04] [-9.15404362e-06 -3.06787800e-05 -4.38800898e-04] [-9.15405676e-06 -3.06787796e-05 4.38800784e-04] [ 9.15405114e-06 3.06787817e-05 4.38800986e-04]] Final stress: [ 8.54542139e-06 3.33934997e-06 -1.25692479e-05 5.66331083e-14 -6.38350540e-14 6.99161008e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 93 steps. Final forces: [[ 4.73206639e-04 1.05582701e-03 6.70098174e-04] [ 9.37750736e-04 9.76369882e-04 1.33977190e-03] [-2.03359571e-03 -1.30709471e-03 -2.48826371e-04] [ 5.76082749e-04 -4.39971128e-04 -6.14768322e-04] [ 8.46787857e-04 1.10921595e-03 -9.54889678e-04] [-6.78680876e-04 -1.41500196e-03 -8.84305369e-04] [-5.57365490e-04 2.49792541e-04 1.20286051e-03] [-7.70381714e-04 -1.58524035e-03 -9.07235504e-04] [ 1.09231668e-03 1.59002788e-03 -8.12358805e-04] [ 4.21956910e-05 9.37659171e-05 1.33093392e-03] [ 1.28371549e-03 1.17166260e-03 4.68845062e-03] [-1.44536383e-04 -1.87701970e-03 -1.97655844e-03] [ 5.78897687e-04 3.20603165e-04 -3.62974718e-03] [-9.73661887e-04 -1.18267789e-03 9.13104292e-04] [-1.47294939e-04 1.42943670e-03 -1.09902790e-03] [-5.47220500e-04 -3.35211232e-04 6.08377551e-04] [-3.34556333e-03 1.58902367e-03 -1.92781719e-04] [ 3.97047099e-03 -1.97461612e-03 -1.90405685e-04] [-1.75995106e-03 1.95892337e-03 9.66162128e-05] [ 1.15835428e-03 -1.59429960e-03 5.59964053e-05] [ 2.82382381e-03 6.13402701e-04 6.14286401e-04] [ 2.36372155e-03 -1.69002497e-03 -2.86664455e-05] [-5.20996929e-03 1.26755343e-03 -3.54251990e-04] [ 2.08970204e-05 -2.44471411e-05 3.73327426e-04]] Final stress: [ 3.61663866e-02 3.61673087e-02 1.44662894e-01 7.41732959e-06 2.48419852e-06 -1.35036367e-04] Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.61680694e-09 2.34978395e-04 -1.87505453e-04] [ 8.19140543e-11 -2.34975952e-04 -1.87124694e-04] [-1.19845640e-09 -2.34977752e-04 1.87360789e-04] [ 1.23012073e-10 2.34976241e-04 1.87162855e-04] [-9.90326536e-10 4.66405445e-08 3.04053133e-09] [-4.16715044e-08 -2.26630357e-08 3.57118524e-09] [ 4.32792656e-08 -2.47150330e-08 4.23600438e-09] [-2.14420858e-09 -1.63318969e-07 3.98283642e-08] [ 1.45190014e-07 8.44599184e-08 4.24087254e-08] [-1.39797758e-07 7.88891428e-08 3.77636066e-08] [ 6.55311805e-10 -1.69213799e-04 -5.48525254e-08] [ 1.75333980e-04 -8.78407511e-05 -5.31975481e-08] [-1.75334911e-04 -8.78394863e-05 -5.39805150e-08] [-2.58824895e-09 1.69125176e-04 5.11925866e-08] [-1.75256734e-04 8.78870762e-05 5.04654757e-08] [ 1.75261674e-04 8.78812355e-05 4.70155357e-08] [-8.69082584e-11 -3.95515414e-05 2.40939398e-04] [-3.68453879e-10 3.95516863e-05 2.40944485e-04] [ 5.20805066e-11 3.95516919e-05 -2.40939193e-04] [-2.92463609e-10 -3.95517950e-05 -2.40947383e-04] [-2.22251662e-11 -1.73179278e-05 3.61413725e-04] [-3.46050624e-10 1.73180813e-05 3.61419957e-04] [-3.35390200e-10 1.73181786e-05 -3.61419241e-04] [ 6.84116652e-11 -1.73180504e-05 -3.61422736e-04]] Final stress: [ 3.12542331e-05 1.05374688e-05 -1.01303438e-05 8.79150358e-12 -7.02222154e-12 1.40963746e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.03244052e-10 -2.52611980e-05 -2.12833526e-05] [-1.45357993e-10 2.52612529e-05 -2.11029284e-05] [ 3.47620802e-10 2.52622533e-05 2.12492906e-05] [-4.54562082e-10 -2.52615046e-05 2.11406562e-05] [-5.12638412e-10 -1.59022368e-08 -7.91022298e-09] [ 1.64312361e-08 9.02427719e-09 -9.29803370e-09] [-1.52796798e-08 7.74187270e-09 -8.43330239e-09] [ 7.44615521e-11 -5.55037460e-08 1.28966372e-08] [ 4.53481358e-08 2.73008628e-08 1.19861197e-08] [-4.55233843e-08 2.75180795e-08 1.21401754e-08] [ 6.96553759e-10 1.45136119e-04 -2.75278382e-08] [-7.13103819e-05 2.24778533e-05 -2.81122116e-08] [ 7.13091992e-05 2.24793042e-05 -2.78211869e-08] [-4.31427838e-10 -1.45128199e-04 2.38469528e-08] [ 7.12983392e-05 -2.24827711e-05 2.39762121e-08] [-7.12975237e-05 -2.24837336e-05 2.41122037e-08] [-7.79313003e-11 1.33472369e-04 2.04646000e-04] [ 2.04842809e-11 -1.33472324e-04 2.04649538e-04] [-6.08417761e-11 -1.33472561e-04 -2.04646736e-04] [ 1.60526314e-11 1.33472622e-04 -2.04649846e-04] [ 7.37950812e-11 -3.43382952e-05 3.95678901e-04] [-6.51301125e-11 3.43384692e-05 3.95682183e-04] [-4.92521078e-11 3.43384361e-05 -3.95680997e-04] [ 6.22895624e-11 -3.43382723e-05 -3.95682565e-04]] Final stress: [ 3.25936401e-06 4.12151373e-05 -9.81503828e-06 -9.17984958e-13 -4.14642143e-13 5.01823398e-13] Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.29481886e-09 7.08445277e-06 8.27722428e-07] [-5.20926058e-09 -7.08271653e-06 2.90084885e-06] [-2.29370938e-09 -7.08460652e-06 -1.80702237e-06] [-4.10567386e-10 7.08962854e-06 7.42352041e-07] [-2.09112946e-09 -2.76693570e-06 -8.87510894e-07] [ 2.38445710e-06 1.38302417e-06 -8.82930551e-07] [-2.37890833e-06 1.37738261e-06 -8.78145163e-07] [ 2.57718711e-09 -1.21755974e-06 3.09278075e-07] [ 1.05250681e-06 6.06845145e-07 3.10526735e-07] [-1.05447376e-06 6.10915970e-07 3.09222020e-07] [-8.71272937e-09 -8.52793942e-06 -1.05296462e-07] [ 3.07465877e-06 -1.66865831e-05 -1.06595038e-07] [-3.05878432e-06 -1.67058474e-05 -1.04593147e-07] [-1.22119392e-09 8.19338553e-06 -1.92787447e-07] [-2.78253165e-06 1.68635761e-05 -1.88394296e-07] [ 2.78524623e-06 1.68606201e-05 -1.91613916e-07] [-2.54571503e-10 -2.03642306e-05 -2.80179815e-06] [ 1.75455317e-10 2.03646464e-05 -2.81220304e-06] [-1.10941256e-10 2.03653581e-05 2.78582628e-06] [ 4.54740190e-10 -2.03646654e-05 2.78642073e-06] [-1.17838528e-09 5.54091552e-06 -2.53677447e-05] [-2.97307986e-10 -5.54034308e-06 -2.53242548e-05] [-2.54621692e-10 -5.54054357e-06 2.53135906e-05] [-1.04899178e-09 5.54121994e-06 2.53651022e-05]] Final stress: [ 1.21685517e-04 9.40623740e-05 1.18667714e-04 -9.16031731e-12 -1.37963642e-11 -3.60937956e-12] Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-7.24708967e-08 4.66492107e-06 8.96893664e-07] [ 3.40147827e-08 4.65613261e-06 -6.52199493e-05] [ 3.33006452e-08 -4.81605169e-06 2.50302475e-06] [-9.47578738e-08 -5.14713541e-06 -6.20118092e-05] [-9.83925239e-08 9.16970146e-05 2.91624461e-05] [-7.84312588e-05 -4.55190157e-05 2.85795417e-05] [ 7.86357212e-05 -4.57516462e-05 2.87188819e-05] [-5.78854358e-08 -1.56031099e-05 2.62465596e-06] [ 1.42996278e-05 7.99986861e-06 2.96245923e-06] [-1.41711375e-05 7.86000073e-06 2.86798604e-06] [ 2.23867788e-07 3.27113454e-05 9.41195773e-06] [-2.53798461e-05 -7.26712421e-06 1.08266154e-06] [ 2.49956505e-05 -6.78735727e-06 1.06756360e-06] [-1.14874024e-07 2.07395116e-05 5.77296553e-07] [-2.07537544e-05 -1.94928484e-05 8.66638584e-06] [ 2.09748298e-05 -1.97537646e-05 8.67623781e-06] [-1.25380560e-08 2.58987012e-05 4.27801755e-05] [-4.80676604e-09 1.54537827e-06 4.41083553e-05] [-1.03148511e-08 -2.59779183e-05 -4.31322088e-05] [-9.01140712e-09 -1.59979602e-06 -4.28638894e-05] [ 2.28809230e-08 2.84225334e-05 -4.45075875e-06] [-1.54065137e-08 -1.40603960e-05 -4.85951229e-06] [-1.55144362e-08 -2.84331500e-05 4.32857998e-06] [ 2.20761797e-08 1.40139062e-05 3.52302470e-06]] Final stress: [ 8.59438601e-05 5.76884805e-05 4.62198345e-05 -2.80211790e-05 6.64317516e-11 1.52419414e-10] Minimization converged after 60 steps. Minimization converged after 18 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 9.74798245e-04 -1.72501506e-03 -3.00440896e-05] [-9.74797557e-04 1.72501615e-03 -2.96434808e-05] [-9.74797118e-04 1.72501688e-03 2.97564363e-05] [ 9.74797481e-04 -1.72501584e-03 2.98054947e-05] [-2.73958227e-10 1.94879293e-08 -1.06988416e-08] [-1.63834287e-08 -9.43630431e-09 -1.07173057e-08] [ 1.69540080e-08 -1.02427120e-08 -1.04147352e-08] [ 3.41789735e-10 -1.57231082e-07 5.28943663e-08] [ 1.31345114e-07 7.67988545e-08 5.03285148e-08] [-1.33232218e-07 7.84013542e-08 5.14453264e-08] [-9.77706110e-05 -5.51016840e-04 -2.97965492e-08] [ 1.52070956e-04 -7.99423460e-04 -2.98177646e-08] [-1.31527699e-04 -9.13874128e-04 -3.00894745e-08] [ 9.77711929e-05 5.50668840e-04 3.30253462e-08] [-1.51771546e-04 7.99596679e-04 3.28251707e-08] [ 1.31227468e-04 9.14048351e-04 3.29424464e-08] [-6.51617619e-04 -4.68562055e-04 6.60261185e-04] [ 6.51617643e-04 4.68562177e-04 6.60259865e-04] [ 6.51617659e-04 4.68562045e-04 -6.60256325e-04] [-6.51617543e-04 -4.68561872e-04 -6.60265688e-04] [-1.20463372e-04 -9.30424567e-05 -7.75211443e-05] [ 1.20463470e-04 9.30426059e-05 -7.75182718e-05] [ 1.20463774e-04 9.30427593e-05 7.75185573e-05] [-1.20463576e-04 -9.30425561e-05 7.75155356e-05]] Final stress: [ 5.90594356e-05 7.19317844e-05 4.86467652e-06 -1.64790519e-12 -1.90729056e-12 -3.50785371e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 1.35023316e-04 1.91083826e-04 -2.86824102e-04] [-1.63921039e-04 -1.72470506e-04 -7.33258887e-05] [-1.24233445e-04 -1.88505792e-04 -3.64959239e-04] [ 1.53471743e-04 2.20777515e-04 -1.79463851e-04] [ 1.17329655e-05 1.14401751e-04 4.36341294e-05] [-1.76184976e-04 -8.75231399e-05 8.95308458e-05] [ 1.60342743e-04 -6.43685609e-05 8.88093484e-05] [-1.32804029e-05 -2.72427601e-04 1.29111822e-04] [ 2.23702962e-04 1.45155905e-04 1.22856760e-04] [-2.05696826e-04 1.19506793e-04 1.21554486e-04] [ 1.23503387e-03 2.21155101e-04 3.94085237e-05] [ 1.13617916e-04 8.06965589e-04 2.16836500e-05] [-6.96820356e-04 -5.64953327e-04 7.09596944e-05] [-1.23558876e-03 -5.86721730e-04 3.56440673e-05] [ 1.58207688e-04 -6.33760021e-04 6.33685067e-05] [ 4.24835763e-04 7.37958404e-04 4.96429977e-05] [-2.05313646e-04 6.70644897e-05 1.29046899e-04] [ 2.02230521e-04 -6.44046534e-05 1.24202178e-04] [ 2.06093884e-04 -6.08077667e-05 -1.16469959e-04] [-2.04082989e-04 6.49967974e-05 -1.22213842e-04] [ 7.50211921e-05 9.35444152e-05 6.77396496e-05] [-7.58830134e-05 -8.91112680e-05 6.76385607e-05] [-7.53093576e-05 -9.07304853e-05 -6.03843352e-05] [ 7.70002536e-05 9.31742650e-05 -6.11909020e-05]] Final stress: [-2.13647444e-04 -1.85846312e-04 -1.62549847e-04 -4.81860730e-08 -1.64208587e-07 5.85629449e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[-1.12966731e-03 5.46320044e-05 7.29159180e-04] [ 1.05506858e-03 -1.72039794e-04 -3.36470229e-03] [ 1.11033791e-03 -1.94876242e-04 -3.62876494e-03] [-1.17104871e-03 1.55434697e-04 1.25415709e-03] [-4.40811554e-05 -5.47713770e-04 2.33268896e-04] [ 5.38360261e-04 3.29559296e-04 1.88192178e-04] [-4.07635181e-04 2.03596562e-04 3.14336058e-04] [-4.41101300e-05 1.10668867e-03 2.34654971e-04] [-3.81259680e-04 -4.19580842e-04 4.52031877e-04] [ 4.63135365e-04 -5.16835915e-04 4.07804247e-04] [-2.91652307e-03 1.10170823e-04 1.29046678e-03] [ 3.83223842e-03 -4.21848460e-03 1.22658672e-03] [ 2.03081599e-03 3.92497630e-03 1.27131112e-03] [ 2.86885110e-03 4.76763314e-05 -3.77601850e-04] [-3.71732057e-03 4.22746427e-03 -3.63266408e-04] [-2.04744509e-03 -4.02623093e-03 -3.36267535e-04] [-7.73619249e-04 -1.62683278e-04 -1.24798191e-04] [ 7.69632816e-04 1.31207264e-04 -2.20918126e-04] [ 7.59786769e-04 1.61314042e-04 2.06621019e-04] [-7.71672167e-04 -1.82247531e-04 3.24681112e-04] [-7.74353624e-04 5.40723368e-04 -1.63516505e-03] [ 7.65941015e-04 -5.51725018e-04 -1.72150205e-03] [ 7.48450998e-04 -5.41497709e-04 1.79746642e-03] [-7.63883297e-04 5.40471995e-04 1.84224878e-03]] Final stress: [-2.73109690e-04 -4.50418042e-04 -2.88926366e-04 -3.70130395e-07 2.89222580e-07 -4.83418279e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 2.07120381e-04 -1.21600393e-04 2.77941319e-03] [-9.48984767e-05 7.83559973e-05 -8.62358254e-03] [ 1.22048168e-04 -2.14131570e-05 -8.67774505e-03] [ 1.09851278e-04 -2.55871422e-04 3.80432932e-03] [ 1.22125903e-04 -1.04577375e-03 5.56467584e-04] [ 9.03638180e-04 4.36924591e-04 4.98001407e-04] [-1.10760052e-03 6.95156571e-04 3.91995335e-04] [ 9.37318485e-05 2.05705360e-03 4.40765299e-04] [-1.29210112e-03 -1.07122939e-03 5.27022195e-04] [ 9.62130884e-04 -7.72083748e-04 8.52434171e-04] [ 3.92515889e-03 2.26627475e-04 3.20968885e-03] [-1.93867669e-03 3.47251713e-03 3.14696701e-03] [-1.75473142e-03 -2.03886875e-03 3.34270735e-03] [-3.84188344e-03 -2.14920649e-04 -9.49608040e-04] [ 2.06436266e-03 -3.53044286e-03 -1.17360486e-03] [ 1.43005982e-03 2.19148007e-03 -1.09612292e-03] [ 8.01791486e-05 -4.87236761e-04 3.19448852e-04] [-7.49669640e-05 4.61374886e-04 5.06715449e-05] [-6.42138062e-05 4.78509652e-04 -1.18272561e-04] [ 1.01906054e-04 -5.16313775e-04 1.76976153e-04] [-9.20895606e-05 1.98955878e-04 3.29880872e-04] [ 9.76906474e-05 -2.06436999e-04 1.15920319e-04] [ 1.52392612e-04 -1.92546272e-04 -2.40824893e-05] [-1.11234479e-04 1.77782081e-04 1.20329003e-04]] Final stress: [-1.66110647e-04 -3.30960578e-04 -2.35562664e-04 3.06252355e-07 -1.03978559e-06 5.79305120e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-6.38493147e-10 -1.45640801e-05 -9.81058908e-05] [ 7.15279664e-11 1.45625812e-05 -9.79052473e-05] [ 1.83680446e-10 1.45629651e-05 9.86401129e-05] [-2.63631394e-10 -1.45650082e-05 9.83534696e-05] [-5.88462309e-11 -3.81926250e-07 -1.14400527e-07] [ 3.34836705e-07 1.92002621e-07 -1.16671314e-07] [-3.34528542e-07 1.91763533e-07 -1.16325627e-07] [-3.25077964e-10 4.10013752e-07 -1.28581359e-07] [-3.54529017e-07 -2.04356711e-07 -1.27541869e-07] [ 3.55297786e-07 -2.05172544e-07 -1.28149450e-07] [ 9.32616262e-10 -8.48630088e-06 -8.54678422e-08] [-1.17228228e-04 -8.02313348e-07 -8.54917326e-08] [ 1.17226659e-04 -8.00330600e-07 -8.53185464e-08] [-8.42884096e-10 8.55202822e-06 2.31402695e-09] [ 1.17176956e-04 7.70463450e-07 2.01095103e-09] [-1.17175397e-04 7.68596607e-07 1.65459593e-09] [-1.94894656e-11 2.97712923e-05 5.14816346e-06] [-4.35436687e-11 -2.97713800e-05 5.15471410e-06] [ 1.82739379e-11 -2.97715669e-05 -5.15339678e-06] [-3.84250964e-11 2.97714142e-05 -5.15810342e-06] [ 8.67357852e-11 -1.13685933e-05 3.05977992e-05] [-1.16614859e-10 1.13682654e-05 3.06019966e-05] [-1.03073012e-10 1.13682974e-05 -3.05938239e-05] [ 8.98672803e-11 -1.13686548e-05 -3.05978250e-05]] Final stress: [ 9.75934251e-05 1.57889455e-04 8.43465023e-05 1.88148064e-12 -1.39503811e-12 8.38671310e-13] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.37296335e-09 -1.08241072e-06 1.62098204e-05] [-3.53254069e-10 1.07751995e-06 1.63259313e-05] [-4.43905608e-11 1.07444547e-06 -1.60974168e-05] [ 7.74002668e-10 -1.07941686e-06 -1.57404755e-05] [-1.23383529e-09 -3.92307363e-07 -1.29158074e-07] [ 3.40652693e-07 1.97609752e-07 -1.30014813e-07] [-3.38587918e-07 1.95003454e-07 -1.29022657e-07] [ 1.59358953e-10 1.16254168e-07 -3.98819751e-08] [-8.43609793e-08 -5.48065600e-08 -3.18408389e-08] [ 8.37168916e-08 -5.42613369e-08 -3.11366995e-08] [-1.50536250e-10 1.39162586e-05 -1.23085061e-08] [-9.37076364e-06 1.67239120e-05 -1.15591096e-08] [ 9.37106862e-06 1.67235511e-05 -1.17453019e-08] [ 3.56724711e-09 -1.41072885e-05 -5.53977612e-08] [ 9.54758021e-06 -1.66294450e-05 -5.48737024e-08] [-9.55390274e-06 -1.66216645e-05 -5.47427126e-08] [-1.26585159e-10 2.45419970e-05 1.60030510e-07] [-5.04873920e-12 -2.45426303e-05 1.54028465e-07] [-1.74829817e-10 -2.45418439e-05 -1.60854381e-07] [ 1.71542502e-11 2.45412102e-05 -1.61311422e-07] [ 2.08544293e-12 -4.78514571e-06 -2.61214559e-05] [ 4.00389593e-10 4.78430136e-06 -2.61207076e-05] [ 4.14011439e-10 4.78419505e-06 2.61196395e-05] [-2.18617346e-11 -4.78503740e-06 2.61244536e-05]] Final stress: [ 9.41183864e-05 1.21769187e-04 1.18491898e-04 7.31962410e-14 8.49423295e-13 -1.69293383e-12] Minimization converged after 14 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.21752330e-09 1.08104685e-05 2.19190104e-06] [ 1.39338423e-09 -1.08132257e-05 2.26095574e-06] [ 7.87197984e-10 -1.08137538e-05 -7.94443522e-07] [ 9.00846925e-10 1.08143357e-05 -8.12940999e-07] [ 1.01259282e-09 -1.72707463e-06 -4.69631152e-07] [ 1.49499764e-06 8.62339441e-07 -4.69161972e-07] [-1.49705432e-06 8.64694363e-07 -4.70542908e-07] [-1.62818867e-09 8.44537716e-07 -2.74412395e-07] [-7.25848576e-07 -4.19291127e-07 -2.70904838e-07] [ 7.28202636e-07 -4.22523540e-07 -2.71633480e-07] [ 3.50094498e-09 -2.79121885e-05 -1.14653027e-07] [ 1.10089072e-05 4.40609695e-06 -1.14878671e-07] [-1.10151062e-05 4.41373112e-06 -1.14728943e-07] [ 3.57368579e-09 2.90159413e-05 -1.01053860e-07] [-1.19724634e-05 -4.96576488e-06 -9.86321364e-08] [ 1.19662002e-05 -4.95799864e-06 -9.74799883e-08] [ 9.25394206e-11 -2.50106785e-05 -3.01841776e-07] [-1.57097502e-10 2.50103319e-05 -2.83249767e-07] [ 5.23655008e-11 2.50106442e-05 2.75581484e-07] [-1.97805300e-10 -2.50106944e-05 2.92155706e-07] [ 4.08115930e-10 6.56911159e-06 2.43409674e-06] [ 4.16659025e-10 -6.56913372e-06 2.45059428e-06] [ 3.99230438e-10 -6.56929496e-06 -2.43006003e-06] [ 3.92777255e-10 6.56938957e-06 -2.41503553e-06]] Final stress: [-6.50561833e-05 -9.34142866e-05 -9.66924048e-05 -9.64188675e-12 2.63807103e-12 -1.00287653e-13] Minimization converged after 20 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 1.03034216e-04 -9.09047874e-05 2.38361422e-03] [-3.36019306e-04 -5.70311651e-04 -1.90954025e-03] [ 4.59629204e-04 8.40177088e-05 2.24661648e-03] [-7.41022624e-04 -6.08680251e-04 -1.81207672e-03] [-4.32666612e-04 1.78005130e-03 6.84249462e-04] [-1.83256066e-03 -9.05089182e-04 1.76738023e-03] [ 1.15337906e-03 -3.00622930e-04 -5.00232943e-04] [ 2.66381761e-03 1.57582957e-03 -8.82749700e-04] [-3.78356291e-03 -1.02197654e-03 4.28949298e-04] [ 1.18633368e-03 -1.77680728e-03 -2.34372055e-03] [ 1.86351258e-04 1.87269407e-03 -3.61321618e-04] [-1.53830931e-03 -7.19771698e-04 -6.19428311e-04] [ 1.59537185e-03 -5.54164276e-04 8.24650453e-04] [-1.22389459e-03 1.82830185e-03 -3.17190295e-04] [-4.50241731e-04 9.91837995e-04 -4.90394112e-04] [ 2.87875308e-03 -1.85220671e-03 1.00161803e-03] [-1.69090314e-04 6.32107916e-05 2.56402823e-05] [ 3.37419999e-04 -1.25584061e-04 1.12147956e-05] [-1.47808967e-04 9.19756576e-05 -4.92130315e-05] [ 3.10378568e-04 -1.97592200e-05 3.47895452e-05] [-9.61991763e-05 1.43884342e-04 -1.42758285e-04] [-1.42506963e-05 -4.18408439e-06 -2.80858991e-05] [-2.54335827e-04 1.54562061e-04 1.56019730e-04] [ 1.45494207e-04 -3.63026873e-05 -1.08030803e-04]] Final stress: [-1.29941516e-04 -2.69722951e-04 -1.53216927e-04 2.11814433e-05 7.90486691e-08 8.08426137e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-6.61630781e-08 4.18137491e-06 2.43158679e-05] [-9.46369132e-11 2.33227026e-06 -7.50862072e-06] [ 6.30140980e-09 -4.07581807e-06 -1.95770296e-05] [-1.16223217e-09 -2.33613842e-06 7.09646640e-06] [ 2.11540855e-08 2.86360373e-06 6.62014351e-07] [-2.33862632e-06 -1.42511845e-06 6.05670929e-07] [ 2.30554227e-06 -1.38170398e-06 5.92252788e-07] [-7.15186015e-08 5.73988426e-06 -1.57721559e-06] [-5.13300339e-06 -2.83223285e-06 -1.63620294e-06] [ 5.27871420e-06 -2.99884334e-06 -1.73354717e-06] [ 4.87352280e-08 1.57620439e-05 4.97011960e-05] [ 6.81399435e-06 6.40601123e-06 4.23304450e-05] [-6.89655033e-06 6.50993558e-06 4.23715927e-05] [-5.67480851e-08 -2.13285318e-05 -5.01000000e-05] [-2.30263098e-06 -3.66264661e-06 -4.27356108e-05] [ 2.40883769e-06 -3.78924127e-06 -4.27720810e-05] [ 2.90210661e-10 3.20006980e-05 -3.80505599e-05] [-9.13655934e-09 -1.17642425e-05 -4.81842935e-05] [ 4.42414261e-09 -3.20149215e-05 3.81138772e-05] [-6.98737687e-09 1.17847240e-05 4.80734320e-05] [ 3.35795269e-09 2.80649882e-05 -1.14447085e-06] [-7.31533354e-09 -1.78184360e-05 4.45004025e-06] [-7.17922406e-09 -2.80489819e-05 1.27776776e-06] [ 5.76460440e-09 1.78313226e-05 -4.57099107e-06]] Final stress: [-2.90169031e-05 -5.66849898e-05 -2.46888543e-05 -2.79166312e-05 -2.04498732e-10 4.70346352e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-3.84066760e-03 -1.22879969e-02 4.56603694e-03] [-2.38958438e-03 -4.57686843e-03 -5.94728304e-03] [ 1.34439551e-03 -9.03916782e-03 7.20010287e-03] [ 5.26762885e-03 -5.19831342e-03 -5.53090850e-03] [-1.34276703e-02 1.32652343e-02 -1.25172627e-02] [ 1.62582897e-03 1.03479172e-02 6.20697965e-03] [ 1.19840935e-02 -1.26593566e-02 5.38978716e-03] [ 4.59597020e-03 -6.08328048e-03 1.41334369e-02] [ 1.79676451e-03 7.11953192e-03 -5.95069557e-03] [-3.63647615e-03 1.54077723e-02 -1.20434129e-02] [ 3.65154175e-03 -5.24459507e-03 8.38492358e-04] [-4.14035485e-03 9.60028439e-05 2.22785774e-04] [-7.36180262e-04 1.11674841e-02 5.86935355e-03] [ 2.70072975e-03 -5.32074665e-03 8.89976092e-04] [-5.74606259e-03 -1.91952261e-03 3.45142490e-03] [ 3.58431081e-04 1.18195140e-02 -4.48877824e-03] [-1.86642932e-03 -1.96211575e-03 3.65841444e-03] [ 2.90218394e-04 9.26663229e-04 -4.28288798e-03] [-1.31023172e-03 -2.35535027e-03 -3.57300058e-03] [ 8.45354538e-04 -3.25226002e-03 4.18460117e-03] [-1.57271528e-04 1.53386479e-03 1.49228254e-03] [ 1.00577949e-03 2.73061931e-03 -4.32258183e-03] [ 2.87977341e-04 -1.93953411e-03 -5.48231978e-03] [ 1.49621483e-03 -2.57549588e-03 6.03545680e-03]] Final stress: [-3.82560271e-04 -1.84308316e-04 -2.27348103e-04 7.11657647e-05 -3.54651005e-05 5.06133704e-06] Minimization converged after 19 steps. Minimization converged after 20 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 178 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 8.59520536e-05 -2.86099593e-04 2.04414755e-04] [-8.79619785e-05 2.85240584e-04 -2.42700836e-04] [-8.88718354e-05 2.83010139e-04 -3.37506234e-04] [ 8.67677097e-05 -2.83832173e-04 1.77817091e-04] [-1.34985273e-06 4.33894006e-05 1.70950521e-05] [-3.70296337e-05 -2.05734215e-05 1.65681708e-05] [ 3.96907514e-05 -2.36178007e-05 1.90641981e-05] [-2.89401380e-06 4.61704762e-05 7.33821563e-06] [-3.17594119e-05 -1.83612449e-05 1.29260232e-05] [ 3.79564011e-05 -2.52870671e-05 8.15546113e-06] [ 1.23349096e-03 4.36214334e-04 1.03138703e-04] [-1.23114922e-03 2.34397650e-03 1.04771697e-04] [-1.61811196e-03 -1.82652494e-03 1.04167989e-04] [-1.23406786e-03 -5.64243142e-04 -7.03904309e-05] [ 1.34392069e-03 -2.27925092e-03 -6.92525142e-05] [ 1.50616506e-03 1.89013677e-03 -6.92963268e-05] [ 2.99049725e-04 -3.11156651e-04 -2.20289628e-04] [-3.00111348e-04 3.10708146e-04 -2.33302090e-04] [-2.99459534e-04 3.11231658e-04 2.25134970e-04] [ 2.99318708e-04 -3.11275045e-04 2.34985294e-04] [-6.01787300e-05 2.18210513e-04 -2.09005547e-04] [ 5.98818183e-05 -2.18385037e-04 -2.18726872e-04] [ 6.05497542e-05 -2.18073144e-04 2.15217722e-04] [-5.97982573e-05 2.18391652e-04 2.19675137e-04]] Final stress: [-1.14760732e-04 -2.66522634e-04 -1.97182390e-04 -1.55723222e-08 -3.11853164e-08 5.06680492e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[-1.08652727e-03 1.17771724e-03 1.06387033e-04] [ 1.12641329e-03 -1.17614184e-03 5.88081037e-04] [ 1.10225181e-03 -1.18384746e-03 5.82111316e-05] [-1.13284124e-03 1.18779042e-03 -4.58332107e-04] [ 5.59950250e-06 -1.00965998e-04 -5.04163625e-05] [ 8.97142260e-05 4.25072019e-05 -4.28282118e-05] [-9.83089891e-05 5.38445615e-05 -4.48088887e-05] [-1.18428701e-05 9.12269505e-05 -3.84291310e-05] [-6.99348030e-05 -3.58860671e-05 -4.13096267e-05] [ 7.78966071e-05 -5.38691799e-05 -3.23713275e-05] [-4.49683191e-03 -2.72436534e-03 -1.00398652e-04] [ 1.11626562e-05 -1.42396561e-03 -8.26061207e-05] [ 6.86473949e-03 7.17837288e-03 -1.05926254e-04] [ 4.49042557e-03 2.88038377e-03 7.68694687e-05] [-1.36304498e-04 1.35111438e-03 6.06138186e-05] [-6.73395298e-03 -7.26207370e-03 1.12739917e-04] [-1.04750537e-03 -7.62675313e-04 -5.87273291e-05] [ 1.04884569e-03 7.60867765e-04 -4.35560648e-05] [ 1.04739668e-03 7.61976857e-04 5.47781464e-05] [-1.05075970e-03 -7.62473893e-04 4.62918979e-05] [ 7.68575474e-06 4.15126969e-04 5.94924845e-05] [-6.35865105e-06 -4.14012078e-04 6.61554556e-05] [-6.64098925e-06 -4.15786222e-04 -6.05216468e-05] [ 5.67798452e-06 4.15133718e-04 -6.93886680e-05]] Final stress: [-2.57264897e-04 -3.52394222e-04 -2.32490233e-04 -3.08026843e-08 1.67219243e-07 -1.31864774e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.80919007e-03 -2.12590702e-03 -7.47575628e-04] [ 1.78967414e-03 2.11541948e-03 7.17893515e-04] [ 1.84452772e-03 2.10521177e-03 1.11141353e-03] [-1.83487881e-03 -2.07293442e-03 2.81417522e-04] [-4.00541961e-06 -1.27311369e-03 -3.45343510e-04] [ 1.06808201e-03 6.33132922e-04 -3.27971159e-04] [-1.03132968e-03 6.07438508e-04 -2.92052466e-04] [-2.85112240e-07 -1.41185481e-04 -2.37324130e-05] [ 1.16615378e-04 7.05498549e-05 -2.38210321e-05] [-1.29473806e-04 7.78024462e-05 -1.71701942e-06] [ 5.73892927e-03 9.39142027e-04 -2.63185330e-04] [-1.84154731e-03 4.25319952e-03 -2.88262410e-04] [-2.37515196e-03 -5.75269946e-03 -2.40849153e-04] [-5.72178410e-03 -3.28642665e-04 1.22517623e-04] [ 1.30123403e-03 -4.57712634e-03 1.55489081e-04] [ 2.89418682e-03 5.46134261e-03 1.71990518e-04] [-1.24929005e-06 -7.68442649e-04 -3.52980837e-04] [ 2.63928064e-06 7.66634110e-04 -3.18338495e-04] [-1.12110084e-07 7.72393479e-04 3.38488669e-04] [ 7.09998890e-07 -7.68248424e-04 3.18639828e-04] [ 3.20389164e-04 1.06163360e-04 -1.04046679e-04] [-3.22476897e-04 -1.03849755e-04 -6.10211045e-05] [-3.21454747e-04 -1.05054021e-04 8.23731914e-05] [ 3.15951519e-04 1.08773829e-04 9.06737581e-05]] Final stress: [-2.84873309e-04 -3.16524963e-04 -1.95212294e-04 -1.67162665e-07 -2.34001484e-08 8.79768457e-05] Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 17 steps. Minimization converged after 13 steps. Minimization converged after 17 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 9.04327966e-06 -8.05984422e-05 6.05995419e-08] [-9.04283435e-06 8.05988540e-05 -6.42464539e-08] [-9.04269475e-06 8.05991530e-05 1.32005455e-07] [ 9.04304048e-06 -8.05987243e-05 -3.17188469e-08] [ 1.74077792e-10 -1.37962554e-08 4.75206996e-09] [ 1.13525089e-08 6.61671415e-09 5.03896674e-09] [-1.17118069e-08 7.02974279e-09 4.79706175e-09] [ 5.50149869e-10 7.53115605e-08 -2.98796313e-08] [-6.71068351e-08 -3.86114959e-08 -3.10261909e-08] [ 6.59542485e-08 -3.73127945e-08 -3.02070497e-08] [-1.97867062e-05 3.87393752e-05 -6.88821318e-09] [ 3.45699981e-05 -4.69872948e-05 -7.03811277e-09] [-6.64320308e-05 -5.15847936e-05 -7.04090273e-09] [ 1.97868280e-05 -3.84904569e-05 4.99015471e-11] [-3.47863752e-05 4.68624715e-05 -1.35870098e-10] [ 6.66480398e-05 5.14603917e-05 -3.33781174e-11] [-2.67783718e-05 -3.69754380e-06 7.44878169e-06] [ 2.67784530e-05 3.69761268e-06 7.45304892e-06] [ 2.67783977e-05 3.69756793e-06 -7.45286407e-06] [-2.67783239e-05 -3.69749739e-06 -7.44948822e-06] [ 1.30827934e-05 -6.67893899e-06 -3.41442189e-05] [-1.30827481e-05 6.67898341e-06 -3.41433096e-05] [-1.30827475e-05 6.67899657e-06 3.41443855e-05] [ 1.30827902e-05 -6.67895150e-06 3.41446364e-05]] Final stress: [ 5.14240851e-05 5.18913509e-05 8.09515832e-05 -5.69337397e-14 2.58057693e-13 2.96382717e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[-7.24878768e-03 -6.00116029e-03 7.86294458e-03] [ 7.54309476e-03 5.88299850e-03 8.41664153e-03] [ 7.57021204e-03 5.93871419e-03 -1.02439477e-02] [-7.35871245e-03 -5.91257514e-03 -1.10104492e-02] [ 3.72508098e-05 -1.05955898e-03 1.44134396e-04] [ 5.32359648e-04 4.30266909e-04 2.97344708e-04] [-6.39455151e-04 5.39075674e-04 1.86551571e-04] [ 4.33013026e-04 8.80495662e-04 1.43061742e-04] [-6.44598125e-04 -8.52198011e-04 8.25756893e-05] [-1.64865294e-04 1.21727052e-04 5.67419072e-04] [-8.89703943e-04 3.90090522e-02 4.90889260e-04] [-1.18925091e-02 7.06872334e-02 4.01896886e-04] [-4.56632651e-02 -6.42365058e-02 2.89686180e-04] [ 1.14486472e-03 -3.81126541e-02 6.37406798e-04] [ 1.10486470e-02 -7.13872187e-02 6.45680418e-04] [ 4.60422904e-02 6.40982230e-02 6.17082112e-04] [ 1.47477872e-02 1.06030527e-02 -9.91961676e-03] [-1.46950780e-02 -1.06215549e-02 -9.88607710e-03] [-1.47364240e-02 -1.05761988e-02 1.00126276e-02] [ 1.47776879e-02 1.05749099e-02 1.00140926e-02] [ 7.76624722e-03 -5.81235381e-03 -1.56665037e-02] [-7.72941087e-03 5.80477366e-03 -1.56621734e-02] [-7.71524024e-03 5.80801694e-03 1.57948212e-02] [ 7.73459528e-03 -5.80656130e-03 1.57839115e-02]] Final stress: [-4.60250116e-05 -1.31438588e-03 2.57672933e-05 -4.52217215e-07 2.72083834e-07 -3.58523514e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-1.10728439e-03 -4.46992966e-04 -2.46997009e-04] [ 1.10960275e-03 4.26877248e-04 -2.75458196e-04] [ 1.10501926e-03 4.58378984e-04 9.26104620e-04] [-1.10792305e-03 -4.37677284e-04 6.42058675e-04] [ 3.31793287e-06 3.01314422e-04 3.23398427e-06] [-2.66354367e-04 -1.52130838e-04 -5.68139157e-07] [ 2.62508920e-04 -1.45932602e-04 -4.77937880e-06] [ 3.59374170e-06 1.97826459e-04 -1.25262628e-04] [-1.70735996e-04 -1.03521088e-04 -1.30839457e-04] [ 1.68009552e-04 -9.78676427e-05 -1.28978441e-04] [-9.83486073e-03 -2.56149921e-04 -9.92105694e-05] [ 3.73321201e-03 -4.13219193e-03 -1.26597557e-04] [ 3.64289835e-03 5.43753074e-03 -1.31547821e-04] [ 9.83739942e-03 3.04845609e-06 -7.90762445e-05] [-3.51654909e-03 4.25654480e-03 -7.09996557e-05] [-3.86076425e-03 -5.30928970e-03 -6.94779418e-05] [ 7.37602011e-04 -3.08546665e-04 -5.00197939e-04] [-7.36063460e-04 3.06747037e-04 -5.01649923e-04] [-7.36378367e-04 3.07959881e-04 4.85995802e-04] [ 7.37644600e-04 -3.05847643e-04 4.78611196e-04] [-7.67232182e-04 8.32508057e-04 -4.30693824e-04] [ 7.64223032e-04 -8.33193881e-04 -4.36280255e-04] [ 7.66549349e-04 -8.32260177e-04 4.15972761e-04] [-7.67435026e-04 8.32866248e-04 4.06637941e-04]] Final stress: [-2.27611489e-04 -4.16096550e-04 -2.72867542e-04 -1.19073242e-07 1.15711234e-08 -1.10188565e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-1.62535462e-05 -2.18870204e-05 -2.23336063e-06] [ 1.62531595e-05 2.18869468e-05 -2.22822814e-06] [ 1.62531948e-05 2.18872228e-05 2.25638892e-06] [-1.62532909e-05 -2.18870341e-05 2.23120758e-06] [ 7.56864292e-12 -2.27796245e-08 -4.92814883e-09] [ 2.01625729e-08 1.14859796e-08 -5.14751439e-09] [-2.01032219e-08 1.14587316e-08 -5.05722283e-09] [-3.83622620e-10 2.80528911e-09 -1.93226279e-09] [-2.77882306e-09 -1.08897102e-09 -1.96332317e-09] [ 3.56379903e-09 -1.98763400e-09 -2.49186434e-09] [ 6.54514115e-06 -7.36161333e-06 -3.46619753e-09] [ 1.51728198e-05 5.74743114e-07 -3.65385386e-09] [ 1.71164250e-05 -1.03157787e-05 -3.48579357e-09] [-6.54524660e-06 7.41165163e-06 1.79394765e-09] [-1.52161884e-05 -5.99646065e-07 2.00764040e-09] [-1.70727973e-05 1.02905875e-05 1.86367486e-09] [ 2.91759123e-05 -3.04812194e-06 -8.69671906e-06] [-2.91759639e-05 3.04812713e-06 -8.69557199e-06] [-2.91759064e-05 3.04808957e-06 8.69588161e-06] [ 2.91758787e-05 -3.04806189e-06 8.69633246e-06] [-1.42556019e-05 1.42359226e-07 2.57194113e-05] [ 1.42555675e-05 -1.42356500e-07 2.57201336e-05] [ 1.42555712e-05 -1.42344743e-07 -2.57196126e-05] [-1.42555966e-05 1.42355972e-07 -2.57194021e-05]] Final stress: [-2.27333522e-05 -2.28023013e-05 -5.94756162e-05 -7.30673165e-13 -7.94162776e-13 -2.98346608e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 6.62229060e-05 -1.87652065e-04 -7.10063170e-04] [ 2.87778969e-04 2.76838461e-04 9.32036268e-04] [-6.60279211e-05 1.87347245e-04 -2.78184447e-04] [-2.86792931e-04 -2.76282702e-04 1.07104378e-03] [ 1.99147848e-08 -1.18172845e-03 -4.02424755e-04] [ 1.02167522e-03 5.89995586e-04 -4.01724956e-04] [-1.02413093e-03 5.91435427e-04 -4.01516480e-04] [-7.61145218e-08 -3.74180206e-04 1.52498443e-04] [ 3.23732360e-04 1.86926002e-04 1.52779551e-04] [-3.24508436e-04 1.87288625e-04 1.52739528e-04] [-1.27020596e-04 -7.84897761e-04 7.64250651e-06] [ 1.13829832e-03 -5.11300973e-05 1.96481642e-04] [-3.86316475e-04 6.68097249e-04 -3.42234048e-04] [ 1.28029949e-04 -7.07710634e-04 -9.63748348e-05] [ 1.53540457e-04 7.96463535e-04 -2.84796967e-04] [-9.06598871e-04 7.89808526e-05 2.53714315e-04] [ 3.55510850e-04 -1.39399287e-04 3.89757850e-04] [-3.10585005e-04 3.71820178e-04 3.58284667e-04] [-3.55470138e-04 1.39649300e-04 -3.71396265e-04] [ 3.10898347e-04 -3.71970027e-04 -3.86051964e-04] [ 1.97813963e-04 3.63533220e-05 -5.08853578e-04] [-1.64734145e-04 -5.44740918e-05 -4.93039146e-04] [-1.97426381e-04 -3.64502758e-05 5.01123437e-04] [ 1.66166688e-04 5.46798121e-05 5.08558621e-04]] Final stress: [ 8.19533678e-06 3.30818232e-06 -2.96091094e-06 -3.58568464e-05 7.85989889e-06 1.31792369e-05] Minimization converged after 188 steps. Minimization converged after 196 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-2.24548109e-04 -2.98713635e-04 5.50928529e-04] [-4.23545400e-04 2.81079846e-04 9.39185537e-05] [ 2.22474505e-04 2.98845326e-04 3.88972348e-04] [ 4.23066212e-04 -2.81090995e-04 2.91236461e-04] [-5.26579681e-08 -3.44787989e-04 -1.03232131e-04] [ 2.98871174e-04 1.72571883e-04 -1.03396949e-04] [-2.98354976e-04 1.72213488e-04 -1.03362526e-04] [-1.72398689e-06 7.06262274e-04 -2.21732453e-04] [-6.10421047e-04 -3.51286447e-04 -2.20028442e-04] [ 6.13645537e-04 -3.55139172e-04 -2.23343483e-04] [ 1.33665805e-04 -7.68179614e-05 -1.01110016e-04] [-2.00437886e-04 9.46846282e-05 -3.03290901e-04] [-2.23368289e-04 -3.42488235e-04 2.74070844e-04] [-1.34649787e-04 2.62801994e-04 -1.47228230e-05] [ 4.03259848e-05 -1.86485701e-04 1.87691758e-04] [ 3.85533718e-04 2.48359433e-04 -3.90256864e-04] [-2.12622899e-04 -1.77292557e-04 1.55109116e-04] [ 1.73490013e-04 -8.01312741e-06 1.60931816e-04] [ 2.12778997e-04 1.77290532e-04 -1.64170931e-04] [-1.74048179e-04 8.01614332e-06 -1.64241504e-04] [-1.33993211e-04 -2.85042085e-06 -1.67032423e-04] [ 1.34085310e-04 -2.77176680e-05 -1.74794759e-04] [ 1.34338270e-04 2.81432333e-06 1.75595380e-04] [-1.34509098e-04 2.77440370e-05 1.76261399e-04]] Final stress: [ 1.11387000e-05 1.21502034e-05 4.54608648e-06 3.33410764e-05 5.63011920e-07 -1.98831859e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 3.50978715e-03 -3.02550581e-03 4.43176493e-02] [ 2.36342247e-02 2.12728498e-02 9.41828073e-02] [ 9.17823810e-05 3.06639752e-03 9.94720533e-02] [-2.40635267e-02 -2.08571953e-02 3.93767706e-02] [-9.90944292e-04 -1.50355262e-01 -4.42863819e-02] [ 1.29969056e-01 7.58742953e-02 -4.46902119e-02] [-1.28570041e-01 7.39581582e-02 -4.08718095e-02] [ 2.04763056e-03 4.21209278e-02 -2.07607682e-02] [-3.87890751e-02 -2.36830752e-02 -2.28931773e-02] [ 3.37869149e-02 -1.84093253e-02 -1.84054712e-02] [ 8.00944456e-02 7.87683667e-02 4.70415985e-02] [-1.14456691e-01 4.13579348e-02 4.54686250e-02] [ 3.83001325e-03 -1.33350274e-01 5.33288084e-02] [-7.87732018e-02 7.11879654e-02 -7.40128415e-02] [-1.67678017e-02 -1.18386432e-01 -7.41157785e-02] [ 1.24292161e-01 6.06796844e-02 -7.93994159e-02] [-2.53007744e-02 5.08096337e-03 -9.42963797e-03] [ 1.22098839e-02 -5.15965054e-03 -1.98023442e-02] [ 2.53829146e-02 -5.14094168e-03 4.88626456e-03] [-1.15323138e-02 5.05867240e-03 2.01648951e-02] [-7.95502358e-04 -3.19738769e-03 -1.81520152e-03] [ 1.41370349e-02 -2.10257227e-03 1.69597278e-02] [ 1.17087229e-03 3.19037079e-03 -1.09556885e-04] [-1.41168497e-02 2.05103588e-03 -1.46066035e-02]] Final stress: [ 0.0003847 0.00038955 0.0003506 -0.00021148 -0.00041467 -0.0001355 ] Minimization converged after 193 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 3.50119926e-02 1.61296227e-01 4.74285867e-02] [ 3.69752340e-02 -1.31174281e-01 7.04554504e-01] [-3.17097770e-02 -1.64379199e-01 -8.80610801e-01] [-3.35601353e-02 1.22619895e-01 2.34800676e-02] [-2.11881907e-03 -6.70856782e-01 -1.86764675e-01] [ 5.87716131e-01 3.39447020e-01 -2.17750080e-01] [-5.92566571e-01 3.39522781e-01 -1.69410349e-01] [ 1.73607949e-04 -8.43545703e-01 2.36752027e-01] [ 7.33002653e-01 4.20731212e-01 2.83087031e-01] [-7.42210008e-01 4.25421763e-01 1.79591028e-01] [ 4.83921969e-01 1.83253606e-01 -1.17782431e-01] [-5.19257058e-01 3.05794552e-01 -1.47695515e-01] [-6.96281172e-03 -3.88044573e-01 -7.64645797e-02] [-4.99985791e-01 -1.21003744e-01 1.13434259e-01] [ 4.71738502e-01 -3.60176799e-01 1.40982721e-01] [ 6.71688495e-02 3.77865626e-01 7.23051485e-02] [-5.46572730e-02 8.01792015e-02 -2.16950173e-01] [ 1.69445641e-01 -1.20228382e-01 -2.25098402e-01] [ 5.24792569e-02 -8.05656806e-02 2.01893833e-01] [-1.72197328e-01 1.23588561e-01 2.36943527e-01] [-9.90366405e-02 -3.22937225e-02 3.36734645e-01] [ 1.46214334e-01 6.22509464e-02 2.80103877e-01] [ 1.08543625e-01 3.12318782e-02 -3.49335683e-01] [-1.38129584e-01 -6.09344020e-02 -2.69428567e-01]] Final stress: [ 0.00827185 0.01488722 0.00285761 0.00105049 -0.00204723 -0.00149076] Minimization converged after 199 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.45886678e-05 4.66733350e-04 -1.29816743e-05] [-1.45886709e-05 -4.66733358e-04 -1.30064962e-05] [-1.45886591e-05 -4.66733348e-04 1.30179680e-05] [ 1.45886565e-05 4.66733355e-04 1.30140535e-05] [ 2.52157507e-12 -5.96462496e-09 -1.77119702e-09] [ 5.15088310e-09 2.98226990e-09 -1.78310275e-09] [-5.15718390e-09 2.98339214e-09 -1.77235165e-09] [-2.53407110e-11 3.18249678e-08 -9.41585787e-09] [-2.75438602e-08 -1.58900326e-08 -9.42785638e-09] [ 2.75840040e-08 -1.59371474e-08 -9.40950205e-09] [-3.81939895e-05 -1.05853148e-04 1.34243521e-10] [-2.43798180e-04 2.19112318e-04 1.17986572e-10] [ 1.73843266e-04 2.12748625e-04 1.38554339e-10] [ 3.81939928e-05 1.05854052e-04 -3.61808806e-09] [ 2.43797389e-04 -2.19112774e-04 -3.62667321e-09] [-1.73842475e-04 -2.12749073e-04 -3.60104514e-09] [-7.76989857e-05 7.78870215e-06 7.13559739e-05] [ 7.76989874e-05 -7.78870098e-06 7.13557494e-05] [ 7.76989821e-05 -7.78870018e-06 -7.13561489e-05] [-7.76989833e-05 7.78870112e-06 -7.13558925e-05] [ 3.72769761e-05 2.17336941e-05 1.20961932e-04] [-3.72769800e-05 -2.17336939e-05 1.20961437e-04] [-3.72769894e-05 -2.17336938e-05 -1.20961362e-04] [ 3.72769834e-05 2.17336933e-05 -1.20961505e-04]] Final stress: [1.76356918e-05 1.61296676e-05 3.88341904e-06 6.54217825e-15 7.77292168e-14 5.57755835e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-7.71617152e-06 4.60264144e-04 -7.39200635e-06] [ 7.71618205e-06 -4.60264170e-04 -7.42622470e-06] [ 7.71615091e-06 -4.60264141e-04 7.44240418e-06] [-7.71616796e-06 4.60264169e-04 7.43100003e-06] [-1.18215369e-11 -1.41068446e-08 -3.24536120e-09] [ 1.22111832e-08 7.06616791e-09 -3.23039509e-09] [-1.21986691e-08 7.03817726e-09 -3.25306163e-09] [ 1.99290205e-11 3.41430550e-08 -1.09283592e-08] [-2.95597868e-08 -1.70863498e-08 -1.08957938e-08] [ 2.95286682e-08 -1.70587399e-08 -1.09323021e-08] [ 3.91666807e-05 -1.66944963e-04 -1.02630598e-10] [-1.28618354e-04 2.41987360e-04 -1.07021629e-10] [ 2.11178416e-04 2.42187492e-04 -1.46837088e-10] [-3.91666576e-05 1.66972268e-04 -4.22757557e-09] [ 1.28594698e-04 -2.42001027e-04 -4.19151143e-09] [-2.11154774e-04 -2.42201129e-04 -4.20540274e-09] [ 7.52762807e-05 7.73026276e-06 7.23611436e-05] [-7.52762806e-05 -7.73026626e-06 7.23613021e-05] [-7.52762759e-05 -7.73026090e-06 -7.23617563e-05] [ 7.52762763e-05 7.73026277e-06 -7.23610722e-05] [-3.71174330e-05 2.22800619e-05 1.20741757e-04] [ 3.71174361e-05 -2.22800623e-05 1.20741458e-04] [ 3.71174461e-05 -2.22800603e-05 -1.20741312e-04] [-3.71174423e-05 2.22800624e-05 -1.20741227e-04]] Final stress: [ 1.75915427e-05 1.60988636e-05 4.17847031e-06 -1.89112730e-13 1.46135367e-14 -5.57185840e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 4.19542484e-10 8.14964343e-06 -2.16243019e-06] [-6.13758649e-10 -8.15024725e-06 -2.19665873e-06] [-9.35177802e-10 -8.15085601e-06 2.20586020e-06] [-1.10156717e-09 8.14906500e-06 2.16551783e-06] [-1.58599791e-09 4.36340785e-08 1.06120804e-08] [-3.00089993e-08 -1.86919312e-08 6.70288061e-09] [ 3.36443498e-08 -2.26411793e-08 9.39931011e-09] [ 1.09689492e-09 2.50881893e-08 -8.66053107e-09] [-2.20986978e-08 -1.33571643e-08 -8.20669688e-09] [ 2.04386087e-08 -1.11727584e-08 -7.60674729e-09] [-1.13942222e-09 -2.06678046e-05 -3.48804617e-09] [-6.24727911e-06 -1.22337238e-05 -1.41932708e-09] [ 6.24950642e-06 -1.22363547e-05 -2.91283202e-09] [-1.05551401e-10 2.06977566e-05 -1.64232178e-09] [ 6.22192876e-06 1.22202657e-05 -1.69695004e-09] [-6.22164427e-06 1.22200001e-05 -1.18660546e-09] [-1.05567777e-10 -2.19761779e-05 -4.26940599e-06] [ 1.41959722e-10 2.19759711e-05 -4.26865186e-06] [-1.97840411e-10 2.19757331e-05 4.26827471e-06] [ 7.19093951e-11 -2.19760455e-05 4.26888720e-06] [-1.20679522e-10 8.58460417e-06 9.38117395e-06] [-6.26559076e-11 -8.58462570e-06 9.38014411e-06] [-3.49768615e-11 -8.58461570e-06 -9.38073642e-06] [-2.14181062e-10 8.58455265e-06 -9.38186902e-06]] Final stress: [ 1.02885715e-04 6.70548160e-05 5.74367093e-05 3.44379826e-12 5.28986369e-12 -3.87951120e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-9.32015104e-10 -8.11964131e-06 9.98744833e-07] [-1.45366315e-10 8.11996443e-06 1.08099308e-06] [-1.28121216e-09 8.12002609e-06 -9.57933093e-07] [-1.14342358e-09 -8.12104789e-06 -9.98395993e-07] [-7.38173025e-10 -1.65245277e-08 -1.05842323e-08] [ 2.14858398e-08 1.04523828e-08 -1.40825521e-08] [-1.95178456e-08 8.42368414e-09 -1.23615930e-08] [-1.91891880e-09 3.77679557e-08 -1.28867904e-08] [-3.06650884e-08 -1.63297488e-08 -1.08296624e-08] [ 3.54412626e-08 -2.13371065e-08 -1.46568111e-08] [ 9.22672105e-10 1.22410077e-05 -1.87621309e-08] [-3.32547835e-06 1.34662601e-05 -1.77918446e-08] [ 3.32425135e-06 1.34680305e-05 -1.83120313e-08] [-9.90981741e-11 -1.23131238e-05 3.89503964e-09] [ 3.38154440e-06 -1.34317100e-05 2.86277106e-09] [-3.38098161e-06 -1.34321481e-05 3.80815658e-09] [-7.13733239e-11 2.24470513e-05 3.62382163e-07] [-1.69905590e-10 -2.24472471e-05 3.62727194e-07] [-1.21379906e-10 -2.24476044e-05 -3.62457626e-07] [-2.38460474e-10 2.24472877e-05 -3.64894560e-07] [-2.60347299e-14 -6.67696336e-06 -1.40640324e-05] [-4.83998280e-11 6.67720932e-06 -1.40635864e-05] [-1.37046296e-10 6.67720188e-06 1.40639006e-05] [ 4.21713775e-11 -6.67700568e-06 1.40622540e-05]] Final stress: [-7.40039011e-05 -3.81498158e-05 -3.58540032e-05 3.91034936e-12 3.86887738e-12 4.94206856e-13] Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.59664315e-10 7.93871721e-06 -8.63425216e-07] [ 1.93736121e-09 -7.93943480e-06 -3.97885707e-07] [ 1.31180875e-09 -7.93861049e-06 6.59529046e-07] [ 1.03134135e-09 7.93618381e-06 3.97029697e-07] [ 3.49847606e-09 1.28029304e-07 2.65708053e-08] [-1.04980678e-07 -6.62926455e-08 2.48492610e-08] [ 9.78006891e-08 -5.80983472e-08 2.00338788e-08] [ 4.67772440e-10 -1.18775682e-07 3.73808005e-08] [ 1.03600928e-07 5.87836109e-08 3.68467847e-08] [-1.05009194e-07 6.01500887e-08 3.82164368e-08] [ 2.02050493e-09 -1.75383142e-05 -6.08160080e-08] [-4.79904026e-07 -1.77997458e-05 -6.07830709e-08] [ 4.76058729e-07 -1.77951832e-05 -6.02535946e-08] [-6.80778878e-10 1.72915083e-05 7.06193316e-08] [ 6.92872294e-07 1.79217486e-05 6.89852132e-08] [-6.92018135e-07 1.79204856e-05 6.96819608e-08] [ 3.61785685e-10 -3.89331808e-05 1.84184255e-05] [ 9.57994795e-11 3.89327319e-05 1.84228785e-05] [ 3.78921616e-10 3.89323007e-05 -1.84147125e-05] [ 6.51905196e-11 -3.89328747e-05 -1.84270065e-05] [ 2.57624311e-10 6.00130732e-06 7.99114597e-05] [ 1.09110738e-11 -6.00135184e-06 7.99164819e-05] [-4.57209058e-11 -6.00127960e-06 -7.99134275e-05] [ 3.08728987e-10 6.00119564e-06 -7.99206787e-05]] Final stress: [ 3.31170660e-05 -1.11954737e-06 8.03960439e-06 4.33036905e-12 4.41723429e-13 1.33889951e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.17603899e-10 -8.46539379e-06 6.97092428e-07] [ 2.82919901e-10 8.46430325e-06 8.58366707e-07] [ 2.65240388e-10 8.46435936e-06 -7.48780378e-07] [ 1.88808913e-10 -8.46313917e-06 -8.48244769e-07] [ 7.71622170e-10 1.14342275e-09 -1.95709460e-09] [-1.82075720e-09 -1.73983311e-09 -6.70363071e-10] [ 1.24124599e-11 1.95438443e-10 -2.04623160e-09] [ 1.03709484e-09 -6.41089288e-08 1.61552178e-08] [ 5.53429313e-08 3.10254016e-08 1.59452552e-08] [-5.71958919e-08 3.32958318e-08 1.69966695e-08] [-4.35358194e-10 1.76332622e-05 -2.33476086e-08] [-7.11892451e-06 1.50066370e-05 -2.34287131e-08] [ 7.11958357e-06 1.50057627e-05 -2.33186480e-08] [-9.61217828e-10 -1.76264353e-05 2.19194132e-08] [ 7.11522011e-06 -1.50085128e-05 2.40324979e-08] [-7.11369507e-06 -1.50104897e-05 2.40844819e-08] [ 8.16226531e-11 2.93440394e-05 2.22771644e-05] [ 1.30949585e-10 -2.93442047e-05 2.22802445e-05] [ 8.79862849e-11 -2.93439909e-05 -2.22775336e-05] [ 1.29243755e-10 2.93440194e-05 -2.22804552e-05] [-4.58815208e-11 -7.97417891e-06 7.90116601e-05] [-6.46538094e-11 7.97412660e-06 7.90147152e-05] [-1.02686228e-10 7.97416608e-06 -7.90136279e-05] [-6.09001738e-12 -7.97414204e-06 -7.90149664e-05]] Final stress: [-1.09942569e-06 3.32723044e-05 7.84656070e-06 -6.42028769e-12 -1.52017776e-13 3.07440752e-13] Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 15 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 2.25696002e-04 7.75127993e-05 -2.76114670e-03] [-1.85517264e-04 -7.74904693e-05 8.43408056e-04] [-2.48161822e-04 -1.01200065e-04 1.76572584e-03] [ 2.21487168e-04 8.90459660e-05 -4.14983430e-03] [ 1.88580359e-05 2.19869799e-03 6.68278931e-04] [-1.89143442e-03 -1.11607117e-03 6.93428196e-04] [ 1.85938312e-03 -1.07543998e-03 6.50432337e-04] [-2.30103367e-05 -2.45650974e-03 5.32316854e-04] [ 2.17823114e-03 1.25855590e-03 5.79907076e-04] [-2.13981756e-03 1.21049079e-03 5.34319854e-04] [-6.82899709e-04 1.72519391e-03 -7.46703119e-04] [-7.70150878e-04 -1.83401114e-03 -7.07202688e-04] [ 1.57691454e-03 6.13747109e-04 -7.54150063e-04] [ 6.86962336e-04 1.18199558e-03 9.73333278e-04] [-1.74487847e-03 3.72225341e-04 9.74585683e-04] [ 9.18393279e-04 -2.05875587e-03 9.92236503e-04] [-6.93810766e-05 -1.19878259e-05 -1.29357915e-04] [ 5.98624760e-05 2.77582129e-06 2.82485743e-05] [ 7.18228444e-05 8.22838924e-06 9.10954501e-05] [-7.20779818e-05 -9.88228884e-06 2.29830761e-05] [ 1.00047029e-05 1.02189438e-04 -1.77625312e-04] [-1.02824719e-05 -1.03315364e-04 -8.49132723e-05] [ 8.24546355e-06 -9.43457249e-05 1.06038297e-04] [ 1.75089201e-06 9.83505990e-05 5.45953617e-05]] Final stress: [-2.37898967e-04 -2.04503725e-04 -1.62645879e-04 -1.22148557e-07 -1.03271423e-07 -6.08906072e-05] Minimization converged after 166 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-6.31160374e-03 2.47952893e-02 3.54766825e-01] [ 5.65649653e-03 -2.62115516e-02 -4.02524492e-01] [ 8.81563671e-03 -2.94381762e-02 -4.29763358e-01] [-5.58781298e-03 3.27096957e-02 3.34202002e-01] [ 3.68731415e-03 -2.42388783e-02 5.01162955e-03] [ 2.06452908e-02 7.25727313e-03 9.46958765e-03] [-2.65490923e-02 1.48604630e-02 7.19076466e-03] [-4.14306043e-04 -2.73729495e-03 1.39542127e-02] [ 5.03614426e-03 2.42427108e-03 1.58330224e-02] [-5.55647262e-03 2.26314271e-03 1.71409564e-02] [-1.11018314e-01 4.62814956e-02 1.49072820e-01] [ 3.27317140e-02 -3.52028777e-02 1.45933779e-01] [ 8.33652797e-02 9.46397028e-02 1.48767575e-01] [ 1.10632546e-01 -7.48558697e-03 -1.34426669e-01] [-6.65102095e-02 1.57224304e-02 -1.24105386e-01] [-4.93231417e-02 -1.15191420e-01 -1.23258564e-01] [ 9.11889511e-03 -2.33198174e-02 1.16806241e-03] [-7.92331015e-03 2.25411057e-02 -1.68037499e-02] [-8.63717270e-03 2.33414656e-02 4.49494750e-04] [ 8.04981067e-03 -2.31729240e-02 2.00319998e-02] [-1.47816024e-02 8.81972813e-03 2.02728978e-03] [ 1.60162006e-02 -9.52394808e-03 -7.63543721e-03] [ 1.46270397e-02 -8.71791072e-03 1.48457268e-03] [-1.57693307e-02 9.58432246e-03 1.20130635e-02]] Final stress: [ 1.86391011e-03 -1.41122660e-03 2.29488608e-04 -3.01203644e-05 4.93344461e-05 -2.74809457e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-1.24369659e-04 -8.95692063e-04 1.70087783e-03] [ 1.78782308e-04 8.10935849e-04 -2.62960380e-03] [ 2.34577344e-04 9.31094030e-04 -2.60044659e-03] [-2.99713687e-04 -8.43310021e-04 1.32691631e-03] [-3.19387597e-05 2.97752744e-05 1.92086737e-04] [ 5.14452573e-05 4.55866555e-05 1.08706759e-04] [ 5.87514441e-05 -5.46001290e-05 2.22929016e-04] [-2.23087049e-05 -3.23720258e-04 2.01748439e-04] [ 2.78964765e-04 1.63530107e-04 1.45254117e-04] [-2.99177157e-04 1.49054844e-04 2.20449732e-04] [ 1.71361369e-03 4.18442813e-04 9.76963629e-04] [-1.17334416e-03 1.30383118e-03 8.56475548e-04] [-8.19124176e-04 -1.90236242e-03 8.87613886e-04] [-1.68549405e-03 1.69934949e-04 -6.10982367e-04] [ 5.94471186e-04 -1.63328840e-03 -6.41373352e-04] [ 1.35412316e-03 1.63118345e-03 -4.79538821e-04] [ 1.59277866e-04 -1.68030163e-04 7.87537953e-05] [-1.63924172e-04 1.57195991e-04 -1.08661537e-05] [-1.74175192e-04 1.65041318e-04 -5.62939405e-05] [ 1.66527397e-04 -1.57410732e-04 4.82983558e-05] [-3.36829577e-05 8.66045829e-05 2.98402372e-05] [ 3.55236470e-05 -9.43870330e-05 -2.18819340e-05] [ 4.52634624e-05 -7.91117499e-05 -9.15705628e-06] [-4.40688381e-05 8.97019304e-05 6.32296223e-05]] Final stress: [-1.83143081e-04 -3.13513634e-04 -2.40130789e-04 -5.94841130e-07 7.33951676e-08 7.54373440e-05] Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.16959420e-09 1.81772190e-05 3.43480572e-05] [-1.59408011e-10 -1.81791041e-05 3.44724680e-05] [-8.62157280e-10 -1.81762713e-05 -3.44131410e-05] [-1.72796624e-09 1.81741280e-05 -3.45261270e-05] [-2.35013164e-09 7.52373379e-08 2.03481826e-08] [-5.26674964e-08 -3.27762874e-08 1.38447594e-08] [ 5.73836326e-08 -3.82161194e-08 1.69252009e-08] [-7.93199777e-10 -3.08257775e-09 9.77000447e-09] [ 3.54073892e-09 2.21248697e-09 9.65049030e-09] [-1.49908164e-09 1.19540045e-10 7.88177639e-09] [ 7.42777284e-10 1.75254798e-05 -1.40928764e-08] [-2.36040293e-05 -2.58036412e-05 -1.46443239e-08] [ 2.36029470e-05 -2.58021596e-05 -1.59802450e-08] [-2.04803174e-09 -1.75586616e-05 2.85768242e-08] [ 2.36400131e-05 2.58228087e-05 2.71064999e-08] [-2.36361433e-05 2.58182110e-05 2.71442871e-08] [-2.23850660e-10 -1.98433531e-05 -5.33542821e-07] [-7.68347608e-11 1.98429009e-05 -5.30889648e-07] [-2.53585319e-10 1.98423769e-05 5.34489780e-07] [-1.58593916e-10 -1.98428446e-05 5.31683688e-07] [ 6.01327876e-11 6.56946160e-06 -1.79642369e-05] [-2.69666614e-10 -6.56975120e-06 -1.79642524e-05] [-2.74581891e-10 -6.56962759e-06 1.79664906e-05] [ 1.94271266e-11 6.56933409e-06 1.79624699e-05]] Final stress: [-3.82344511e-05 -7.39732587e-05 -3.59687037e-05 5.79544963e-13 3.64618339e-12 1.28902310e-12] Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 9 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-5.02071296e-04 -8.25485794e-04 1.98456999e-04] [ 5.02070731e-04 8.25483474e-04 1.92493593e-04] [ 5.02066701e-04 8.25486504e-04 -1.89557138e-04] [-5.02069717e-04 -8.25486706e-04 -1.98263513e-04] [-2.61649378e-10 6.96472077e-07 5.68695827e-07] [-5.94849113e-07 -3.46264972e-07 5.64867022e-07] [ 5.98836658e-07 -3.48830696e-07 5.65012537e-07] [-6.49666063e-10 2.86098587e-06 -1.29109666e-06] [-2.47542195e-06 -1.42877397e-06 -1.28912181e-06] [ 2.48698601e-06 -1.43626618e-06 -1.28931049e-06] [-3.31542501e-04 -3.66181059e-04 -3.98675053e-07] [-3.56492621e-04 -1.19733428e-04 -3.99023031e-07] [-1.81715422e-04 -1.89824279e-04 -4.01801214e-07] [ 3.31525882e-04 3.78545351e-04 9.08587412e-08] [ 3.45780984e-04 1.13566169e-04 9.14221083e-08] [ 1.92440108e-04 1.83630087e-04 9.13888791e-08] [-5.03087003e-04 1.52283260e-04 1.87901466e-04] [ 5.03085198e-04 -1.52282811e-04 1.88124063e-04] [ 5.03085153e-04 -1.52283073e-04 -1.88111876e-04] [-5.03086440e-04 1.52283322e-04 -1.87952369e-04] [ 5.94820965e-06 -3.06775763e-05 1.62261945e-04] [-5.95074951e-06 3.06785569e-05 1.62304843e-04] [-5.95204398e-06 3.06792192e-05 -1.62279165e-04] [ 5.95018754e-06 -3.06785402e-05 -1.62282066e-04]] Final stress: [ 4.45149555e-05 3.58809099e-05 8.16274870e-06 4.63446404e-12 -1.64151780e-11 -1.15721519e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 5.11765790e-04 -9.22531263e-04 2.50777798e-03] [-4.66162412e-04 9.28803944e-04 -9.70592259e-03] [-5.36378172e-04 9.19282487e-04 -8.62218394e-03] [ 4.89839182e-04 -9.19418796e-04 7.11255026e-04] [-1.57865518e-06 7.24439007e-03 2.28642153e-03] [-6.29791734e-03 -3.64366485e-03 2.24759142e-03] [ 6.25332278e-03 -3.61978127e-03 2.27442149e-03] [-1.60665577e-05 -3.54541660e-03 1.27069485e-03] [ 3.09768642e-03 1.80383180e-03 1.26327937e-03] [-3.03906510e-03 1.75147757e-03 1.25214131e-03] [ 5.59413928e-03 1.85972345e-03 2.66465607e-03] [-4.41141287e-03 7.74094574e-03 2.70058611e-03] [-5.39276314e-03 -3.08352498e-03 2.64088733e-03] [-5.60871321e-03 -3.28170748e-03 -1.21252992e-03] [ 5.65399123e-03 -7.01900804e-03 -1.23827032e-03] [ 4.16144548e-03 3.78023751e-03 -1.19020885e-03] [ 9.15323634e-05 -1.56052977e-03 -2.25381311e-04] [-1.01281660e-04 1.55508328e-03 -5.05528647e-04] [-1.01218952e-04 1.55460539e-03 3.47798808e-04] [ 1.02109172e-04 -1.55232488e-03 5.76257625e-04] [-1.00940849e-03 4.70973392e-04 5.37562142e-04] [ 1.00920626e-03 -4.72226673e-04 3.23154949e-04] [ 9.95465004e-04 -4.78095285e-04 -5.09295778e-04] [-9.78536406e-04 4.88875248e-04 -3.95164659e-04]] Final stress: [ 4.33475896e-05 -2.81196475e-04 -1.19040140e-04 -2.27277099e-07 -3.49501729e-07 -1.16961429e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.80810083e-04 -8.22321221e-04 -3.53765501e-05] [-4.80782703e-04 8.22332036e-04 7.31225476e-06] [-4.80771433e-04 8.22338349e-04 -1.93718894e-05] [ 4.80796240e-04 -8.22329477e-04 1.69325034e-05] [ 5.42240305e-09 -1.68105081e-05 -5.39595679e-06] [ 1.45375446e-05 8.38917367e-06 -5.40104515e-06] [-1.45663577e-05 8.41222724e-06 -5.39734427e-06] [ 1.60954311e-08 -4.22312612e-05 1.30489007e-05] [ 3.64944168e-05 2.10679521e-05 1.30475599e-05] [-3.65735057e-05 2.11321455e-05 1.30455015e-05] [ 2.06909618e-04 -1.16919239e-04 6.96760738e-07] [ 1.71659467e-04 -5.05275209e-04 6.94350669e-07] [-1.34293159e-04 -2.84266958e-04 6.97177707e-07] [-2.06906512e-04 9.97350869e-05 1.84057006e-06] [-1.56783097e-04 5.13859732e-04 1.83561857e-06] [ 1.19398558e-04 2.92865398e-04 1.84119475e-06] [-1.00736616e-04 -9.04831282e-05 -2.12216773e-06] [ 1.00735883e-04 9.04821172e-05 -2.31383504e-06] [ 1.00737520e-04 9.04825876e-05 2.51263305e-06] [-1.00737367e-04 -9.04832608e-05 2.17408838e-06] [ 2.74117320e-05 -2.22537744e-05 -2.88798061e-04] [-2.73872096e-05 2.22652972e-05 -2.88096338e-04] [-2.73763426e-05 2.22705458e-05 2.88000061e-04] [ 2.74017213e-05 -2.22586109e-05 2.88594013e-04]] Final stress: [-2.91813392e-05 -2.85365147e-05 -9.44851221e-06 -1.02429107e-11 -1.89416056e-11 5.37525596e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-6.65726665e-04 -1.09175962e-03 8.20178673e-06] [ 6.65708988e-04 1.09177344e-03 4.28577820e-05] [ 6.65699822e-04 1.09178063e-03 -5.00080369e-05] [-6.65713847e-04 -1.09176835e-03 -2.17034187e-05] [ 6.40537655e-10 -1.14881001e-05 -4.03191129e-06] [ 9.94764649e-06 5.74278329e-06 -4.02665242e-06] [-9.93342481e-06 5.73518808e-06 -4.03560093e-06] [-9.77226567e-09 -2.87291200e-05 9.22070694e-06] [ 2.48644638e-05 1.43704781e-05 9.20630811e-06] [-2.48058243e-05 1.43253578e-05 9.21035720e-06] [-3.19648107e-04 3.88265672e-04 2.88801201e-07] [ 4.63904439e-04 -5.42375484e-04 2.88596720e-07] [-4.33220719e-04 -9.36843098e-04 2.86769423e-07] [ 3.19638725e-04 -4.10506006e-04 1.42754702e-06] [-4.44648105e-04 5.53504036e-04 1.42875227e-06] [ 4.13982696e-04 9.47950129e-04 1.42311888e-06] [ 1.35612597e-05 -6.40731213e-05 -8.92929482e-07] [-1.35619113e-05 6.40737797e-05 -1.16264175e-06] [-1.35631113e-05 6.40739331e-05 1.32062384e-06] [ 1.35613599e-05 -6.40727527e-05 9.04469765e-07] [-7.23667514e-05 -4.76944265e-05 -1.72237316e-04] [ 7.23480056e-05 4.77042615e-05 -1.71797483e-04] [ 7.23388997e-05 4.77088769e-05 1.71748668e-04] [-7.23587072e-05 -4.76984914e-05 1.72081702e-04]] Final stress: [-3.29251411e-05 -2.57222821e-05 -1.41127488e-05 -1.57333486e-11 2.21157527e-11 -1.89374292e-06] Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 170 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.59732734e-05 -7.16124808e-05 1.66930427e-05] [-1.59749570e-05 7.16123732e-05 2.01802891e-05] [-1.59746429e-05 7.16116745e-05 -1.75462948e-05] [ 1.59732143e-05 -7.16127853e-05 -1.48523137e-05] [-1.32460777e-09 -3.46468969e-06 -1.14137417e-06] [ 3.00251453e-06 1.73411937e-06 -1.14232847e-06] [-2.99940059e-06 1.73079539e-06 -1.14094279e-06] [-1.08171117e-09 4.00358442e-08 4.96990216e-08] [-3.12830247e-08 -1.82717541e-08 5.15791393e-08] [ 3.37322926e-08 -2.09104686e-08 4.97710944e-08] [ 2.83863132e-05 -7.68779681e-05 -2.69494597e-07] [ 4.02960147e-05 -5.13236989e-07 -2.69174394e-07] [ 1.69664694e-05 -7.39642484e-07 -2.68954965e-07] [-2.83875572e-05 7.40688901e-05 -1.26806314e-07] [-3.78608537e-05 1.91938991e-06 -1.27305751e-07] [-1.93993513e-05 2.14308543e-06 -1.27325706e-07] [ 2.54706497e-05 -3.26356736e-06 9.86810763e-06] [-2.54708768e-05 3.26350151e-06 9.83390633e-06] [-2.54707874e-05 3.26353112e-06 -9.84633690e-06] [ 2.54705602e-05 -3.26368550e-06 -9.89878958e-06] [-4.35121809e-06 5.87277136e-07 -3.75718229e-05] [ 4.35090829e-06 -5.87338421e-07 -3.75372449e-05] [ 4.35109013e-06 -5.87363521e-07 3.75594646e-05] [-4.35140599e-06 5.87266983e-07 3.75806504e-05]] Final stress: [ 3.74995414e-05 3.77380224e-05 5.48715481e-05 2.85229265e-12 -2.45279965e-13 -1.75027292e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 0.01561057 -0.01384058 -0.04896351] [-0.00453455 0.01425968 0.08233666] [ 0.00038745 0.01367043 0.12677403] [ 0.00872817 -0.01385536 -0.14636241] [ 0.00269122 -0.00062406 0.00864244] [-0.00211904 -0.00287332 0.01072925] [-0.00374828 0.00365135 0.00642435] [ 0.01307481 0.13904483 -0.03069692] [-0.13142256 -0.08426438 -0.0397167 ] [ 0.10447387 -0.05341624 -0.01860494] [-0.03207985 -0.00426552 -0.0298486 ] [ 0.02296353 -0.06511266 -0.03065675] [ 0.02278031 0.04875893 -0.02961486] [ 0.03996341 0.00610235 0.04267505] [-0.03671822 0.05429231 0.04157852] [-0.02487307 -0.0410909 0.0453523 ] [-0.00317526 0.00440431 0.00218504] [ 0.00463906 -0.00469804 0.00690987] [ 0.00357141 -0.00434774 -0.00047883] [-0.00154623 0.00435199 -0.00526997] [-0.00484879 -0.00448609 0.00022777] [ 0.00521378 0.00432177 0.0013524 ] [ 0.00498985 0.00415645 0.00468073] [-0.00402158 -0.00413951 0.00034506]] Final stress: [ 1.52500614e-05 -3.26495190e-04 -5.44160842e-04 -2.93506848e-06 -1.07691901e-05 -1.68953668e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-1.48247768e-03 -3.65187437e-04 2.97043235e-03] [ 1.11380048e-03 3.77182233e-04 2.97764641e-03] [ 9.50259391e-04 3.43766943e-04 1.01424257e-02] [-1.26716624e-03 -3.63769043e-04 -3.91497539e-03] [ 4.59418604e-05 -7.46568962e-03 -1.45541830e-03] [ 6.44487041e-03 3.69907997e-03 -1.40665943e-03] [-6.47109433e-03 3.76797028e-03 -1.46567098e-03] [-3.53420072e-04 3.49876919e-03 -1.75590774e-03] [-2.57401749e-03 -1.31096338e-03 -1.42017236e-03] [ 3.30656633e-03 -2.14375348e-03 -1.99058650e-03] [ 5.24789889e-03 1.04360961e-02 -1.73766273e-03] [-1.22603984e-02 1.83455451e-03 -1.70330099e-03] [ 8.23288466e-03 -9.04310850e-03 -1.73491515e-03] [-5.66555914e-03 9.70148084e-03 8.14037419e-04] [-4.85826880e-03 -1.14138291e-02 8.53175076e-04] [ 9.78478698e-03 -1.54176004e-03 7.68948766e-04] [-1.06468377e-03 -1.15627853e-03 5.99873962e-04] [ 1.06732906e-03 1.14174929e-03 1.07443913e-03] [ 1.11508986e-03 1.15011915e-03 -9.56324848e-04] [-1.12849785e-03 -1.16173242e-03 -8.13087673e-04] [-1.34859705e-04 1.27643184e-03 9.50159712e-04] [ 5.14182497e-05 -1.26926168e-03 1.22827933e-03] [ 6.75229263e-05 -1.27385419e-03 -1.04668109e-03] [-1.67925600e-04 1.28198710e-03 -9.78054696e-04]] Final stress: [-1.03284963e-04 -3.41371131e-04 -2.97388153e-04 6.81177412e-08 3.33620917e-07 9.05219136e-05] Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-4.21207867e-05 3.42481815e-05 2.33691182e-04] [ 2.12284292e-05 -1.42472373e-05 -2.20539152e-04] [ 4.21190178e-05 -3.42475532e-05 -2.15378290e-04] [-2.12233278e-05 1.42442304e-05 2.17878918e-04] [ 3.76930356e-09 -4.91585749e-07 3.58973995e-08] [ 4.27696507e-07 2.42559458e-07 3.51858812e-08] [-4.36067963e-07 2.51311661e-07 2.85792452e-08] [-1.13902202e-09 1.06017502e-05 -3.68561249e-06] [-9.17761245e-06 -5.29939428e-06 -3.68957411e-06] [ 9.18388359e-06 -5.30178702e-06 -3.68857164e-06] [ 6.69338023e-06 1.30278735e-05 9.55541736e-05] [ 6.10393125e-05 -3.32509532e-05 6.94702674e-05] [ 8.65275069e-05 4.37453161e-05 7.79773590e-05] [-6.69663062e-06 -1.59492030e-06 -9.70678532e-05] [-7.09368281e-05 2.75380717e-05 -7.09844339e-05] [-7.66273613e-05 -4.94650606e-05 -7.94945064e-05] [ 1.27970887e-04 1.96462685e-05 9.14329282e-05] [-1.29667596e-04 6.41344050e-05 8.05151320e-05] [-1.27971299e-04 -1.96475008e-05 -9.17018464e-05] [ 1.29667778e-04 -6.41336237e-05 -8.04311105e-05] [ 7.86163699e-05 1.09683411e-05 -5.65515047e-05] [-7.49070779e-05 -4.07673785e-06 -6.39106692e-05] [-7.86200908e-05 -1.09679934e-05 5.66380739e-05] [ 7.49077866e-05 4.07603843e-06 6.38654276e-05]] Final stress: [ 1.48983748e-05 1.45228532e-05 7.16473953e-06 -1.94022101e-05 6.88059799e-07 1.36783016e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 8.97561050e-06 3.86489078e-06 -1.23048009e-05] [-1.85754138e-05 -3.92576085e-06 6.52527084e-07] [ 7.85061859e-06 1.86384247e-05 -2.25048336e-06] [-3.81552274e-06 -1.77370654e-05 -6.38698143e-08] [ 2.08383046e-05 -9.42045452e-06 5.97343862e-06] [-1.44521442e-05 1.07820933e-05 -1.06476344e-05] [-1.70322412e-05 -2.15082633e-05 2.48066886e-05] [ 2.67316987e-05 -1.34542492e-05 1.85497944e-06] [-1.44860772e-06 -6.84556569e-06 1.05696596e-05] [-2.19184317e-05 -1.59130909e-05 5.91421203e-06] [-2.78093103e-06 9.75160544e-06 -3.45447495e-06] [-6.06860346e-06 1.80861691e-05 -1.11502750e-05] [-2.54494356e-06 -6.45377569e-06 -6.59991652e-06] [-4.90785211e-06 4.96025711e-06 -6.94139286e-06] [-4.59645768e-06 -1.17973083e-05 -1.53082874e-05] [-2.29884935e-05 3.99142474e-06 6.45679254e-06] [-1.19262276e-05 -8.83164609e-07 3.62241290e-05] [-1.27292754e-05 2.14285288e-05 -3.27299022e-05] [ 3.13908983e-05 -1.53710304e-05 2.19404273e-06] [ 2.94169904e-05 4.16936115e-05 -2.29358594e-05] [-3.69972019e-06 3.01484140e-06 3.99450795e-06] [ 7.05785061e-06 -1.06619753e-05 1.79649779e-05] [ 5.09316572e-06 2.83264846e-06 1.48397562e-06] [ 1.21297284e-05 -5.07279119e-06 6.29696570e-06]] Final stress: [ 3.18820321e-02 3.37445576e-02 1.34817269e-01 1.47198817e-05 -5.53035116e-07 -3.28213650e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.75147358e-05 1.64123841e-05 -9.96547368e-06] [ 8.27292907e-07 1.26582152e-05 -2.67774413e-05] [-2.44639916e-05 1.75697313e-06 8.32214928e-05] [ 1.60283558e-05 -1.69592188e-05 9.06263024e-06] [ 1.37115238e-05 -4.16308398e-05 -6.71863898e-06] [ 4.53614602e-05 2.74992684e-05 6.98264267e-06] [-1.13415985e-05 3.00477558e-05 4.61210765e-05] [-2.54144312e-05 -6.35503586e-05 -3.07158409e-06] [ 4.28499084e-05 1.44192720e-05 -8.81033857e-06] [-6.64365705e-05 1.97344423e-05 -1.36366614e-05] [-6.65801787e-05 -2.28164093e-05 -8.29717893e-06] [ 5.87770613e-05 -1.27965582e-05 1.36477848e-05] [ 3.65987157e-05 -4.89599152e-06 -2.92854759e-05] [-2.51281845e-05 -4.08881391e-05 -1.72486099e-05] [ 1.40653841e-05 -6.20856516e-07 1.31246650e-05] [-2.74255995e-05 4.44076850e-05 -1.37870068e-05] [ 2.01887270e-05 -3.41572897e-05 -3.28853946e-05] [-6.71886756e-06 9.55592400e-06 6.02110491e-06] [ 6.28324819e-06 -9.82360734e-06 6.68902210e-06] [-2.12293154e-05 -1.27651049e-05 1.69373094e-05] [-3.25570235e-05 1.72655459e-05 -2.31694018e-05] [ 8.93774259e-06 4.57272744e-05 8.41685608e-06] [-6.29705947e-06 1.64860949e-05 -2.05982512e-05] [ 2.24486648e-05 4.93353866e-06 4.02687268e-06]] Final stress: [ 0.03275523 0.03330868 0.13516011 -0.00088024 -0.00049959 0.00051207] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.24002140e-05 2.43603530e-05 -2.40442568e-04] [-4.51133815e-05 -4.58106905e-05 2.51359030e-04] [-2.23971152e-05 -2.43598396e-05 2.46897796e-04] [ 4.51076087e-05 4.58137790e-05 -2.45450791e-04] [-3.48474474e-09 -2.51606235e-06 -1.02294196e-06] [ 2.17547871e-06 1.26051566e-06 -1.02240608e-06] [-2.16569316e-06 1.25198323e-06 -1.01622163e-06] [ 2.10004145e-09 6.50398359e-06 -1.89978012e-06] [-5.63680218e-06 -3.25592561e-06 -1.90001625e-06] [ 5.62906727e-06 -3.24778709e-06 -1.89842565e-06] [-3.13427386e-06 6.53699138e-06 -1.07014718e-04] [-8.76523203e-05 5.75524767e-05 -8.48041933e-05] [-7.24720478e-05 -3.07139726e-05 -8.26326193e-05] [ 3.12885743e-06 -1.07614542e-05 1.05843974e-04] [ 9.13114412e-05 -5.54362614e-05 8.36320358e-05] [ 6.88202044e-05 3.28210936e-05 8.14632083e-05] [-1.34689708e-04 -7.02616040e-05 8.72210755e-05] [ 1.34618082e-04 -1.75675367e-05 9.95625649e-05] [ 1.34688935e-04 7.02619518e-05 -8.72263656e-05] [-1.34618842e-04 1.75677966e-05 -9.96962577e-05] [-7.80324754e-05 4.50418963e-06 -7.29604317e-05] [ 8.31518364e-05 -1.31454815e-05 -6.49690117e-05] [ 7.80354370e-05 -4.50405046e-06 7.30581632e-05] [-8.31531173e-05 1.31455517e-05 6.49189003e-05]] Final stress: [ 1.48114877e-05 1.43005388e-05 6.85769341e-06 1.95489002e-05 9.00047424e-07 -1.30286944e-05] Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 191 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.15454259e-06 6.83112004e-06 2.86167287e-06] [-8.90391725e-06 5.68503428e-06 8.49833432e-06] [-7.22023110e-06 -4.12811150e-06 -1.12621296e-05] [ 4.53472056e-06 -4.82440855e-06 1.05722081e-05] [-3.12109439e-06 -9.34243704e-06 -3.85561333e-06] [ 6.41718456e-06 -1.88357498e-06 6.78498282e-07] [-5.44522280e-06 -8.60465722e-06 6.59452632e-07] [-1.13506966e-05 7.21475064e-06 -2.66127387e-06] [-3.72424345e-06 5.38235300e-06 2.05130717e-06] [ 1.90559424e-05 -2.90128993e-06 -9.95703812e-07] [ 1.55129274e-05 -6.42041725e-07 2.12789934e-06] [-8.00854922e-06 1.30709135e-05 1.55383224e-06] [ 5.48689444e-06 -3.46599799e-06 -5.17388080e-06] [-6.13557878e-06 1.04999565e-05 3.13328770e-06] [-2.83536876e-06 -5.16127549e-06 -2.58316729e-06] [-4.51885487e-06 -1.29507021e-06 -1.99484816e-07] [ 4.17516583e-06 -4.33541860e-06 -9.71468422e-07] [ 4.10173414e-06 2.65329070e-06 -4.12617444e-06] [ 2.15301832e-06 -3.01443625e-06 -5.20287034e-07] [-1.58847068e-06 -1.51324324e-06 -2.99715580e-06] [-5.59258657e-07 5.11637065e-06 1.81256197e-06] [ 9.48105911e-06 -1.67595889e-06 -1.82043328e-06] [-6.21650290e-06 3.56568195e-06 -1.86354592e-06] [-2.44519985e-06 -7.23154973e-06 5.08126377e-06]] Final stress: [ 3.35845277e-02 3.24772289e-02 1.35159187e-01 7.66778099e-07 1.01446058e-03 -3.18607829e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-5.23351538e-04 1.87711751e-03 9.31565300e-04] [ 1.27487298e-03 -5.63774344e-04 1.20017027e-03] [ 1.34179180e-03 3.50347974e-04 -3.99356433e-04] [ 2.99164935e-04 -5.25108313e-04 -9.00252300e-04] [-8.12610722e-04 6.34762891e-04 3.47986936e-04] [-6.28121639e-04 7.82942911e-04 -4.09313866e-04] [ 1.49959956e-03 -9.97501355e-04 1.13750524e-03] [ 1.80985212e-05 3.28436868e-04 8.89092801e-04] [-1.29104760e-04 -1.34310895e-03 -4.26149463e-04] [ 1.01360063e-03 -6.88632919e-05 -9.94052939e-05] [-7.80023049e-04 3.69162784e-04 -5.23157115e-04] [-5.57440700e-04 8.00350577e-04 -1.85651154e-03] [-4.08096231e-04 9.97518009e-04 -2.86400652e-05] [-2.21553063e-03 -6.69227985e-04 -8.08045056e-04] [ 1.80012332e-03 -1.62406812e-03 -3.86961132e-04] [ 7.89654679e-04 7.69052498e-04 3.20358881e-04] [-6.53148065e-04 -1.67272448e-03 2.17499367e-04] [-4.46735641e-04 2.12876143e-04 -1.24941101e-03] [-6.86828551e-04 2.63013567e-04 4.97063763e-04] [-4.40529672e-04 3.41777503e-04 -6.83396576e-04] [-3.16060192e-04 4.95520952e-04 1.20153597e-03] [ 7.25561151e-04 7.18589067e-04 4.89803299e-04] [-3.06059521e-04 -9.90096360e-04 1.22364227e-03] [ 1.41173324e-04 -4.86996052e-04 -6.85624246e-04]] Final stress: [ 3.32818337e-02 3.23399411e-02 1.34818109e-01 -3.87662645e-06 -1.68063427e-05 8.36119566e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 3.66097609e-04 1.11391114e-03 2.90457076e-03] [ 1.22020855e-05 -1.22735126e-03 7.34392517e-03] [-4.15239232e-04 -1.13559099e-03 2.12961516e-03] [ 1.16036581e-04 1.25201443e-03 -1.65059611e-03] [ 5.23014911e-05 6.19740017e-03 6.93782020e-04] [-5.49153852e-03 -3.18337935e-03 7.41542053e-04] [ 5.34775270e-03 -3.03932022e-03 6.91004550e-04] [-1.28130946e-04 1.01454524e-02 -2.70782801e-03] [-8.62387580e-03 -4.92593231e-03 -2.56560426e-03] [ 8.83265061e-03 -5.19516250e-03 -2.78776013e-03] [-6.38607918e-03 -1.05078503e-02 3.27690120e-03] [ 1.37971531e-02 -2.87749678e-03 1.70225810e-03] [-4.36056480e-03 1.30433114e-02 2.26022985e-03] [ 6.41603632e-03 -1.03753195e-02 -4.74140797e-03] [ 4.24222249e-03 1.32515230e-02 -3.12690779e-03] [-1.38346949e-02 -2.53500916e-03 -3.73926294e-03] [ 2.08184691e-03 -6.90938974e-04 9.45904936e-04] [-1.27343507e-03 6.22372146e-04 -1.72536310e-05] [-2.08237148e-03 6.98606520e-04 -7.36949479e-04] [ 1.21798807e-03 -6.24727542e-04 -4.33806067e-04] [ 8.99154857e-04 -2.92298934e-04 -1.20080609e-03] [-4.86500251e-04 3.03994445e-04 -1.11003215e-03] [-8.42844726e-04 2.84682552e-04 1.42191475e-03] [ 5.43832020e-04 -3.02890432e-04 7.06566085e-04]] Final stress: [-1.24903195e-04 -6.79504628e-05 -8.46615549e-05 -2.96698816e-05 -2.99794275e-05 9.69118846e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 7.26155480e-05 4.76408784e-04 2.03320141e-03] [-1.12060710e-04 -5.07747644e-04 -4.88498160e-03] [-2.23373347e-05 -4.69292271e-04 -4.61611583e-03] [ 7.15006610e-05 4.75895601e-04 2.28155758e-03] [-4.17567851e-06 -7.41202883e-04 2.52426192e-04] [ 6.48983966e-04 3.82221201e-04 2.27214455e-04] [-6.36617020e-04 3.70219076e-04 2.48463519e-04] [-2.40288968e-05 6.71690098e-04 2.47849845e-04] [-5.42701303e-04 -3.14245571e-04 2.42972947e-04] [ 5.53861872e-04 -3.48024582e-04 2.73107160e-04] [-4.78808365e-03 -8.21474943e-04 1.79977128e-03] [ 2.35353541e-03 -5.23050309e-03 1.72724535e-03] [ 1.89789916e-03 3.06496302e-03 1.81900363e-03] [ 4.77810621e-03 9.11530493e-04 -7.05962263e-04] [-2.40337066e-03 5.19895415e-03 -7.12244602e-04] [-1.83874792e-03 -3.11331093e-03 -7.11099030e-04] [-3.34773246e-04 1.46659730e-03 3.60089794e-04] [ 3.37768477e-04 -1.46498039e-03 1.97635956e-04] [ 3.31565164e-04 -1.46452808e-03 -2.54548116e-04] [-3.41851973e-04 1.46103713e-03 -8.98992581e-05] [ 6.56923515e-05 1.64469322e-04 4.08142834e-04] [-5.64417025e-05 -1.65658393e-04 3.06388922e-04] [-7.55095019e-05 -1.67677983e-04 -2.77636691e-04] [ 6.91707759e-05 1.64660594e-04 -1.72583491e-04]] Final stress: [-2.43819415e-04 -2.41406236e-04 -2.25484896e-04 -5.62630453e-08 2.32210947e-07 -6.28354986e-05] Minimization converged after 171 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[-3.18429417e-04 -2.09852281e-02 1.59494038e-01] [ 6.55289798e-04 2.10554471e-02 -2.07527014e-01] [-2.38286726e-03 2.40008258e-02 -1.98773718e-01] [-8.31115987e-04 -2.11958792e-02 1.66854538e-01] [-1.93895004e-03 -1.30865715e-02 3.81852198e-03] [ 8.36255285e-03 7.94890686e-03 4.22561080e-03] [-5.30953201e-03 3.91004542e-03 5.55492590e-03] [-1.34700647e-03 -2.50533635e-03 6.67370191e-03] [ 2.56855339e-03 2.24171733e-03 6.12339404e-03] [ 7.94325713e-04 -1.27890011e-03 3.21923838e-03] [-4.19900885e-02 -2.83750413e-04 7.47271505e-02] [ 3.89432362e-02 -3.60043438e-02 7.41613855e-02] [ 8.16874047e-03 4.08761960e-02 7.13298523e-02] [ 4.16172470e-02 -5.01832469e-03 -5.78278619e-02] [-3.65529257e-02 3.85578326e-02 -5.93671145e-02] [-9.58023573e-03 -3.91907991e-02 -5.89322388e-02] [-3.34874447e-03 -2.64513310e-04 1.16230711e-02] [ 3.58733620e-03 6.99577241e-04 3.08231430e-03] [ 3.00664012e-03 5.72706133e-04 -1.00628219e-02] [-4.01312264e-03 -5.77247374e-04 -1.87713785e-03] [-5.88460484e-03 -4.97670840e-03 1.31681421e-04] [ 6.41614102e-03 5.61575237e-03 -4.91759178e-03] [ 5.63688396e-03 5.28347572e-03 1.16436226e-03] [-6.25932354e-03 -5.39488020e-03 7.10171268e-03]] Final stress: [ 2.34277210e-04 -1.60355164e-04 -3.20923659e-04 1.86958554e-05 2.75916294e-05 -2.55887353e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.14124715e-04 -1.85966563e-04 -1.00055926e-05] [ 1.14124632e-04 1.85964317e-04 -1.00521847e-05] [ 1.14124104e-04 1.85967366e-04 1.01084510e-05] [-1.14123879e-04 -1.85966211e-04 1.01660127e-05] [ 1.25902607e-10 -5.51304977e-08 -1.92048838e-08] [ 4.72272651e-08 2.77288078e-08 -2.00220864e-08] [-4.78850259e-08 2.82431002e-08 -2.08142726e-08] [ 6.10172591e-10 1.25760190e-07 -3.42356664e-08] [-1.09241669e-07 -6.32327777e-08 -3.39251169e-08] [ 1.08894746e-07 -6.23954804e-08 -3.44413257e-08] [-1.61160740e-05 -5.23844729e-05 2.09305166e-09] [ 2.63891508e-06 -8.71353003e-05 -6.43449061e-10] [-5.51097008e-05 -7.55819496e-05 -9.42343816e-10] [ 1.61162873e-05 5.22829321e-05 -1.85363410e-08] [-2.55180511e-06 8.71859461e-05 -1.79018733e-08] [ 5.50223271e-05 7.56329123e-05 -1.85405194e-08] [ 3.41778515e-05 -2.14721719e-05 6.64136032e-06] [-3.41777867e-05 2.14721222e-05 6.63860512e-06] [-3.41777917e-05 2.14721836e-05 -6.64068202e-06] [ 3.41778877e-05 -2.14719353e-05 -6.64107843e-06] [-4.47968440e-06 -4.47813940e-06 1.76325684e-05] [ 4.47968721e-06 4.47800752e-06 1.76302690e-05] [ 4.47962951e-06 4.47808129e-06 -1.76300466e-05] [-4.47961598e-06 -4.47809730e-06 -1.76305674e-05]] Final stress: [ 4.10462389e-05 3.26445146e-05 2.45912522e-05 -9.71390055e-12 -9.89861032e-13 -9.87158802e-06] Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 6.66127255e-05 -3.94703316e-04 4.06745444e-04] [-7.37901161e-05 3.90522809e-04 -7.01835067e-04] [-7.33642367e-05 3.85630840e-04 -5.37302103e-04] [ 7.13972642e-05 -3.90304603e-04 3.67045833e-04] [-2.39021267e-06 1.62181356e-05 4.29073548e-05] [-1.49080053e-05 -5.98929010e-06 4.28343838e-05] [ 2.01456364e-05 -1.17977890e-05 4.58725364e-05] [-6.80572235e-06 -3.02093382e-05 2.23288003e-05] [ 5.24930043e-05 2.70905588e-05 3.69356787e-05] [-3.85561526e-05 1.12874629e-05 2.65708562e-05] [-1.80476944e-03 -1.48405507e-04 2.17079408e-04] [ 1.00699517e-03 -1.47643306e-03 2.17601548e-04] [ 1.01969741e-03 1.58941442e-03 2.20380426e-04] [ 1.80250812e-03 3.63330987e-04 -1.45304230e-04] [-1.17942612e-03 1.37377744e-03 -1.42669707e-04] [-8.43256830e-04 -1.69684936e-03 -1.46536754e-04] [ 7.30869607e-05 -2.29948802e-04 1.42013658e-04] [-7.35196388e-05 2.28993288e-04 1.20946231e-04] [-7.36596608e-05 2.30407940e-04 -1.38005033e-04] [ 7.18112121e-05 -2.30590112e-04 -1.11420133e-04] [ 3.33438697e-05 1.05511673e-04 1.59796650e-04] [-3.24667649e-05 -1.06813571e-04 1.47136786e-04] [-3.38946790e-05 -1.06125093e-04 -1.55150641e-04] [ 3.27162073e-05 1.05984291e-04 -1.37971927e-04]] Final stress: [-1.25854847e-04 -2.63914173e-04 -2.16753746e-04 -2.96184031e-08 4.76973265e-08 -8.50114012e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-2.85057010e-05 -1.02926560e-03 7.22582688e-03] [-1.78507137e-05 9.06733847e-04 -1.76477066e-02] [-1.78969464e-04 8.71413576e-04 -8.96817548e-03] [-5.62766008e-06 -1.01901198e-03 -1.87043205e-03] [-1.56173352e-05 7.45561214e-05 1.93351567e-03] [ 1.45536052e-04 1.21829785e-05 1.83371820e-03] [-1.46684506e-04 -5.52625078e-06 1.82444576e-03] [-7.64368253e-05 -5.20468557e-03 1.63771519e-03] [ 4.85467172e-03 2.77092888e-03 1.81419483e-03] [-4.63209291e-03 2.55413076e-03 1.67790186e-03] [ 5.36875269e-03 1.53694756e-02 4.44315675e-03] [-1.65983427e-02 9.06603720e-04 4.54538120e-03] [ 7.27584918e-03 -1.23560425e-02 4.40423538e-03] [-5.34977599e-03 1.22180734e-02 -1.29882423e-03] [-7.00708659e-03 -1.45977489e-02 -1.30954369e-03] [ 1.64801221e-02 -1.39937605e-03 -1.28617470e-03] [ 2.45453497e-04 -1.01720643e-03 -3.04855233e-04] [-2.51026347e-04 1.00301918e-03 -2.48260356e-04] [-2.36977697e-04 1.00734191e-03 1.49991658e-04] [ 2.46753669e-04 -1.01159963e-03 9.61086379e-04] [-9.83549660e-04 3.11958073e-04 2.10394978e-04] [ 9.34425690e-04 -3.47463397e-04 1.62836837e-04] [ 9.46007909e-04 -3.40028280e-04 -1.65271396e-04] [-9.69028357e-04 3.21536627e-04 2.74842199e-04]] Final stress: [-8.40650678e-07 -2.76528713e-04 -1.23857724e-04 -3.10717240e-07 -5.04096798e-07 -3.82443097e-07] Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-1.93048069e-05 -1.61303675e-05 4.66362355e-06] [ 3.44038132e-05 1.79053292e-05 1.65044559e-04] [ 1.92652017e-05 1.61796432e-05 6.19357514e-05] [-3.43476025e-05 -1.79026039e-05 1.20045150e-04] [ 5.16279456e-09 -1.42150957e-04 -5.18496137e-05] [ 1.23075049e-04 7.10509589e-05 -5.18353055e-05] [-1.23156488e-04 7.11032695e-05 -5.18685864e-05] [-6.91387591e-09 1.38114635e-04 -3.45712128e-05] [-1.19689798e-04 -6.90626791e-05 -3.46451141e-05] [ 1.19740668e-04 -6.90990439e-05 -3.46024607e-05] [ 4.14205078e-05 -1.66225473e-04 -1.74715140e-04] [ 1.21132973e-04 8.95403520e-05 -1.67355053e-04] [-5.03363381e-05 4.98615238e-05 -1.54908549e-04] [-4.13491424e-05 -7.88045408e-05 1.44119132e-04] [ 9.09735885e-05 3.29007123e-05 1.36764875e-04] [-1.61848245e-04 7.27041680e-05 1.24283039e-04] [ 1.01519908e-04 -1.06527314e-05 5.45067630e-05] [-4.87691762e-05 1.28751720e-05 8.56536043e-05] [-1.01505402e-04 1.06513731e-05 -5.23466005e-05] [ 4.87874268e-05 -1.28665597e-05 -9.10559033e-05] [ 5.36972066e-05 6.22908040e-06 -2.97223561e-05] [-4.58930960e-05 -2.96043899e-06 -4.73582258e-05] [-5.37504487e-05 -6.22337122e-06 3.23273485e-05] [ 4.59359500e-05 2.96254878e-06 4.74902751e-05]] Final stress: [ 1.54681411e-05 1.49848683e-05 7.87853626e-06 5.18509549e-07 -1.21002769e-05 8.31324678e-06] Minimization converged after 16 steps. Minimization converged after 18 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 45 steps. Final forces: [[ 0.0426853 0.05431453 -0.19236209] [-0.04069964 -0.08238509 -0.49960012] [-0.02946109 -0.04573199 -0.22665293] [-0.02593902 0.08040614 -0.53338392] [-0.04153999 0.02548622 0.13358603] [ 0.01393215 0.03542057 0.10682544] [ 0.07860806 -0.06646502 0.1751793 ] [ 0.02729258 0.30381604 0.01685858] [-0.30256701 -0.18693515 -0.00283902] [ 0.24568354 -0.12209057 0.03375168] [-0.11329402 0.09237625 0.10614201] [-0.01580052 -0.17373715 0.08392898] [ 0.19650004 0.11850968 0.13311948] [ 0.07047974 0.11963319 0.19490632] [-0.12727472 0.11719632 0.18415001] [ 0.02920679 -0.26933686 0.17798933] [-0.03203636 0.03177221 -0.01252562] [ 0.05525514 -0.02194106 0.00449729] [ 0.02196983 -0.03037856 0.04191815] [-0.0452181 0.01948743 0.02606126] [ 0.06680934 0.01725558 0.07919799] [ 0.01143082 -0.00477273 0.05580607] [-0.06754273 -0.01590627 -0.05544595] [-0.01848012 0.00400632 -0.03110826]] Final stress: [ 4.75807388e-04 2.01411902e-03 -5.85734467e-04 1.33822401e-05 -8.38102654e-04 1.11046446e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.84929538e-05 -1.08321646e-03 -2.92215859e-05] [-3.84910352e-05 1.08321839e-03 -2.89222195e-05] [-3.84912784e-05 1.08321694e-03 2.89296219e-05] [ 3.84902651e-05 -1.08321741e-03 2.88895534e-05] [ 1.88331648e-10 1.22415404e-07 2.39026360e-08] [-1.07569455e-07 -6.15686880e-08 2.46661081e-08] [ 1.07996434e-07 -6.17673285e-08 2.50663042e-08] [ 9.95967319e-10 -2.72961836e-07 7.56483008e-08] [ 2.34433244e-07 1.34946696e-07 7.43841296e-08] [-2.37209916e-07 1.37661784e-07 7.57513605e-08] [-1.48810790e-04 4.38991019e-05 -2.51450054e-08] [ 3.01099058e-04 -4.44953710e-04 -2.35064460e-08] [-4.92082563e-04 -5.09052773e-04 -2.45290008e-08] [ 1.48811010e-04 -4.40158153e-05 3.73566643e-08] [-3.00999417e-04 4.45011476e-04 3.51992597e-08] [ 4.91982470e-04 5.09111190e-04 3.73401231e-08] [-1.58687479e-04 -2.26402191e-04 3.89152276e-04] [ 1.58687700e-04 2.26402369e-04 3.89154371e-04] [ 1.58687530e-04 2.26402317e-04 -3.89151043e-04] [-1.58687477e-04 -2.26402348e-04 -3.89156798e-04] [-2.57611194e-06 -4.89440740e-05 1.67643810e-04] [ 2.57624328e-06 4.89442285e-05 1.67647968e-04] [ 2.57656103e-06 4.89441533e-05 -1.67650291e-04] [-2.57647521e-06 -4.89441047e-05 -1.67651797e-04]] Final stress: [ 1.73994368e-05 1.79933766e-05 -1.67928810e-05 6.68728585e-12 6.06090980e-12 -3.58330892e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 1.65989260e-04 -2.53567636e-04 2.25675909e-03] [ 7.82014644e-04 4.83116242e-04 3.79337738e-03] [ 2.24244315e-04 4.70150362e-04 1.97077461e-02] [ 8.08030289e-06 -2.96821566e-04 -1.24927810e-02] [ 4.28297469e-04 1.38782271e-02 3.52536146e-03] [-1.28019383e-02 -7.60646860e-03 4.08989917e-03] [ 1.16106403e-02 -6.41748312e-03 3.20606258e-03] [ 5.61870955e-04 2.16226924e-02 -6.38359346e-03] [-1.95128511e-02 -1.15705950e-02 -6.79488240e-03] [ 1.82471603e-02 -1.01827244e-02 -6.15113078e-03] [ 8.82484433e-03 -4.51535482e-03 -3.76453452e-03] [ 1.63128409e-04 1.22176463e-02 -3.46116772e-03] [-8.13837631e-03 -5.31330885e-03 -4.07991156e-03] [-9.13577245e-03 -7.60222651e-03 2.29378505e-03] [ 9.85997284e-03 -6.01924231e-03 2.16939638e-03] [-1.70978572e-03 1.10260060e-02 2.35090426e-03] [ 2.42782517e-04 2.40530333e-03 3.21980714e-04] [-1.08179938e-04 -2.39839171e-03 4.85034456e-04] [-1.55646604e-04 -2.39115150e-03 -2.01511750e-04] [ 1.78438597e-04 2.41807081e-03 -8.25122344e-04] [ 1.35564072e-04 8.67776378e-04 -1.43784934e-03] [ 3.59540766e-05 -8.68585783e-04 -1.62582858e-03] [ 1.03837467e-05 -8.58450973e-04 1.86111958e-03] [ 8.31842930e-05 9.05384009e-04 1.15688725e-03]] Final stress: [-1.83343600e-04 -3.17564585e-04 -1.91424346e-04 -7.52351625e-08 3.16044888e-06 9.67273628e-05] Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 4 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 16 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 6 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 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. 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 8 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 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 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 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 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 6 steps. Minimization converged after 7 steps. Minimization converged after 7 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 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 0 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 6 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 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 7 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 9 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 2 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 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 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 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 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 8 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 0 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 9 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 4 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 9 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 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 2 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 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 7 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 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 0 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 0 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 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 0 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 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 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 8 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 6 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 0 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 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 4 steps. Minimization converged after 4 steps. Minimization converged after 0 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 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 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 0 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 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 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 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 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 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]: [[ 1.16991 0.6426 0.59804 0.00045 0. 0.0001 ] [ 0.6426 1.16991 0.59708 0.00001 0.00005 0.00003] [ 0.59804 0.59708 1.11954 -0.00001 0. -0. ] [ 0.00045 0.00001 -0.00001 -0.21588 0. 0.00009] [ 0. 0.00005 0. 0. -0.21595 0.00005] [ 0.0001 0.00003 -0. 0.00009 0.00005 0.26894]] 95%% Error estimate [ASE units]: [[0.01362 0.02507 0.02095 0.00046 0.00004 0.00017] [0.02507 0.01365 0.00917 0.00023 0.00017 0.00004] [0.02095 0.00917 0.00294 0.00003 0. 0.00004] [0.00046 0.00023 0.00003 0.00019 0.00001 0.00014] [0.00004 0.00017 0. 0.00001 0.00026 0.00035] [0.00017 0.00004 0.00004 0.00014 0.00035 0.00696]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.012536 is too big compared to maximum elastic constant component 1.169908 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.005281 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 3 steps. Minimization converged after 29 steps. Minimization converged after 26 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 5.57287549e-12 9.91395437e-05 1.80921107e-04] [ 4.89317186e-12 -9.91395451e-05 1.80919601e-04] [ 8.09947012e-13 -9.91395475e-05 -1.80920133e-04] [ 1.35585987e-13 9.91395453e-05 -1.80920048e-04] [-5.43862405e-12 1.62178215e-10 8.02710121e-11] [-1.30173913e-10 -7.56322990e-11 7.94155297e-11] [ 1.33974831e-10 -8.38731307e-11 7.59627916e-11] [-6.02509308e-13 8.43772163e-10 -2.46448084e-10] [-7.24504234e-10 -4.21930380e-10 -2.47588616e-10] [ 7.17168103e-10 -4.18282409e-10 -2.36311592e-10] [-4.55990801e-12 -1.98905110e-04 1.31624785e-10] [-4.26864131e-04 -1.03620690e-04 1.38745400e-10] [ 4.26864136e-04 -1.03620699e-04 1.31097540e-10] [ 2.53463917e-13 1.98905481e-04 -1.52642041e-10] [ 4.26863802e-04 1.03620507e-04 -1.53381634e-10] [-4.26863803e-04 1.03620508e-04 -1.50609697e-10] [-3.37868622e-13 -2.50700979e-04 -6.82860305e-06] [-7.17759185e-14 2.50700979e-04 -6.82861547e-06] [-7.84927678e-13 2.50700978e-04 6.82859831e-06] [-4.69763117e-13 -2.50700979e-04 6.82862275e-06] [ 2.78777001e-13 2.68815700e-04 -5.08964247e-05] [ 5.08914877e-13 -2.68815699e-04 -5.08964477e-05] [ 6.36965903e-13 -2.68815700e-04 5.08964441e-05] [-2.08832951e-13 2.68815700e-04 5.08964479e-05]] Final stress: [ 5.17215092e-04 -4.94084414e-04 9.26460504e-06 1.10783460e-14 2.80021125e-14 -4.44675356e-15] Minimization converged after 25 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-2.11975992e-11 3.04634710e-05 1.70533391e-04] [-2.82788069e-11 -3.04634854e-05 1.70535294e-04] [-1.48334925e-11 -3.04636141e-05 -1.70527653e-04] [ 1.88269955e-11 3.04636250e-05 -1.70540628e-04] [-9.93620941e-12 -4.94917257e-09 -2.44496479e-10] [ 3.94423176e-09 2.42053983e-09 -1.02788444e-10] [-3.94674948e-09 2.41012538e-09 -1.22187899e-10] [ 1.17371828e-10 7.00103975e-09 -1.69572156e-09] [-5.82826132e-09 -3.53644491e-09 -1.53757362e-09] [ 5.64336533e-09 -3.29386557e-09 -1.45827232e-09] [-1.04875886e-10 -1.94701218e-04 -7.25258796e-10] [ 1.54136251e-04 -3.05288675e-05 -6.91259199e-10] [-1.54136061e-04 -3.05290997e-05 -7.04392935e-10] [-9.47046330e-11 1.94709563e-04 1.92541018e-09] [-1.54143611e-04 3.05248702e-05 2.02026985e-09] [ 1.54143762e-04 3.05246738e-05 1.94911644e-09] [-2.99760217e-14 -1.27797547e-04 1.57660563e-04] [ 1.12437837e-11 1.27797547e-04 1.57660855e-04] [ 1.92262872e-12 1.27797577e-04 -1.57660512e-04] [ 1.39210865e-11 -1.27797572e-04 -1.57660567e-04] [-1.28617117e-11 1.62452373e-04 -2.93131156e-04] [-9.43355732e-12 -1.62452363e-04 -2.93130981e-04] [-1.04280364e-11 -1.62452372e-04 2.93131431e-04] [-9.94904159e-12 1.62452384e-04 2.93131351e-04]] Final stress: [ 1.75589961e-03 1.25907051e-03 1.71643200e-03 -1.10851340e-13 -1.51480354e-13 1.50479346e-14] Minimization converged after 30 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[ 2.83706115e-04 -7.39122798e-04 -8.19508394e-04] [-2.76870011e-05 4.51056573e-04 5.78893983e-04] [ 4.82857376e-04 -6.25840655e-04 -8.39476488e-04] [ 1.31494441e-04 3.70378424e-04 6.08285843e-04] [-1.27051993e-03 -1.73453641e-03 -9.32676094e-04] [ 2.18412993e-04 -1.24785226e-03 -4.07879315e-04] [ 1.96998719e-03 -3.81328733e-04 1.72797850e-03] [ 1.74380985e-04 1.18378984e-03 1.00976445e-03] [-1.41305424e-03 -1.65735109e-04 -5.64144632e-04] [-9.14744820e-04 3.51788863e-04 2.81084983e-03] [ 9.89366286e-05 2.17572825e-04 6.27655366e-04] [-5.96303612e-04 3.78723231e-04 -5.79519232e-04] [ 5.28527771e-04 6.80543308e-04 -1.61743818e-03] [-1.11261762e-03 1.64323029e-04 6.13720564e-04] [ 9.65478576e-05 2.90364268e-04 -3.54048187e-04] [ 1.26734551e-03 6.13464721e-04 -1.79246021e-03] [ 4.94722830e-05 -1.24437023e-04 -5.64229084e-06] [-1.01132333e-04 -3.87404520e-05 -2.18252078e-04] [ 6.84632528e-05 -2.37075242e-04 -1.60464929e-04] [-1.02490992e-04 1.24215474e-04 1.52304198e-04] [ 2.30627523e-04 -4.96647729e-05 9.64252090e-05] [-1.41048204e-04 2.90960882e-04 -3.42680406e-05] [ 1.57590134e-04 -1.10564546e-04 5.40869453e-05] [-7.87513014e-05 3.37716557e-04 4.58131787e-05]] Final stress: [-1.41377977e-03 -6.84366328e-04 -7.00629913e-04 -6.05959133e-04 -1.12790418e-06 2.38011075e-06] Minimization converged after 61 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 2.74376084e-03 -2.59152217e-03 -3.34168066e-04] [-2.74376079e-03 2.59152212e-03 -3.34134119e-04] [-2.74376079e-03 2.59152214e-03 3.34149771e-04] [ 2.74376078e-03 -2.59152213e-03 3.34149776e-04] [-2.16274516e-11 -1.21636009e-08 -3.77371062e-09] [ 1.06055961e-08 6.11549299e-09 -3.88390692e-09] [-1.05673936e-08 6.06027639e-09 -3.76018330e-09] [ 1.57576190e-10 -1.64409584e-08 4.74198292e-09] [ 1.40437013e-08 8.04156730e-09 4.78192008e-09] [-1.43243512e-08 8.38689357e-09 4.79955010e-09] [-2.07470548e-03 -4.21332864e-03 -3.04822356e-09] [ 1.25939740e-03 1.11045340e-03 -3.04286574e-09] [ 2.83580776e-04 -2.32878688e-03 -3.09025417e-09] [ 2.07470548e-03 4.21332502e-03 2.99085575e-09] [-1.25939418e-03 -1.11045157e-03 3.05458364e-09] [-2.83583983e-04 2.32878869e-03 3.04667451e-09] [-1.77420552e-03 -1.00982475e-03 5.76732507e-04] [ 1.77420550e-03 1.00982473e-03 5.76732847e-04] [ 1.77420550e-03 1.00982473e-03 -5.76732474e-04] [-1.77420549e-03 -1.00982474e-03 -5.76732922e-04] [-1.51721143e-05 6.28563032e-05 2.02929502e-03] [ 1.51721436e-05 -6.28562927e-05 2.02929564e-03] [ 1.51721593e-05 -6.28562849e-05 -2.02929543e-03] [-1.51721138e-05 6.28563053e-05 -2.02929536e-03]] Final stress: [ 1.12216828e-03 6.91642640e-04 5.14895033e-04 -4.16647112e-13 -2.35303898e-13 4.53733372e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-2.74576195e-03 -2.58746837e-03 -3.37545490e-04] [ 2.74576188e-03 2.58746841e-03 -3.37514984e-04] [ 2.74576182e-03 2.58746844e-03 3.37536243e-04] [-2.74576191e-03 -2.58746836e-03 3.37533986e-04] [ 1.09371019e-12 -1.18631364e-08 -4.05239936e-09] [ 1.01288230e-08 5.91033346e-09 -3.98620537e-09] [-1.01111419e-08 5.89236815e-09 -4.05613049e-09] [-1.51391276e-10 -8.17071411e-09 2.28565877e-09] [ 7.08674253e-09 4.23412438e-09 2.32002606e-09] [-6.77429934e-09 3.87000881e-09 2.15624297e-09] [ 2.07491278e-03 -4.21392066e-03 -3.59241638e-09] [-2.81143404e-04 -2.32711943e-03 -3.61419231e-09] [-1.26795926e-03 1.11575956e-03 -3.64517009e-09] [-2.07491283e-03 4.21391247e-03 2.25699372e-09] [ 2.81150452e-04 2.32712357e-03 2.26295543e-09] [ 1.26795232e-03 -1.11575554e-03 2.27811372e-09] [ 1.77242597e-03 -1.00866487e-03 5.76253843e-04] [-1.77242597e-03 1.00866487e-03 5.76254097e-04] [-1.77242596e-03 1.00866488e-03 -5.76253827e-04] [ 1.77242594e-03 -1.00866486e-03 -5.76254335e-04] [ 1.47795537e-05 6.30353290e-05 2.03022476e-03] [-1.47795750e-05 -6.30353167e-05 2.03022524e-03] [-1.47795831e-05 -6.30353126e-05 -2.03022505e-03] [ 1.47795433e-05 6.30353350e-05 -2.03022510e-03]] Final stress: [ 1.12225248e-03 6.91667186e-04 5.14977229e-04 -3.23065981e-13 4.44029901e-13 -4.53783238e-04] Minimization converged after 93 steps. Minimization converged after 167 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-4.27816116e-11 1.59273667e-04 6.12900368e-04] [-8.68850388e-11 -1.59273773e-04 6.12909541e-04] [ 1.68848726e-11 -1.59273524e-04 -6.12895444e-04] [ 2.11345302e-10 1.59273671e-04 -6.12905715e-04] [-3.28613931e-11 -2.89780439e-09 -6.77299661e-10] [ 3.05611503e-09 1.56704279e-09 -8.63512789e-10] [-3.05362613e-09 1.52866814e-09 -9.19923721e-10] [ 9.67648657e-11 2.37409958e-09 -7.76005815e-10] [-2.34680264e-09 -1.36491418e-09 -9.86143611e-10] [ 2.18785029e-09 -1.15951382e-09 -9.16482709e-10] [-1.35649936e-10 2.15913762e-03 -2.25065570e-09] [-4.72791199e-04 -3.83465114e-04 -2.38617657e-09] [ 4.72791446e-04 -3.83465414e-04 -2.30887167e-09] [ 1.62436675e-10 -2.15913718e-03 1.06490645e-09] [ 4.72790630e-04 3.83464822e-04 1.34153985e-09] [-4.72790937e-04 3.83465190e-04 1.02876975e-09] [-5.28702082e-12 3.72895363e-04 -2.99797303e-04] [-4.07440748e-12 -3.72895390e-04 -2.99797083e-04] [ 7.95352673e-12 -3.72895404e-04 2.99797225e-04] [ 1.55819246e-11 3.72895392e-04 2.99796995e-04] [-1.73304149e-11 -4.07906341e-04 4.36609230e-04] [ 1.85276393e-11 4.07906348e-04 4.36609436e-04] [ 2.22187046e-11 4.07906368e-04 -4.36609237e-04] [-1.05128128e-11 -4.07906355e-04 -4.36609362e-04]] Final stress: [ 1.30887505e-03 2.28967201e-03 1.19747288e-03 -6.06797902e-13 -1.02621437e-12 -1.20334880e-13] Minimization converged after 27 steps. Minimization converged after 30 steps. Minimization converged after 31 steps. Minimization converged after 26 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-3.50849863e-08 1.18873227e-05 1.06944071e-06] [ 3.78676081e-08 -1.29141553e-05 1.86149397e-06] [-4.37333544e-08 -1.19220052e-05 5.49681608e-06] [ 4.70437865e-08 1.28904225e-05 -8.50864558e-07] [ 7.41050730e-08 1.73149782e-06 2.39088183e-07] [-1.63934863e-06 -9.58291004e-07 2.95220206e-07] [ 1.47626516e-06 -7.78326529e-07 1.75441035e-07] [-6.60489954e-08 5.75910350e-06 -1.80475732e-06] [-4.85129715e-06 -2.78370262e-06 -1.74268748e-06] [ 4.99661314e-06 -2.94349038e-06 -1.84965824e-06] [-1.55871971e-08 -1.83249102e-05 -9.79922392e-07] [ 7.43743609e-06 -2.08704793e-05 4.90781644e-06] [-7.41036226e-06 -2.09045122e-05 4.88009877e-06] [ 9.78779224e-09 1.51890227e-05 9.45837826e-08] [-4.53213905e-06 2.24686306e-05 -5.78424223e-06] [ 4.51362167e-06 2.24908344e-05 -5.81247129e-06] [ 9.69415828e-09 -2.17456785e-05 3.35718667e-05] [-8.87453960e-09 3.06415550e-05 6.07260153e-06] [ 9.44606204e-09 2.17565951e-05 -3.35847024e-05] [-8.62722324e-09 -3.06515951e-05 -6.19537919e-06] [-3.40797551e-09 2.40746981e-05 -5.60770278e-05] [ 2.96281805e-09 -4.74630540e-05 -2.64640411e-05] [-4.76257183e-10 -2.40868420e-05 5.61539576e-05] [ 1.44250112e-10 4.74573601e-05 2.63273290e-05]] Final stress: [ 6.47917912e-04 1.17859347e-03 6.38780507e-04 -4.30155459e-04 -2.15883801e-12 -1.16486918e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.39151210e-08 1.31643285e-05 -2.45410276e-07] [ 1.78444000e-08 -1.18431928e-05 1.24989260e-05] [-2.79142923e-08 -1.31153224e-05 -2.93139040e-06] [ 2.87992646e-08 1.17611885e-05 1.58872319e-05] [ 3.06012444e-08 -1.62301268e-05 -5.57274860e-06] [ 1.40875799e-05 8.08359113e-06 -5.63991770e-06] [-1.41545836e-05 8.15735348e-06 -5.68941409e-06] [-6.10238023e-08 1.50480277e-06 -2.18589025e-07] [-1.34416273e-06 -7.00632686e-07 -2.14673258e-07] [ 1.47367435e-06 -8.46113103e-07 -3.05841823e-07] [ 1.07242655e-08 -2.61327781e-05 -3.70821750e-07] [ 1.40631296e-05 -1.68390402e-05 -5.88349339e-06] [-1.40790537e-05 -1.68174560e-05 -5.89484966e-06] [ 3.23548319e-08 7.27855467e-06 -2.04347201e-06] [ 2.41939637e-06 2.62564898e-05 3.43903092e-06] [-2.47403327e-06 2.63255150e-05 3.42005346e-06] [ 4.00262584e-09 -3.06949052e-05 5.53227739e-06] [-7.95324712e-09 2.14331405e-05 3.26352085e-05] [ 4.14271506e-09 3.06678566e-05 -5.38139771e-06] [-7.42679762e-09 -2.14055319e-05 -3.30929089e-05] [-3.38319650e-10 4.73362255e-05 -2.64382594e-05] [ 4.16381798e-09 -2.43699501e-05 -5.61553597e-05] [ 2.18278627e-09 -4.73160934e-05 2.63689269e-05] [ 1.80871179e-09 2.43420962e-05 5.62968926e-05]] Final stress: [ 6.47901468e-04 1.17857353e-03 6.38815339e-04 4.30174021e-04 -1.94650313e-11 -9.86174718e-12] Minimization converged after 50 steps. Minimization converged after 49 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-7.43383234e-06 1.09819659e-04 -1.60573432e-04] [-9.12349368e-06 -1.07325048e-04 5.95752749e-05] [ 5.91839335e-06 -1.06315764e-04 2.18626666e-04] [ 1.04405327e-05 1.07503308e-04 -1.14911783e-05] [ 1.59383155e-08 5.69059642e-06 -5.54526948e-06] [-7.03160711e-06 -3.28972307e-06 -4.59243549e-06] [ 6.57165716e-06 -3.00082039e-06 -5.26618807e-06] [-9.50199876e-07 -2.76473445e-05 -2.03441268e-06] [ 1.75642366e-05 1.34585818e-05 -4.89431633e-06] [-1.50395735e-05 1.08870002e-05 -7.04536511e-06] [-2.06089579e-06 7.05289120e-05 -5.12469586e-05] [-1.83526055e-05 1.31759573e-04 1.23805197e-04] [ 2.32900530e-05 1.26541422e-04 -2.26917959e-04] [ 4.28876670e-06 -6.40713172e-05 3.01065596e-05] [ 9.78943194e-06 -1.37623227e-04 -1.45673437e-04] [-1.79365449e-05 -1.27971113e-04 2.03277817e-04] [-2.59291772e-06 2.21134907e-04 -6.18745636e-05] [-2.67694966e-06 -2.20667129e-04 -5.68137336e-05] [ 2.61478272e-06 -2.21014801e-04 5.97651465e-05] [ 2.31224421e-06 2.21355042e-04 5.45327649e-05] [-7.83158819e-05 -4.56530283e-06 -4.38669591e-04] [-7.74414338e-05 4.76556649e-06 -4.34238834e-04] [ 7.84379769e-05 4.70637395e-06 4.35169301e-04] [ 7.77119223e-05 -4.65935166e-06 4.32018947e-04]] Final stress: [-6.17278809e-04 -1.18074342e-03 -5.48180131e-04 5.71043130e-09 4.67736216e-04 -3.79567528e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-1.59527680e-03 9.39846673e-05 -7.92955238e-04] [ 1.59494491e-03 -9.40294050e-05 -8.34288679e-04] [ 1.59485536e-03 -9.46760614e-05 7.26996159e-04] [-1.59489608e-03 9.43452508e-05 7.85471618e-04] [ 3.55064850e-07 -1.05406286e-06 6.29245992e-06] [-1.16169311e-07 -2.90917214e-09 6.81831753e-06] [-4.30580321e-07 7.20337894e-07 6.50596702e-06] [-6.28071537e-07 -8.21342711e-06 9.41891576e-06] [ 9.44324355e-06 5.17022067e-06 1.06629958e-05] [-8.36986096e-06 3.83396667e-06 9.82128650e-06] [-1.07864229e-02 -9.42822396e-04 1.85097797e-05] [ 3.29638280e-03 -4.82094416e-03 1.87068057e-05] [ 2.38770241e-03 6.30562114e-03 1.88013605e-05] [ 1.07862734e-02 9.36075796e-04 6.68567283e-07] [-3.29042054e-03 4.82451472e-03 7.09707179e-07] [-2.39332730e-03 -6.30242186e-03 5.94234000e-07] [ 8.04201897e-06 2.89598871e-04 -1.02880901e-03] [-8.02942834e-06 -2.89647150e-04 -1.03009647e-03] [-7.95703987e-06 -2.89527394e-04 1.03072180e-03] [ 7.87426847e-06 2.89505713e-04 1.03183042e-03] [ 5.73179074e-04 4.22861055e-05 5.44633802e-04] [-5.73115762e-04 -4.23268518e-05 5.43976674e-04] [-5.73281987e-04 -4.22603528e-05 -5.42900728e-04] [ 5.73219886e-04 4.22692465e-05 -5.42090757e-04]] Final stress: [ 4.82238455e-04 7.68196021e-04 3.50804502e-04 -9.53622349e-10 2.68740862e-09 3.90843697e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.22947632e-03 6.32661584e-05 -5.44734279e-04] [-1.22958084e-03 -6.31666999e-05 -6.61591188e-04] [-1.22966160e-03 -6.34228524e-05 5.54860916e-04] [ 1.22878610e-03 6.30996194e-05 6.53068107e-04] [-5.33946171e-07 -1.13520628e-05 -1.69947030e-06] [ 1.04366798e-05 6.33660656e-06 -1.97990639e-06] [-9.23777720e-06 5.02994286e-06 -1.25629872e-06] [-2.31345791e-08 -1.47172240e-05 1.87065422e-06] [ 1.31908172e-05 7.46999478e-06 1.86167919e-06] [-1.31091771e-05 7.39545592e-06 2.00054527e-06] [ 9.06693483e-03 -7.62192014e-04 1.89590397e-05] [-2.20879265e-03 5.42819304e-03 1.92441209e-05] [-2.82259662e-03 -4.33054545e-03 1.90387386e-05] [-9.06702418e-03 8.09388551e-04 -1.96082095e-05] [ 2.16831621e-03 -5.45145607e-03 -2.00180240e-05] [ 2.86376616e-03 4.30679624e-03 -1.95992901e-05] [ 1.17283176e-05 2.40071809e-04 -8.49644314e-04] [-1.18113877e-05 -2.40097660e-04 -8.51514998e-04] [-1.17842338e-05 -2.40047133e-04 8.48859384e-04] [ 1.18966994e-05 2.40097667e-04 8.52149477e-04] [-5.37025157e-04 3.72652160e-05 4.74058330e-04] [ 5.36705682e-04 -3.74020310e-05 4.73154762e-04] [ 5.36833061e-04 -3.73440585e-05 -4.74864859e-04] [-5.36890180e-04 3.73329545e-05 -4.72614916e-04]] Final stress: [ 4.70544940e-04 7.69766895e-04 3.34149355e-04 -2.64382512e-09 -5.47603652e-09 -3.94568574e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.67736282e-03 -2.07182135e-03 1.42021621e-03] [ 2.67779918e-03 2.07176179e-03 1.47128133e-03] [ 2.67767121e-03 2.07179263e-03 -1.41942896e-03] [-2.67762039e-03 -2.07208624e-03 -1.46816737e-03] [ 5.77645688e-08 4.07167246e-06 7.36584002e-07] [-2.71773865e-06 -1.94718285e-06 4.47258992e-07] [ 2.52832144e-06 -1.76685667e-06 2.41447503e-07] [ 3.90590964e-07 -4.25409830e-07 -3.28268989e-07] [-3.20092395e-07 -2.75620740e-07 -6.73542417e-07] [-4.57683359e-07 6.21375186e-07 -1.59351272e-07] [ 1.07421330e-02 2.96318305e-04 -9.63313326e-06] [-3.68486252e-03 8.38773588e-03 -9.50083694e-06] [-3.52356636e-03 -1.17179639e-02 -9.64840847e-06] [-1.07419437e-02 -3.06803987e-04 8.42839583e-06] [ 3.69416162e-03 -8.38259745e-03 8.34224717e-06] [ 3.51395485e-03 1.17234867e-02 8.42449265e-06] [-2.63095011e-03 1.25443790e-03 -1.41167939e-03] [ 2.63094639e-03 -1.25449164e-03 -1.41070409e-03] [ 2.63098326e-03 -1.25450196e-03 1.41175720e-03] [-2.63084667e-03 1.25453388e-03 1.41036755e-03] [-3.21205618e-04 -8.17574211e-04 9.63154239e-04] [ 3.21152897e-04 8.17499491e-04 9.63875811e-04] [ 3.21231165e-04 8.17548643e-04 -9.63285800e-04] [-3.21156574e-04 -8.17552402e-04 -9.64063619e-04]] Final stress: [-1.04171030e-03 -1.33031441e-03 -7.87948895e-04 -1.17601627e-09 -2.27879692e-09 5.31847425e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.55959762e-03 -2.11090535e-03 1.51796323e-03] [-2.55928716e-03 2.11101693e-03 1.54796369e-03] [-2.55912210e-03 2.11085413e-03 -1.50453764e-03] [ 2.55988210e-03 -2.11101158e-03 -1.53882260e-03] [ 3.93795468e-07 -1.10049649e-05 -2.99082611e-06] [ 9.18006600e-06 5.03796694e-06 -2.68563795e-06] [-1.00243083e-05 5.98128440e-06 -3.42699007e-06] [ 7.02908840e-07 1.55839405e-06 -1.73850677e-06] [-2.03421324e-06 -1.55902693e-06 -2.09140533e-06] [ 7.00915124e-07 2.52634317e-08 -1.30469603e-06] [-1.10249595e-02 3.52682714e-04 -7.17754266e-06] [ 3.49744224e-03 -1.15115695e-02 -7.06860624e-06] [ 3.73188630e-03 8.17818177e-03 -7.04045394e-06] [ 1.10252837e-02 -3.39840780e-04 4.52621383e-06] [-3.50889731e-03 1.15047761e-02 4.64096097e-06] [-3.72103549e-03 -8.18425608e-03 4.30582213e-06] [ 2.63459593e-03 1.25289957e-03 -1.48095569e-03] [-2.63441057e-03 -1.25293853e-03 -1.48001135e-03] [-2.63445064e-03 -1.25292928e-03 1.48057478e-03] [ 2.63456233e-03 1.25293478e-03 1.47999482e-03] [ 2.85885439e-04 -8.08365482e-04 8.52543664e-04] [-2.85855437e-04 8.08380907e-04 8.53268994e-04] [-2.85861768e-04 8.08376059e-04 -8.52843361e-04] [ 2.85825139e-04 -8.08325297e-04 -8.53086867e-04]] Final stress: [-1.04409749e-03 -1.33398449e-03 -7.83950708e-04 -4.37023092e-10 9.18992666e-10 -5.34004668e-04] Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.56292155e-08 1.22982157e-04 -3.05821898e-04] [ 2.32961701e-09 3.79376303e-04 2.14879101e-04] [-1.67408525e-08 -1.22949926e-04 3.05636669e-04] [ 4.39362319e-09 -3.79359620e-04 -2.14281088e-04] [ 9.84749717e-09 -1.88149539e-07 -1.25279801e-07] [ 1.83654659e-07 8.37580420e-08 -1.17775287e-07] [-2.03055921e-07 1.06262968e-07 -1.30159183e-07] [-3.21573341e-08 -3.44314568e-07 1.16167690e-07] [ 1.79479804e-07 1.83464993e-07 8.40656540e-08] [-1.11798429e-07 1.07358310e-07 3.66183939e-08] [-4.39681996e-09 2.97754395e-04 7.88726614e-04] [-2.63481198e-05 4.43603224e-04 3.61271687e-04] [ 2.63578398e-05 4.43592343e-04 3.61268008e-04] [ 9.19163079e-11 -2.97547400e-04 -7.88825697e-04] [ 2.61611834e-05 -4.43706965e-04 -3.61339495e-04] [-2.61595922e-05 -4.43707372e-04 -3.61344192e-04] [ 1.27383606e-09 5.18306310e-04 -1.40738531e-03] [-3.86324023e-09 6.69006743e-04 -1.39986573e-03] [ 1.26771671e-09 -5.18308977e-04 1.40736898e-03] [-3.78508228e-09 -6.68993385e-04 1.39986620e-03] [-1.20512350e-09 1.31422001e-03 -4.43235680e-04] [ 6.34096561e-11 -3.22946447e-04 -2.92305792e-04] [-6.50467408e-10 -1.31421747e-03 4.43229781e-04] [-4.30780300e-10 3.22947703e-04 2.92294217e-04]] Final stress: [ 5.23759741e-04 5.79628236e-04 1.21760185e-03 -5.17390890e-04 -2.83562161e-12 -2.02821538e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.18611421e-09 -3.79326025e-04 2.17332633e-04] [-7.37580823e-09 -1.22738967e-04 -3.08977531e-04] [ 7.52031431e-09 3.79323577e-04 -2.17737537e-04] [ 1.69166642e-09 1.22703638e-04 3.08123298e-04] [-1.14354275e-08 3.93028823e-07 1.77311239e-07] [-2.56240524e-07 -1.66758409e-07 1.34183977e-07] [ 2.79049140e-07 -1.92647372e-07 1.48998008e-07] [ 1.52815844e-08 -4.82633700e-07 1.44418241e-07] [ 4.14056313e-07 2.25837009e-07 1.38708938e-07] [-4.40147937e-07 2.58603216e-07 1.52175487e-07] [ 2.36896575e-09 2.94332576e-04 -7.96510898e-04] [-2.76319521e-05 4.38949989e-04 -3.72112259e-04] [ 2.76284072e-05 4.38955006e-04 -3.72105313e-04] [ 2.71432349e-09 -2.93668338e-04 7.96634868e-04] [ 2.70910058e-05 -4.39280756e-04 3.72225038e-04] [-2.70953323e-05 -4.39274864e-04 3.72212808e-04] [-1.55472413e-09 -6.65943963e-04 -1.39837314e-03] [ 1.25621996e-09 -5.14125774e-04 -1.40273895e-03] [-7.40251915e-10 6.65938597e-04 1.39837119e-03] [ 2.00389907e-09 5.14124464e-04 1.40275598e-03] [ 3.23985838e-11 3.24374968e-04 -2.84630390e-04] [-1.65906760e-10 -1.30649712e-03 -4.36653523e-04] [ 5.17934566e-10 -3.24376717e-04 2.84626475e-04] [ 2.25219732e-10 1.30649428e-03 4.36661452e-04]] Final stress: [ 5.24181304e-04 5.79948385e-04 1.21743953e-03 5.16875850e-04 -5.02103259e-11 2.35522318e-13] Minimization converged after 51 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.56341841e-04 4.15998116e-05 -2.82337926e-05] [ 1.56311319e-04 -4.15850749e-05 -2.99222954e-05] [-1.56304281e-04 -4.15933528e-05 2.67639878e-05] [-1.56317314e-04 4.15726339e-05 2.88321650e-05] [ 2.70269805e-08 4.44016585e-08 1.30665887e-07] [-3.09331160e-08 -4.38821487e-08 1.23956395e-07] [-1.02433992e-08 1.09602418e-08 1.09401905e-07] [ 1.17460421e-08 -2.61507320e-08 2.32481999e-07] [ 5.85465887e-09 -6.41210574e-09 2.09713760e-07] [-4.36767826e-08 2.92459550e-08 2.45000900e-07] [ 2.92624852e-09 -7.38078362e-05 5.50317042e-07] [ 4.44453590e-05 -8.25742017e-05 -1.42662293e-04] [-4.44406323e-05 -8.25732440e-05 1.43786432e-04] [ 4.64180683e-09 7.42592267e-05 -1.00782446e-07] [-4.48431436e-05 8.23412691e-05 1.43079024e-04] [ 4.48291592e-05 8.23545801e-05 -1.43322901e-04] [ 4.50874011e-04 3.92703399e-04 -1.04234606e-03] [ 4.50876196e-04 -3.92703845e-04 -1.04237532e-03] [-4.50871116e-04 -3.92706328e-04 1.04237322e-03] [-4.50871946e-04 3.92703826e-04 1.04243137e-03] [ 1.90302608e-04 -5.78618748e-04 6.38840409e-05] [ 1.90301546e-04 5.78619528e-04 6.38392547e-05] [-1.90298926e-04 5.78620403e-04 -6.38231584e-05] [-1.90302022e-04 -5.78620209e-04 -6.38044334e-05]] Final stress: [ 5.98892033e-04 5.59061632e-04 1.20102320e-03 7.18202760e-11 -4.79596698e-04 -7.85052568e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.59801478e-04 4.39703358e-05 -2.96064888e-05] [-1.59799684e-04 -4.39774504e-05 -3.11471390e-05] [ 1.59852741e-04 -4.40095936e-05 2.87157416e-05] [ 1.59834309e-04 4.39621092e-05 3.01285874e-05] [ 3.82615581e-08 7.76545100e-07 3.03446766e-07] [-6.44795977e-07 -4.21741234e-07 3.05516154e-07] [ 5.64722161e-07 -3.31561992e-07 2.46138932e-07] [ 2.44412955e-08 2.66102956e-07 2.15210543e-08] [-1.97269438e-07 -1.49603336e-07 3.35480924e-08] [ 1.32859671e-07 -8.40864416e-08 8.82052207e-08] [ 1.13613586e-08 -7.46192202e-05 3.81783268e-07] [ 4.57898024e-05 -8.44851419e-05 1.43910443e-04] [-4.58254210e-05 -8.44517114e-05 -1.43089336e-04] [ 7.67343855e-10 7.33105066e-05 -1.22277189e-07] [-4.46459635e-05 8.51282327e-05 -1.43641592e-04] [ 4.46416835e-05 8.51316768e-05 1.43379387e-04] [-4.54017810e-04 3.98752479e-04 -1.05014649e-03] [-4.54017866e-04 -3.98757085e-04 -1.05020376e-03] [ 4.54024431e-04 -3.98758279e-04 1.05019281e-03] [ 4.54026614e-04 3.98750951e-04 1.05020420e-03] [-1.94275070e-04 -5.83130857e-04 6.09879173e-05] [-1.94279085e-04 5.83129610e-04 6.09493304e-05] [ 1.94281380e-04 5.83128705e-04 -6.09514324e-05] [ 1.94281066e-04 -5.83130922e-04 -6.09400656e-05]] Final stress: [5.98535273e-04 5.58643315e-04 1.20138138e-03 9.14893723e-11 4.80244564e-04 9.94686205e-12] Minimization converged after 42 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.45227224e-03 -2.64457617e-03 2.42294691e-04] [ 2.45247000e-03 2.64453824e-03 2.52081285e-04] [ 2.45244279e-03 2.64420218e-03 -2.32211575e-04] [-2.45219187e-03 -2.64405926e-03 -2.80091279e-04] [ 4.63500179e-08 3.78306548e-05 9.15010911e-06] [-3.35820604e-05 -1.91464381e-05 9.78476672e-06] [ 3.35496923e-05 -1.90756044e-05 9.23666146e-06] [ 3.62896863e-07 2.62999305e-06 -2.19319460e-06] [-1.99758937e-06 -1.56703946e-06 -2.03511984e-06] [ 1.32369901e-06 -7.52759729e-07 -1.61218474e-06] [ 8.46395864e-03 -4.53911338e-04 -5.69974157e-06] [-4.25070865e-03 1.07455240e-02 -5.59028682e-06] [-5.25837496e-03 -1.33020095e-02 -5.66074828e-06] [-8.46364690e-03 4.47638171e-04 4.56726436e-06] [ 4.25588521e-03 -1.07426861e-02 4.96767503e-06] [ 5.25275129e-03 1.33054257e-02 4.73717968e-06] [-9.80375325e-05 -2.58289860e-05 -5.52408835e-04] [ 9.80848280e-05 2.58101793e-05 -5.51853644e-04] [ 9.81505779e-05 2.58913195e-05 5.52323325e-04] [-9.79978530e-05 -2.58657054e-05 5.51504080e-04] [ 1.39009081e-04 -2.25047342e-05 2.51593132e-03] [-1.39168688e-04 2.24818734e-05 2.51584019e-03] [-1.38966481e-04 2.24893992e-05 -2.51605937e-03] [ 1.38909760e-04 -2.24781558e-05 -2.51700258e-03]] Final stress: [ 2.91630140e-04 4.01980153e-04 8.59852307e-04 -5.82754294e-10 -2.42110220e-09 4.04782274e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 83 steps. Final forces: [[ 3.56317063e-03 5.89661407e-03 -1.48994245e-02] [-7.35972215e-04 3.03698287e-03 2.13865779e-02] [ 6.86972423e-03 4.35624107e-03 5.81981584e-03] [ 4.35439828e-03 5.60086608e-03 2.30681936e-03] [-4.78836699e-03 1.40996777e-02 1.08156922e-02] [-3.59035606e-02 -5.91890975e-03 1.23514358e-02] [ 4.07629028e-02 -1.40703868e-02 5.61640758e-03] [ 6.53716864e-03 3.16607010e-02 -1.50924127e-02] [-3.76831082e-02 -2.21300860e-02 -3.43768087e-03] [ 3.08459044e-02 -1.12908843e-02 -2.01303545e-02] [ 2.47028134e-02 2.10976881e-02 4.99330477e-05] [-1.25942266e-02 -1.98800084e-02 -1.85976018e-02] [-1.02213463e-02 9.47008413e-03 -1.06810714e-04] [ 2.73443370e-02 2.15340174e-02 1.88413340e-02] [-1.52963820e-02 -2.40943177e-02 -6.45808656e-03] [-1.09915012e-02 7.22990370e-03 2.62015058e-03] [ 1.83816808e-02 -2.31667861e-03 4.92378448e-04] [-8.55612367e-03 1.93007606e-03 2.14759202e-03] [ 1.27751851e-02 5.65596941e-03 -1.03849289e-03] [-1.37790501e-02 4.84123888e-03 -2.13609732e-03] [ 4.24958719e-03 -8.71756901e-03 2.50741573e-04] [-7.43297802e-03 -1.09812023e-02 -1.93811620e-03] [-5.57881731e-03 -1.13901298e-02 -2.86415067e-03] [-1.68254392e-02 -5.61988790e-03 4.00035032e-03]] Final stress: [ 3.65143369e-02 3.64788108e-02 1.45288688e-01 2.50933974e-07 -7.44772087e-06 -7.76340329e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-4.51378144e-03 1.76854860e-03 3.39787794e-03] [ 4.51377383e-03 -1.76827586e-03 3.26555939e-03] [ 4.51407818e-03 -1.76846276e-03 -3.30822159e-03] [-4.51459069e-03 1.76852900e-03 -3.52150725e-03] [-2.53450681e-07 9.79492890e-05 4.07339853e-05] [-8.43312085e-05 -4.84652290e-05 4.02438659e-05] [ 8.60451524e-05 -4.97419074e-05 4.09094697e-05] [ 3.28874030e-07 -2.14257720e-05 -1.55238795e-06] [ 1.81433890e-05 1.03667745e-05 -1.82625602e-06] [-1.85368341e-05 1.09780151e-05 -1.78009082e-06] [ 3.84573202e-02 -5.78116188e-04 6.13456629e-07] [-1.13308099e-02 1.65182229e-02 6.60609954e-07] [-1.32016073e-02 -3.76564764e-02 6.65037415e-07] [-3.84601194e-02 8.74103480e-04 1.52509600e-05] [ 1.10758926e-02 -1.66634169e-02 1.51246279e-05] [ 1.34597925e-02 3.75065770e-02 1.54162476e-05] [ 1.77349669e-03 9.16873301e-03 -7.33072853e-03] [-1.77404561e-03 -9.16932973e-03 -7.32525968e-03] [-1.77388153e-03 -9.16933036e-03 7.32745122e-03] [ 1.77346773e-03 9.16878370e-03 7.33094815e-03] [-1.97644944e-03 -6.86389844e-04 -2.31357848e-03] [ 1.97619360e-03 6.86501278e-04 -2.31236024e-03] [ 1.97664362e-03 6.86537521e-04 2.31266203e-03] [-1.97676958e-03 -6.86399559e-04 2.31269751e-03]] Final stress: [-1.52458802e-03 -4.80297427e-04 -1.19864792e-03 7.52085263e-10 -2.48593197e-09 4.37425326e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 4.10896459e-03 1.77296511e-03 3.62345585e-03] [-4.10936583e-03 -1.77316653e-03 3.58513808e-03] [-4.10933502e-03 -1.77305342e-03 -3.58448341e-03] [ 4.10871757e-03 1.77294894e-03 -3.59196749e-03] [-6.31505877e-07 -7.94705911e-05 -1.59234242e-05] [ 6.95586097e-05 4.05663679e-05 -1.57936568e-05] [-6.81081573e-05 3.89987400e-05 -1.54424049e-05] [-3.09243764e-07 -3.96933614e-05 5.97683421e-06] [ 3.47095928e-05 2.02231228e-05 5.85101340e-06] [-3.41021885e-05 1.95132889e-05 5.75548499e-06] [-3.80458750e-02 -4.69681365e-04 2.21453705e-06] [ 1.27672788e-02 -3.60506599e-02 2.20220891e-06] [ 1.13636608e-02 1.53040200e-02 2.13946597e-06] [ 3.80483887e-02 6.68085454e-04 -3.37121666e-06] [-1.29404180e-02 3.59499776e-02 -3.42404666e-06] [-1.11929728e-02 -1.54011234e-02 -3.34598865e-06] [-1.18109474e-03 8.95928163e-03 -7.55073297e-03] [ 1.18147095e-03 -8.95958723e-03 -7.54778121e-03] [ 1.18150363e-03 -8.95957461e-03 7.54740190e-03] [-1.18107915e-03 8.95925256e-03 7.55110543e-03] [ 1.58924522e-03 -8.00424466e-04 -2.39892265e-03] [-1.58974940e-03 8.00516981e-04 -2.39661916e-03] [-1.58957169e-03 8.00513180e-04 2.39690568e-03] [ 1.58911434e-03 -8.00428144e-04 2.39966114e-03]] Final stress: [-1.51267102e-03 -4.99035115e-04 -1.18321051e-03 -3.37529053e-10 -8.54572271e-10 -4.51063101e-04] Minimization converged after 46 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[ 6.34871398e-05 -6.04834336e-03 -3.70142413e-02] [-4.96725512e-04 2.59068299e-03 -1.57970625e-03] [-2.11578542e-04 5.84483474e-03 -4.09187942e-02] [ 8.70717927e-04 -2.55911197e-03 -4.10671681e-03] [-1.25113507e-05 2.67395320e-02 6.31245242e-03] [-2.30608842e-02 -1.33776035e-02 5.87775964e-03] [ 2.28615562e-02 -1.32786254e-02 6.03136977e-03] [ 2.71068587e-04 -3.94703587e-02 1.42565365e-02] [ 3.41285217e-02 1.95396742e-02 1.42704109e-02] [-3.42141794e-02 1.99052144e-02 1.42858372e-02] [-2.75598071e-02 -2.78841786e-02 3.18003309e-03] [ 3.85058880e-02 5.00752894e-03 5.61818937e-03] [-1.65099281e-02 4.24399410e-02 2.49530680e-03] [ 2.74059529e-02 -3.80641580e-02 4.14139608e-03] [ 1.87065123e-02 2.81227517e-02 1.96432237e-03] [-4.06059767e-02 -9.48589271e-03 4.74739937e-03] [-3.42922692e-05 -1.14900990e-03 -6.14073984e-03] [ 1.52463907e-04 2.70670975e-03 -2.15116132e-03] [-1.42484451e-05 1.25836088e-03 7.66731796e-03] [-2.33100702e-04 -2.78557864e-03 1.64080859e-03] [ 5.17608246e-04 4.90411199e-03 -9.99360417e-04] [-3.88909540e-04 -2.34125839e-03 -2.08122801e-03] [-7.85873530e-04 -4.99602581e-03 9.13547794e-04] [ 6.44238453e-04 2.38080226e-03 1.58926018e-03]] Final stress: [-1.53974843e-04 -4.74715216e-04 2.50511937e-05 -6.39698183e-04 -5.38024429e-04 6.56539810e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 41 steps. Final forces: [[ 1.86358502e-02 -2.44213474e-02 -1.85023554e-01] [ 4.97009242e-02 -2.85159975e-02 -2.64804300e-01] [-1.64817251e-02 3.22715289e-02 -2.81788179e-01] [-4.48144646e-02 1.62832260e-02 -3.32407708e-01] [ 1.41646432e-03 3.02055887e-01 1.16616184e-01] [-2.53124423e-01 -1.48600660e-01 1.03787308e-01] [ 2.51238735e-01 -1.45462282e-01 1.05874023e-01] [-5.54391290e-04 -5.12954145e-01 1.57889765e-01] [ 4.35134926e-01 2.53304113e-01 1.39004558e-01] [-4.38728995e-01 2.54846942e-01 1.37388079e-01] [ 1.34407605e-01 2.59807222e-01 1.00122500e-01] [-2.80815384e-01 1.06593298e-01 7.87598532e-02] [ 1.26426502e-01 -1.27650523e-01 -2.20217520e-02] [-1.38068659e-01 1.52508564e-01 1.01823275e-02] [-6.95662904e-02 -3.13925550e-01 1.91419019e-02] [ 2.27101431e-01 -7.63694840e-02 1.08826505e-01] [ 4.38240567e-02 -3.87420487e-02 -3.64449267e-02] [-6.90692754e-03 -1.92654338e-04 1.59998648e-02] [-4.53688600e-02 3.99442448e-02 3.82250511e-02] [ 5.22315999e-03 -2.02445358e-04 -4.28740250e-03] [-3.91227397e-02 -5.18296693e-03 -4.18137429e-02] [ 1.82251788e-02 7.03398231e-03 -4.64486582e-02] [ 4.16729437e-02 5.78642981e-03 3.43987071e-02] [-1.94549168e-02 -8.21533261e-03 4.88235961e-02]] Final stress: [ 0.0026354 -0.00057564 0.00107105 -0.00092945 0.00081645 -0.00059069] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 41 steps. Final forces: [[-1.00591750e-02 -3.27670029e-03 -1.15821206e-02] [-9.10232774e-03 1.60125900e-02 -2.66486939e-03] [ 1.00218334e-02 3.38926801e-03 -8.84600060e-03] [ 9.04000255e-03 -1.60152981e-02 -1.07630666e-02] [ 3.91753192e-05 5.82578827e-03 2.49426365e-03] [-5.05814767e-03 -2.93315374e-03 2.46558702e-03] [ 5.05398508e-03 -2.88587150e-03 2.46049676e-03] [-9.71840140e-05 -1.55475979e-02 5.14963444e-03] [ 1.33881225e-02 7.81173489e-03 5.01236352e-03] [-1.33091688e-02 7.65150436e-03 4.84190991e-03] [ 3.07398426e-02 9.67341419e-03 3.98640567e-03] [-1.36416408e-02 3.28651433e-02 5.92180770e-04] [-1.40560154e-02 -1.52189063e-02 9.56212745e-03] [-3.08290378e-02 -5.90233063e-03 -3.36850494e-04] [ 1.04495923e-02 -3.46908310e-02 2.96337661e-03] [ 1.74270168e-02 1.32068522e-02 -5.95575646e-03] [ 9.34772834e-04 -4.28233667e-03 -1.11274132e-04] [-2.59543440e-03 4.47846334e-03 -7.43853043e-03] [-9.29588886e-04 4.29818044e-03 3.10983114e-04] [ 2.54964574e-03 -4.48096510e-03 7.80034659e-03] [ 7.83840366e-04 2.80900816e-03 -2.58776675e-03] [ 2.51906789e-03 -7.19133823e-03 -1.08831397e-03] [-7.13838105e-04 -2.79655046e-03 2.47658061e-03] [-2.55533887e-03 7.19993272e-03 1.25829332e-03]] Final stress: [ 4.04405653e-05 -5.39329097e-04 5.25218751e-05 3.80157306e-04 -3.36157578e-04 -8.08343483e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 42 steps. Final forces: [[ 7.59979136e-03 -2.77167419e-02 -1.64634820e-03] [ 6.61117159e-04 2.88147580e-02 1.40220261e-04] [-7.67947631e-03 2.79107494e-02 -8.45970584e-03] [-8.38570255e-04 -2.90592699e-02 -2.55005211e-02] [-2.10773369e-04 7.12724422e-03 3.94708413e-03] [-5.70496717e-03 -3.22819346e-03 3.45218675e-03] [ 6.06537319e-03 -3.68700050e-03 3.71597709e-03] [ 7.10616750e-05 -1.30977371e-02 4.00026995e-03] [ 1.10957611e-02 6.41195416e-03 3.63381546e-03] [-1.11543306e-02 6.53345762e-03 3.66287252e-03] [-6.86410727e-02 4.03950870e-02 -4.95093358e-03] [ 1.85557137e-02 -3.48741545e-02 3.94498284e-03] [ 4.88013938e-02 8.59234528e-02 2.02134972e-03] [ 6.86838000e-02 -1.58235976e-02 9.16799489e-03] [-3.97492369e-02 2.26037702e-02 2.97081982e-05] [-2.76009087e-02 -9.82948750e-02 1.92997685e-03] [ 5.79652827e-03 2.68826785e-03 -7.72445654e-03] [ 2.17831890e-02 2.93143626e-02 -2.98921964e-02] [-5.81522198e-03 -2.67658087e-03 7.66759751e-03] [-2.16623522e-02 -2.92772756e-02 3.06769624e-02] [ 1.68386471e-02 2.33863138e-02 -6.55146495e-03] [ 3.71778512e-03 5.62407788e-04 -5.73226225e-03] [-1.69229706e-02 -2.34012143e-02 6.42364843e-03] [-3.69028085e-03 -5.35184699e-04 6.04324194e-03]] Final stress: [ 7.25762122e-04 -1.25375893e-03 4.43300240e-04 3.53294262e-04 1.86164423e-04 7.36592144e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-3.76270103e-03 8.03108789e-03 -1.20914931e-03] [-9.57153453e-05 -6.94143913e-03 -1.49072898e-03] [ 3.76270751e-03 -8.03109715e-03 1.20543522e-03] [ 9.57184964e-05 6.94144895e-03 1.49359926e-03] [ 6.87721632e-09 -1.55148319e-06 -5.51374015e-07] [ 1.32948312e-06 7.66538150e-07 -5.38062099e-07] [-1.34057806e-06 7.80902191e-07 -5.38216286e-07] [ 1.06250933e-08 -2.21880628e-06 7.35396909e-07] [ 1.92105416e-06 1.09896511e-06 7.55575277e-07] [-1.93871212e-06 1.12145497e-06 7.61138914e-07] [-1.39585884e-02 -2.37324235e-03 -4.98592929e-03] [ 6.50167160e-03 -4.49508181e-03 1.48218608e-03] [-1.05815336e-03 1.35820953e-02 2.93128790e-03] [ 1.39586011e-02 2.37038217e-03 4.98600103e-03] [-6.49920676e-03 4.49650027e-03 -1.48211212e-03] [ 1.05567120e-03 -1.35806546e-02 -2.93121500e-03] [ 1.84734754e-03 9.01623693e-04 -3.63322420e-04] [-1.39122850e-03 7.10889153e-04 -2.62578648e-05] [-1.84734598e-03 -9.01618497e-04 3.63369977e-04] [ 1.39123002e-03 -7.10894163e-04 2.62180081e-05] [ 6.70463230e-05 -3.33027245e-03 -6.45089976e-04] [ 1.62751404e-04 -4.45843789e-03 -5.29767250e-04] [-6.70442662e-05 3.33027200e-03 6.45054405e-04] [-1.62750231e-04 4.45844115e-03 5.29795878e-04]] Final stress: [-5.55946359e-06 -1.82455804e-05 8.57802143e-05 -3.35874666e-04 6.25153703e-05 4.00249576e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 4.26838828e-03 7.94466075e-03 -1.67268293e-03] [ 4.32655545e-04 -6.81257045e-03 -1.18939336e-03] [-4.26839154e-03 -7.94466503e-03 1.67078587e-03] [-4.32656339e-04 6.81257348e-03 1.19016893e-03] [-1.29790465e-09 -3.18418711e-07 -1.26729655e-07] [ 2.74914862e-07 1.60102027e-07 -1.23718618e-07] [-2.72705073e-07 1.57303790e-07 -1.23764429e-07] [-5.85937549e-09 -1.21504134e-06 3.92956532e-07] [ 1.06140423e-06 6.14043308e-07 4.06835346e-07] [-1.05173257e-06 6.01668830e-07 4.03820902e-07] [ 1.42926453e-02 -2.80276833e-03 -5.21333110e-03] [ 9.82715177e-04 1.38630524e-02 3.23676675e-03] [-6.44152127e-03 -4.55736043e-03 9.80804798e-04] [-1.42926503e-02 2.80161445e-03 5.21342794e-03] [-9.81712366e-04 -1.38624707e-02 -3.23667024e-03] [ 6.44052541e-03 4.55793333e-03 -9.80707317e-04] [-1.87636376e-03 9.25129823e-04 -3.74375115e-04] [ 1.46187345e-03 7.46703815e-04 -1.35031005e-05] [ 1.87636301e-03 -9.25127946e-04 3.74397973e-04] [-1.46187398e-03 -7.46706110e-04 1.34906353e-05] [-3.41571333e-05 -3.40793539e-03 -6.79589427e-04] [-1.67079213e-04 -4.58950142e-03 -5.44575768e-04] [ 3.41559192e-05 3.40793552e-03 6.79571744e-04] [ 1.67079151e-04 4.58950252e-03 5.44584308e-04]] Final stress: [-6.48395625e-06 -1.90605256e-05 8.72395211e-05 -3.35857878e-04 -5.99105342e-05 -3.96381091e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 2.33996189e-04 6.78035124e-03 -2.66659243e-03] [ 3.90603031e-03 -7.84237820e-03 -5.39803516e-04] [-2.33995788e-04 -6.78035456e-03 2.66667302e-03] [-3.90603481e-03 7.84238624e-03 5.37061302e-04] [-6.61764892e-09 1.45021835e-06 5.05246375e-07] [-1.25656760e-06 -7.18861633e-07 5.19347377e-07] [ 1.26778660e-06 -7.32992199e-07 5.22884599e-07] [ 3.93962784e-09 -6.83998127e-07 1.42788121e-07] [ 5.87522526e-07 3.37967648e-07 1.38751374e-07] [-5.93104519e-07 3.45711532e-07 1.39318987e-07] [-1.37028944e-02 -2.46584018e-03 4.39936766e-03] [ 6.30626630e-03 -4.34828283e-03 -1.48613741e-03] [-1.04237322e-03 1.33420592e-02 -3.34528814e-03] [ 1.37028831e-02 2.46811018e-03 -4.39913729e-03] [-6.30822605e-03 4.34715681e-03 1.48636822e-03] [ 1.04434786e-03 -1.33432066e-02 3.34551710e-03] [ 1.38615297e-03 -7.24980734e-04 -5.24255104e-05] [-1.77789010e-03 -9.10147818e-04 -3.30623383e-04] [-1.38615413e-03 7.24984796e-04 5.24028664e-05] [ 1.77788841e-03 9.10144845e-04 3.30670850e-04] [-1.43795469e-04 4.34276206e-03 -5.25483647e-04] [-4.23355007e-05 3.21703489e-03 -6.06946619e-04] [ 1.43797145e-04 -4.34276363e-03 5.25470436e-04] [ 4.23342473e-05 -3.21703379e-03 6.06938143e-04]] Final stress: [-5.62443078e-06 -1.74038126e-05 8.61340114e-05 3.45393511e-04 -5.94109063e-05 4.01867546e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-3.47674662e-04 6.90884546e-03 -1.76377863e-03] [-4.29978769e-03 -8.09466266e-03 -1.63756835e-03] [ 3.47676055e-04 -6.90885405e-03 1.76548112e-03] [ 4.29979648e-03 8.09467595e-03 1.63241351e-03] [ 1.43369748e-08 3.02798905e-06 1.01090833e-06] [-2.64606437e-06 -1.53040328e-06 1.04692545e-06] [ 2.62198598e-06 -1.49989675e-06 1.03928386e-06] [ 3.12483877e-10 2.62950341e-07 -1.83801857e-07] [-2.25293683e-07 -1.31009553e-07 -1.79360438e-07] [ 2.24110569e-07 -1.29929687e-07 -1.79869614e-07] [ 1.42865385e-02 -2.67708477e-03 5.01613146e-03] [ 1.16729944e-03 1.38990032e-02 -3.29878746e-03] [-6.64446029e-03 -4.52092154e-03 -1.05157244e-03] [-1.42865210e-02 2.68084109e-03 -5.01583329e-03] [-1.17056430e-03 -1.39008988e-02 3.29908419e-03] [ 6.64770157e-03 4.51905781e-03 1.05187206e-03] [-1.43449615e-03 -7.86478488e-04 -2.08345158e-05] [ 1.82646784e-03 -9.57909831e-04 -3.66609561e-04] [ 1.43449803e-03 7.86485503e-04 2.07928212e-05] [-1.82646530e-03 9.57904040e-04 3.66683285e-04] [ 1.46106555e-04 4.57066268e-03 -5.56088202e-04] [ 2.00205320e-05 3.40823043e-03 -6.84390329e-04] [-1.46107439e-04 -4.57066595e-03 5.56095454e-04] [-2.00176368e-05 -3.40822971e-03 6.84354789e-04]] Final stress: [-6.65048144e-06 -1.97979091e-05 8.88853327e-05 3.42310071e-04 5.95436769e-05 -3.97296299e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-5.21641105e-04 -1.15090329e-03 -4.74444836e-04] [-5.21639201e-04 1.15090245e-03 -4.74142083e-04] [ 5.21641975e-04 1.15090234e-03 4.74031247e-04] [ 5.21639025e-04 -1.15090361e-03 4.73904481e-04] [-2.70347611e-10 2.65539783e-07 6.46016524e-08] [-2.29303807e-07 -1.32609306e-07 6.16480618e-08] [ 2.29481966e-07 -1.33000035e-07 6.50108331e-08] [-5.75410728e-10 -5.59876369e-07 1.38841793e-07] [ 4.88475333e-07 2.81679701e-07 1.42888387e-07] [-4.87919032e-07 2.80719164e-07 1.35334574e-07] [ 1.19945415e-09 2.17951231e-03 -2.70603314e-08] [-6.26916332e-04 2.38710228e-03 -3.51811444e-04] [ 6.26912336e-04 2.38710594e-03 3.51757056e-04] [ 8.57881544e-11 -2.17935457e-03 5.04507568e-08] [ 6.26778983e-04 -2.38718221e-03 3.51833537e-04] [-6.26777137e-04 -2.38718312e-03 -3.51734248e-04] [ 6.20334667e-04 -7.13702486e-04 9.72364763e-04] [ 6.20334770e-04 7.13702681e-04 9.72372167e-04] [-6.20335184e-04 7.13702422e-04 -9.72368469e-04] [-6.20334412e-04 -7.13702519e-04 -9.72371012e-04] [-2.19156287e-03 -1.20945345e-03 5.60832264e-04] [-2.19156362e-03 1.20945305e-03 5.60840464e-04] [ 2.19156353e-03 1.20945164e-03 -5.60848380e-04] [ 2.19156340e-03 -1.20945233e-03 -5.60847223e-04]] Final stress: [ 1.50567701e-04 -1.37537439e-04 6.92434601e-05 7.03709751e-12 -1.11399068e-03 1.82384473e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 5.22263408e-04 -1.15059402e-03 -4.74073405e-04] [ 5.22253982e-04 1.15059248e-03 -4.73293636e-04] [-5.22264877e-04 1.15059361e-03 4.74095264e-04] [-5.22254584e-04 -1.15059294e-03 4.73161664e-04] [-2.20560510e-10 1.58611946e-07 4.07224625e-08] [-1.36398389e-07 -7.90017544e-08 4.07618850e-08] [ 1.37024630e-07 -7.96278604e-08 3.91647159e-08] [-1.00297121e-09 -2.51816457e-08 -3.82710530e-11] [ 2.45304457e-08 1.41205224e-08 1.23640731e-09] [-2.23501761e-08 1.17146681e-08 -7.45770667e-11] [-2.90376623e-09 2.17658515e-03 -1.53849158e-07] [-6.27911710e-04 2.38345539e-03 3.53201277e-04] [ 6.27924830e-04 2.38344461e-03 -3.53510248e-04] [ 1.96239508e-09 -2.17657639e-03 1.52865825e-07] [ 6.27905733e-04 -2.38345852e-03 -3.53202504e-04] [-6.27916753e-04 -2.38345005e-03 3.53508936e-04] [-6.17464756e-04 -7.13786994e-04 9.68311397e-04] [-6.17463510e-04 7.13787286e-04 9.68331289e-04] [ 6.17464690e-04 7.13786867e-04 -9.68312313e-04] [ 6.17463239e-04 -7.13787397e-04 -9.68332094e-04] [ 2.19060782e-03 -1.20874405e-03 5.61901960e-04] [ 2.19060910e-03 1.20874467e-03 5.61914486e-04] [-2.19060799e-03 1.20874389e-03 -5.61903637e-04] [-2.19060926e-03 -1.20874423e-03 -5.61919226e-04]] Final stress: [ 1.50488152e-04 -1.37290673e-04 6.94293206e-05 1.70199566e-11 1.11361336e-03 -7.30771210e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.82085022e-04 1.38650470e-05 1.93208634e-05] [-1.11324579e-03 -2.12262298e-03 9.52071731e-04] [ 1.82083233e-04 -1.38652437e-05 -2.05386131e-05] [ 1.11324520e-03 2.12262322e-03 -9.52337093e-04] [-2.06778892e-09 3.07048380e-07 8.56648443e-08] [-2.64761344e-07 -1.51596463e-07 8.43790171e-08] [ 2.67871625e-07 -1.55782599e-07 8.75265771e-08] [ 2.62234452e-09 -8.86933436e-07 2.80566449e-07] [ 7.67284024e-07 4.41438799e-07 2.84430256e-07] [-7.70249101e-07 4.46191413e-07 2.76129468e-07] [ 4.70701584e-03 -3.41110484e-04 8.00657875e-04] [-5.16986222e-03 6.24241456e-03 5.40139999e-04] [-2.74053607e-03 -4.52134132e-03 -5.02286521e-04] [-4.70701483e-03 3.40740400e-04 -8.00530210e-04] [ 5.17018327e-03 -6.24222990e-03 -5.40011569e-04] [ 2.74021618e-03 4.52152669e-03 5.02413511e-04] [ 1.46014577e-03 7.68927996e-05 -2.99451286e-04] [-4.94024802e-04 1.05789681e-04 -3.34110548e-04] [-1.46014524e-03 -7.68928598e-05 2.99463814e-04] [ 4.94023594e-04 -1.05789656e-04 3.34111647e-04] [-2.55591256e-03 -1.40280517e-04 -4.18014432e-04] [-2.67702514e-03 1.96987363e-04 -2.33745425e-05] [ 2.55591282e-03 1.40280081e-04 4.18002979e-04] [ 2.67702507e-03 -1.96987245e-04 2.33736989e-05]] Final stress: [ 1.91106424e-05 -2.21158000e-05 5.57641860e-05 4.78239761e-05 -4.41149742e-04 4.51860043e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.11049974e-03 2.12053815e-03 9.49175366e-04] [-1.83228343e-04 -2.20741191e-05 1.84450043e-05] [ 1.11049827e-03 -2.12053840e-03 -9.49555056e-04] [ 1.83227151e-04 2.20743486e-05 -1.95352357e-05] [ 2.70322842e-09 8.70700883e-07 2.67486279e-07] [-7.56279705e-07 -4.38161444e-07 2.63286409e-07] [ 7.53103125e-07 -4.33215689e-07 2.71129048e-07] [-2.08956551e-09 -3.13470419e-07 9.55793170e-08] [ 2.73516307e-07 1.59069371e-07 9.76148469e-08] [-2.70189096e-07 1.54743218e-07 9.41386460e-08] [-4.69319874e-03 -3.37007360e-04 -7.95869847e-04] [ 2.73561133e-03 -4.50556915e-03 4.98898195e-04] [ 5.15184967e-03 6.22624630e-03 -5.38380773e-04] [ 4.69319848e-03 3.37129414e-04 7.95996310e-04] [-2.73571555e-03 4.50550898e-03 -4.98772180e-04] [-5.15174269e-03 -6.22630814e-03 5.38507745e-04] [-4.90675270e-04 -1.05166706e-04 -3.33680197e-04] [ 1.45563582e-03 -7.69402452e-05 -2.98733561e-04] [ 4.90674340e-04 1.05166664e-04 3.33685047e-04] [-1.45563579e-03 7.69402735e-05 2.98742183e-04] [-2.67008430e-03 -1.97088752e-04 -2.30212638e-05] [-2.54731567e-03 1.40459729e-04 -4.16189650e-04] [ 2.67008400e-03 1.97088629e-04 2.30214814e-05] [ 2.54731625e-03 -1.40459275e-04 4.16177196e-04]] Final stress: [ 1.91398067e-05 -2.20678116e-05 5.57470121e-05 -4.77658237e-05 -4.41181097e-04 -4.52050056e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 1.11018201e-03 2.11971589e-03 9.47770106e-04] [ 1.83382190e-04 -2.47186113e-05 1.88580330e-05] [-1.11017882e-03 -2.11971635e-03 -9.48502626e-04] [-1.83382931e-04 2.47185701e-05 -1.84238210e-05] [ 8.58475385e-10 -2.82975388e-07 -9.24305713e-08] [ 2.44779781e-07 1.40817673e-07 -9.36647312e-08] [-2.45765333e-07 1.42381173e-07 -9.10079749e-08] [ 3.42268831e-09 -5.20293769e-07 1.65282906e-07] [ 4.48500345e-07 2.56874186e-07 1.62879004e-07] [-4.54065126e-07 2.64027998e-07 1.68750450e-07] [ 4.69070729e-03 -3.35942593e-04 -7.94075982e-04] [-5.14761610e-03 6.22332331e-03 -5.38799789e-04] [-2.73582426e-03 -4.50242089e-03 4.97676306e-04] [-4.69070613e-03 3.35604675e-04 7.94101967e-04] [ 5.14790764e-03 -6.22315580e-03 5.38825213e-04] [ 2.73553042e-03 4.50259137e-03 -4.97649761e-04] [ 4.90115009e-04 -1.05144799e-04 -3.33600982e-04] [-1.45488549e-03 -7.70409865e-05 -2.98600290e-04] [-4.90115496e-04 1.05144783e-04 3.33607544e-04] [ 1.45488632e-03 7.70409578e-05 2.98596603e-04] [ 2.66887290e-03 -1.97203855e-04 -2.29726846e-05] [ 2.54580967e-03 1.40493140e-04 -4.15853640e-04] [-2.66887218e-03 1.97203621e-04 2.29632298e-05] [-2.54580979e-03 -1.40493271e-04 4.15860766e-04]] Final stress: [ 1.91446886e-05 -2.20602855e-05 5.57461310e-05 -4.77667184e-05 4.41181783e-04 4.52082168e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 1.82961169e-04 2.17400153e-05 1.87930629e-05] [ 1.11130743e-03 -2.11971652e-03 9.49077559e-04] [-1.82960994e-04 -2.17400514e-05 -1.89435270e-05] [-1.11130652e-03 2.11971666e-03 -9.49303235e-04] [ 1.16639358e-09 1.76922139e-07 5.46499914e-08] [-1.54391129e-07 -8.97732652e-08 5.58058725e-08] [ 1.52523932e-07 -8.73515245e-08 5.38512933e-08] [-3.56508279e-10 -1.23494362e-07 3.77987306e-08] [ 1.07241720e-07 6.21230810e-08 3.71880564e-08] [-1.06838173e-07 6.14647447e-08 3.83417971e-08] [-4.69624746e-03 -3.36979851e-04 7.95184527e-04] [ 2.73824357e-03 -4.50899247e-03 -4.98752452e-04] [ 5.15448084e-03 6.22935563e-03 5.39795403e-04] [ 4.69624763e-03 3.36999422e-04 -7.95151883e-04] [-2.73826100e-03 4.50898229e-03 4.98785093e-04] [-5.15446434e-03 -6.22936504e-03 -5.39762737e-04] [-1.45671887e-03 7.70711146e-05 -2.98883788e-04] [ 4.91444642e-04 1.05452727e-04 -3.33765534e-04] [ 1.45671899e-03 -7.70711167e-05 2.98885275e-04] [-4.91444517e-04 -1.05452716e-04 3.33767583e-04] [ 2.54922176e-03 -1.40452043e-04 -4.16586046e-04] [ 2.67162198e-03 1.97241613e-04 -2.31141303e-05] [-2.54922187e-03 1.40451979e-04 4.16585122e-04] [-2.67162179e-03 -1.97241538e-04 2.31120704e-05]] Final stress: [ 1.91312966e-05 -2.20782508e-05 5.57542600e-05 4.77970531e-05 4.41167964e-04 -4.52005476e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 1.89653814e-03 -3.42779303e-03 7.40384834e-03] [-1.89664395e-03 3.42778517e-03 7.38530255e-03] [-1.89663697e-03 3.42779392e-03 -7.38797581e-03] [ 1.89660596e-03 -3.42778797e-03 -7.39301800e-03] [-2.39342298e-08 3.28041717e-06 1.31082004e-06] [-2.80129679e-06 -1.60585174e-06 1.29703545e-06] [ 2.86991009e-06 -1.67268567e-06 1.30565763e-06] [-1.04351056e-07 1.09166252e-05 -3.47863192e-06] [-9.32511190e-06 -5.32931474e-06 -3.44336749e-06] [ 9.56435424e-06 -5.58730456e-06 -3.46694275e-06] [ 2.33276689e-02 -2.39567329e-03 9.25901452e-07] [-1.15007246e-02 1.35707437e-02 9.10836116e-07] [-1.89981582e-03 -1.16332366e-02 9.30271596e-07] [-2.33277679e-02 2.40507503e-03 -1.50993855e-06] [ 1.14926589e-02 -1.35753389e-02 -1.49023058e-06] [ 1.90802859e-03 1.16284377e-02 -1.52124376e-06] [-5.69594675e-04 -2.36228452e-03 1.94645180e-03] [ 5.69601655e-04 2.36228017e-03 1.94643266e-03] [ 5.69586673e-04 2.36227973e-03 -1.94661519e-03] [-5.69598997e-04 -2.36228669e-03 -1.94631916e-03] [-3.09378025e-04 3.58913368e-04 2.91337836e-04] [ 3.09343606e-04 -3.58911177e-04 2.91107867e-04] [ 3.09310364e-04 -3.58911415e-04 -2.91149510e-04] [-3.09361423e-04 3.58912827e-04 -2.91173550e-04]] Final stress: [-1.80123986e-04 -1.51348563e-04 -3.30328992e-04 -2.89719103e-11 3.14808339e-10 1.00867883e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-2.11388378e-03 -3.90600878e-03 7.92877068e-03] [ 2.11396700e-03 3.90599518e-03 7.91611795e-03] [ 2.11398264e-03 3.90600173e-03 -7.91565195e-03] [-2.11396378e-03 -3.90598969e-03 -7.91812203e-03] [-1.40811276e-08 -3.30942799e-07 1.30474238e-07] [ 2.93040648e-07 1.77823085e-07 1.32242806e-07] [-2.74783904e-07 1.50877477e-07 1.36246126e-07] [ 1.05698958e-07 1.03043136e-05 -3.12391591e-06] [-9.03442881e-06 -5.28077762e-06 -3.10957953e-06] [ 8.79429232e-06 -5.02043803e-06 -3.08185883e-06] [-2.51127307e-02 -2.30580300e-03 5.33557217e-07] [ 1.71751221e-03 -1.09320337e-02 5.35382925e-07] [ 1.14727079e-02 1.36713116e-02 5.21864433e-07] [ 2.51127837e-02 2.31076974e-03 -1.31312347e-06] [-1.72185670e-03 1.09294934e-02 -1.31290486e-06] [-1.14684538e-02 -1.36737333e-02 -1.27953794e-06] [ 5.28024489e-04 -2.98112899e-03 2.31350210e-03] [-5.28032457e-04 2.98112627e-03 2.31345496e-03] [-5.28018314e-04 2.98112774e-03 -2.31360483e-03] [ 5.28025083e-04 -2.98113121e-03 -2.31341430e-03] [ 1.10374401e-03 4.38320509e-04 -1.72964062e-04] [-1.10371688e-03 -4.38319571e-04 -1.73138910e-04] [-1.10367416e-03 -4.38319292e-04 1.73150975e-04] [ 1.10371382e-03 4.38320521e-04 1.73130575e-04]] Final stress: [-1.92321270e-04 -1.89094180e-04 -3.63992312e-04 -6.30738892e-11 -2.35547986e-10 -1.00976647e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 2.78322088e-11 9.56153940e-05 -1.52104258e-04] [-7.59161560e-12 -9.56153237e-05 -1.52101037e-04] [-1.72789360e-10 -9.56154846e-05 1.52111045e-04] [-5.58485758e-11 9.56154791e-05 1.52104953e-04] [-2.82162411e-11 -3.04215836e-09 -1.01784042e-09] [ 2.66962964e-09 1.53398666e-09 -9.80897863e-10] [-2.59158872e-09 1.45871282e-09 -9.17470599e-10] [ 4.39593912e-11 3.39110562e-09 -1.39058853e-09] [-2.95023994e-09 -1.71654368e-09 -1.33824651e-09] [ 2.91779889e-09 -1.64846942e-09 -1.36842003e-09] [-2.34685549e-10 1.74292760e-04 -1.51199727e-09] [ 1.99117385e-04 -1.44713225e-04 -1.26419199e-09] [-1.99116962e-04 -1.44713741e-04 -1.47570677e-09] [-1.81194504e-11 -1.74291140e-04 2.03296720e-10] [-1.99118708e-04 1.44712664e-04 2.50270429e-10] [ 1.99118742e-04 1.44712625e-04 3.09747969e-10] [ 7.88544230e-12 -1.25337480e-04 -8.73012321e-05] [ 6.85013157e-12 1.25337480e-04 -8.73011061e-05] [-5.40167910e-12 1.25337482e-04 8.73011327e-05] [-2.06382134e-12 -1.25337487e-04 8.73010414e-05] [-2.52029508e-11 1.77740690e-04 2.33605526e-04] [-2.57765321e-12 -1.77740679e-04 2.33605629e-04] [-5.39585179e-12 -1.77740685e-04 -2.33605570e-04] [-3.15151238e-11 1.77740694e-04 -2.33605623e-04]] Final stress: [ 1.44885774e-03 8.23477600e-04 7.56903359e-04 1.93288064e-13 7.14294840e-13 -9.56746048e-14] Minimization converged after 28 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.11830553e-13 -1.24991221e-04 -6.46909608e-05] [-8.60200973e-12 1.24991224e-04 -6.46922012e-05] [ 1.04143161e-11 1.24991210e-04 6.46915160e-05] [ 1.57795998e-12 -1.24991221e-04 6.46916871e-05] [ 6.62542905e-12 8.26749780e-11 6.63832878e-11] [-6.67310651e-11 -4.72164599e-11 6.77401468e-11] [ 6.11342088e-11 -3.81156773e-11 7.08250680e-11] [-6.64057812e-12 5.29861266e-10 -1.46804124e-10] [-4.45618098e-10 -2.56129895e-10 -1.34475320e-10] [ 4.48613424e-10 -2.63392474e-10 -1.27895434e-10] [-3.11084491e-13 3.21297753e-04 1.37784651e-10] [-2.32722241e-04 -2.55686271e-04 1.37649525e-10] [ 2.32722241e-04 -2.55686272e-04 1.58170871e-10] [-1.85129689e-13 -3.21297254e-04 -9.90097716e-11] [ 2.32721817e-04 2.55686022e-04 -1.02344706e-10] [-2.32721817e-04 2.55686025e-04 -1.04921849e-10] [-8.39606162e-14 -2.06912765e-04 1.39896267e-05] [-8.99280650e-13 2.06912765e-04 1.39896189e-05] [ 8.27005131e-13 2.06912764e-04 -1.39896285e-05] [ 1.25566224e-13 -2.06912765e-04 -1.39896054e-05] [ 2.03614903e-13 1.69045587e-04 -8.47039401e-05] [-4.23514522e-13 -1.69045587e-04 -8.47039578e-05] [ 7.74619789e-13 -1.69045589e-04 8.47039575e-05] [-1.40998324e-13 1.69045588e-04 8.47039644e-05]] Final stress: [ 3.26024915e-04 -3.01273612e-04 8.55191013e-06 4.71826265e-14 -6.48421982e-14 -3.03498196e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.72403236e-12 1.24817562e-04 8.13528395e-06] [ 1.65112902e-12 -1.24817557e-04 8.13493439e-06] [-5.82599859e-13 -1.24817560e-04 -8.13517808e-06] [ 3.43583495e-12 1.24817554e-04 -8.13497232e-06] [-4.37642506e-12 -6.80313028e-11 3.60772523e-12] [ 6.64738681e-11 3.88957269e-11 1.03531073e-12] [-6.57764399e-11 3.37830874e-11 -5.02151098e-12] [ 5.05859710e-12 2.38478570e-10 -4.02703426e-11] [-2.11618501e-10 -1.23222432e-10 -3.96053190e-11] [ 2.12781404e-10 -1.18860255e-10 -5.04282380e-11] [ 8.24396107e-13 3.12402224e-04 5.19661089e-11] [-1.68233102e-04 1.40891975e-06 5.67593188e-11] [ 1.68233099e-04 1.40892170e-06 5.83164611e-11] [-9.98534588e-13 -3.12402289e-04 -3.97292844e-11] [ 1.68233154e-04 -1.40888701e-06 -4.12170456e-11] [-1.68233153e-04 -1.40888906e-06 -4.68012266e-11] [-6.10012041e-13 1.86198164e-04 -9.24768240e-07] [ 5.49560397e-13 -1.86198164e-04 -9.24776113e-07] [-3.34288153e-13 -1.86198164e-04 9.24772500e-07] [ 7.87342413e-13 1.86198164e-04 9.24777156e-07] [-7.60946861e-13 -1.52708122e-04 -2.73263434e-05] [ 4.00380711e-13 1.52708123e-04 -2.73263512e-05] [-8.70989153e-13 1.52708123e-04 2.73263556e-05] [ 6.89337476e-13 -1.52708123e-04 2.73263573e-05]] Final stress: [-3.03012956e-04 3.29642592e-04 9.39311816e-06 2.95579958e-14 -1.55795569e-14 -1.02330764e-15] Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-7.72802933e-11 3.30983797e-05 1.07033166e-04] [ 4.33460312e-12 -3.30985561e-05 1.07030706e-04] [-4.03349691e-12 -3.30984213e-05 -1.07018384e-04] [-9.28049027e-11 3.30983747e-05 -1.07029545e-04] [-8.43211556e-11 -2.63708094e-09 -7.60906504e-10] [ 2.79501589e-09 1.50731543e-09 -1.02989245e-09] [-2.62281757e-09 1.31007688e-09 -9.15505421e-10] [-2.71288447e-11 8.42900727e-09 -2.90862701e-09] [-6.89506119e-09 -4.12752776e-09 -2.77145806e-09] [ 6.95446589e-09 -4.19152596e-09 -2.81812554e-09] [ 4.20699031e-11 -1.00158509e-04 -1.47108944e-09] [ 7.64405860e-05 -1.77806892e-05 -1.56757202e-09] [-7.64406648e-05 -1.77805966e-05 -1.60416082e-09] [-1.68832892e-10 1.00169973e-04 1.67188437e-11] [-7.64504099e-05 1.77751027e-05 3.22992873e-11] [ 7.64507223e-05 1.77747278e-05 2.17620082e-11] [-8.97995567e-12 -6.13579555e-05 4.92615024e-05] [-2.40729658e-12 6.13579118e-05 4.92618032e-05] [-7.85221888e-12 6.13579116e-05 -4.92617945e-05] [-5.64734370e-12 -6.13579428e-05 -4.92616978e-05] [ 4.93599606e-12 9.29544179e-05 -1.61768416e-04] [-2.07005846e-11 -9.29544212e-05 -1.61768390e-04] [-1.93388970e-11 -9.29544166e-05 1.61768473e-04] [ 2.70544698e-12 9.29544180e-05 1.61768353e-04]] Final stress: [ 1.10441015e-03 7.92474580e-04 1.08144572e-03 -3.84178326e-13 6.91089903e-14 7.82115430e-14] Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-2.33446040e-11 -7.68341100e-05 -4.14444021e-05] [ 6.98116830e-12 7.68340162e-05 -4.14471185e-05] [-2.18521354e-11 7.68338619e-05 4.14473794e-05] [ 2.05840622e-11 -7.68340065e-05 4.14499148e-05] [ 1.65851337e-11 4.95149421e-10 -3.68849395e-10] [-4.59856153e-10 -2.65668487e-10 -3.58083063e-10] [ 4.20342650e-10 -2.23786822e-10 -3.89163674e-10] [-3.04267779e-11 8.65443273e-11 -5.94859051e-10] [ 3.47783580e-10 1.15240817e-10 -2.78934653e-10] [-2.72112888e-10 3.53878593e-11 -3.40733240e-10] [ 8.84770035e-12 -9.00525091e-05 -6.71167100e-11] [-4.84472000e-05 7.23293211e-05 8.89170402e-12] [ 4.84471925e-05 7.23293341e-05 1.83386203e-12] [-6.40598685e-13 9.00528143e-05 -9.88170596e-10] [ 4.84469174e-05 -7.23294640e-05 -9.49612276e-10] [-4.84469196e-05 -7.23294609e-05 -9.73220005e-10] [ 2.18744467e-12 2.06606181e-05 3.62057456e-05] [-4.45810056e-12 -2.06606258e-05 3.62056925e-05] [ 2.81685786e-12 -2.06606114e-05 -3.62058492e-05] [-3.74358877e-12 2.06606000e-05 -3.62057793e-05] [-6.95388191e-13 -7.35931211e-05 -4.14764551e-05] [ 4.24741703e-13 7.35931114e-05 -4.14765110e-05] [-1.18560115e-12 7.35931009e-05 4.14763245e-05] [ 1.46338497e-12 -7.35931120e-05 4.14763563e-05]] Final stress: [-3.33432276e-04 -1.86080114e-05 3.33623405e-04 1.34707673e-13 -4.48806339e-14 1.46795703e-14] Minimization converged after 31 steps. Minimization converged after 51 steps. Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 7.39378970e-04 1.35516822e-03 1.53588712e-03] [-2.60181468e-05 5.50205498e-04 -1.94213339e-03] [ 4.46567146e-04 1.36806402e-03 1.60519398e-03] [-1.14259278e-03 7.04684754e-04 -1.98453388e-03] [ 7.74914893e-04 -2.77411087e-03 -5.74561067e-03] [ 8.04531705e-04 -6.98294185e-04 -2.16399824e-03] [-1.19395251e-03 3.52929967e-04 -1.37632768e-03] [ 3.49769656e-04 -1.16232415e-04 -7.99926636e-04] [-1.52735056e-03 -1.56197305e-03 3.91581424e-03] [ 6.88778813e-04 -1.59778045e-03 4.23096841e-03] [ 8.75611379e-04 4.81588510e-04 2.43820686e-04] [ 1.68814514e-03 -8.32557771e-04 4.61598514e-04] [-3.10077994e-03 1.15453077e-03 8.03817379e-04] [-5.40335719e-05 5.84205854e-04 -1.15144637e-04] [ 2.56234279e-03 5.25366758e-04 -3.54788301e-04] [-2.18868935e-03 1.00230519e-04 1.54378417e-03] [ 6.50860077e-05 -1.12402768e-04 2.62810514e-04] [ 1.16357844e-04 -2.47711295e-04 1.34774729e-04] [ 1.79713511e-05 -1.96145082e-04 5.56587076e-04] [ 2.96412961e-05 -7.11574620e-04 -5.74423959e-04] [ 1.26606371e-04 4.36229057e-04 5.11261884e-04] [-9.37286591e-05 4.72545099e-04 -5.74259014e-04] [ 1.29978825e-05 4.36410800e-04 7.51480220e-05] [ 2.84442652e-05 3.26622687e-04 -2.50320323e-04]] Final stress: [-8.79695284e-04 -7.11243135e-04 -5.34978684e-04 -2.16055318e-04 4.26832657e-06 5.98859142e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 2.56666665e-06 5.55158721e-05 -2.70965304e-04] [-6.90719733e-06 -2.92747916e-05 -1.81619347e-04] [-1.59468164e-06 -2.94693801e-05 -2.24746524e-04] [-3.44353970e-06 2.86159519e-05 -2.19261554e-04] [-1.26501175e-07 1.52796399e-04 7.28777094e-05] [-1.17627389e-04 -7.32290250e-05 6.60396101e-05] [ 1.20388471e-04 -7.49573450e-05 7.00760042e-05] [ 9.08232707e-06 -1.56751798e-04 1.06856282e-04] [ 7.25245385e-05 5.60229846e-05 7.24912588e-05] [-9.03517997e-05 7.68164683e-05 8.37693916e-05] [-1.84459307e-05 -2.84988813e-05 1.56236198e-05] [-1.05428949e-05 2.02073260e-05 6.82488841e-05] [ 4.26975730e-05 -1.96278645e-05 6.99505931e-05] [-7.41352726e-06 4.70420343e-05 1.17080880e-04] [-1.53259645e-05 -8.39335252e-06 5.53029532e-05] [ 2.77772615e-05 -2.41226324e-05 5.77451034e-05] [ 2.43277610e-08 -3.61881384e-05 -3.32348823e-08] [ 1.15231661e-06 2.77725017e-05 4.97600550e-05] [-1.04695568e-07 3.46693244e-05 8.65680521e-06] [ 1.23260082e-06 -2.28855905e-05 -3.70031728e-05] [-1.85397129e-06 -3.09626916e-05 -5.58717897e-05] [-9.02528534e-07 3.56176717e-05 -9.77517123e-05] [-6.43574910e-07 3.34388094e-05 6.85754949e-05] [-2.16188650e-06 -3.41538523e-05 1.04197994e-04]] Final stress: [-7.07477279e-04 -3.95240424e-04 -3.51951683e-04 2.64798734e-04 2.17368356e-09 -4.96529492e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 7.12378177e-06 -4.00439781e-05 9.48310126e-05] [ 6.86725945e-06 3.97090321e-05 -3.10849052e-05] [-6.99400506e-06 3.97761717e-05 -4.84713640e-05] [-6.55023045e-06 -3.98880371e-05 -9.08642665e-06] [ 3.24251478e-07 1.24086921e-05 5.61606039e-06] [-1.09200865e-05 -6.54935890e-06 5.74640913e-06] [ 1.02166158e-05 -5.76780869e-06 5.27984670e-06] [ 6.85315637e-08 2.37746060e-05 -7.95210401e-06] [-2.04856073e-05 -1.19101428e-05 -7.90048514e-06] [ 2.03512598e-05 -1.17540129e-05 -7.74000751e-06] [-1.60783467e-07 8.25989420e-05 1.48558500e-05] [ 2.89878849e-05 -1.98254525e-05 1.59136835e-05] [-2.85298839e-05 -2.02759952e-05 1.37307295e-05] [ 2.66234573e-07 -1.95255984e-05 -1.48491084e-05] [-8.25456486e-05 -1.16577390e-05 -1.57894481e-05] [ 8.18454061e-05 -1.09449736e-05 -1.36666543e-05] [ 1.38893254e-05 2.17587631e-05 2.56424115e-05] [ 1.39372220e-05 -2.17674320e-05 2.47681859e-05] [-1.38600462e-05 -2.17671478e-05 -2.66219127e-05] [-1.38789102e-05 2.17592440e-05 -2.36752244e-05] [ 1.40148465e-05 4.88138729e-05 -3.00333684e-07] [ 1.40427386e-05 -4.88692524e-05 -1.95856657e-06] [-1.39499001e-05 -4.88702308e-05 7.90133675e-07] [-1.40602560e-05 4.88178363e-05 1.92221763e-06]] Final stress: [ 7.37846153e-04 4.16781025e-04 3.95203944e-04 -4.01041478e-10 -2.65444431e-04 -3.78826492e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-6.39975668e-06 -3.91618023e-05 4.73404383e-05] [-6.59937239e-06 3.91191329e-05 7.04885156e-06] [ 6.99263475e-06 3.91676863e-05 -3.12128341e-05] [ 6.85451395e-06 -3.91573152e-05 -3.26953104e-05] [ 1.15019814e-07 -5.31026138e-06 1.70453444e-06] [ 4.84444417e-06 2.58707048e-06 1.63810532e-06] [-5.12307920e-06 2.88036310e-06 1.42172323e-06] [ 3.83392808e-07 1.46132248e-05 -3.20730353e-06] [-1.29250548e-05 -7.75943396e-06 -3.48059844e-06] [ 1.19846640e-05 -6.77350042e-06 -2.75620767e-06] [-3.93876987e-10 6.92100072e-05 5.44081713e-06] [ 3.62314704e-05 -1.46905523e-05 4.37860026e-06] [-3.63628830e-05 -1.46150355e-05 6.48566796e-06] [ 2.21418805e-07 -2.97033491e-05 -1.53624145e-06] [-7.14222435e-05 -5.46125241e-06 -5.21915497e-07] [ 7.09857542e-05 -4.95330568e-06 -2.49315116e-06] [-1.36409159e-05 1.99145431e-05 2.45062935e-05] [-1.36467197e-05 -1.99442002e-05 2.47058198e-05] [ 1.36967607e-05 -1.99552314e-05 -2.47029506e-05] [ 1.37129887e-05 1.99262396e-05 -2.36045143e-05] [-1.37933467e-05 4.74680738e-05 -7.21186675e-07] [-1.37541955e-05 -4.74345620e-05 -1.00648679e-06] [ 1.38227449e-05 -4.74377040e-05 1.44919825e-06] [ 1.38221541e-05 4.74711644e-05 1.81865096e-06]] Final stress: [ 7.37954185e-04 4.16669313e-04 3.95251048e-04 -9.29917766e-11 2.65545500e-04 -5.36195897e-11] Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.04410026e-03 -1.10870293e-03 1.10099474e-04] [-1.04410038e-03 1.10870293e-03 1.10098130e-04] [-1.04410023e-03 1.10870299e-03 -1.10095583e-04] [ 1.04410037e-03 -1.10870296e-03 -1.10098349e-04] [-7.77930307e-11 2.83349938e-09 4.17738066e-10] [-2.33890107e-09 -1.32561457e-09 3.46460666e-10] [ 2.46988036e-09 -1.47513657e-09 4.03923089e-10] [ 8.25051707e-11 1.88949967e-10 -4.59577043e-10] [-4.03505229e-10 -2.23549512e-10 -5.79062909e-10] [ 2.56680899e-10 -2.54372079e-11 -4.86791506e-10] [ 1.67779788e-04 1.01008928e-04 -5.71950222e-10] [ 1.69153095e-04 -9.03667609e-04 -6.66518285e-10] [-2.89994118e-04 -6.83925719e-04 -5.51422829e-10] [-1.67779795e-04 -1.01007430e-04 -3.46736138e-10] [-1.69154435e-04 9.03666836e-04 -2.68619094e-10] [ 2.89995452e-04 6.83924983e-04 -4.27569473e-10] [-6.22735789e-04 -3.84608718e-04 1.38463809e-04] [ 6.22735780e-04 3.84608723e-04 1.38463853e-04] [ 6.22735777e-04 3.84608715e-04 -1.38463936e-04] [-6.22735762e-04 -3.84608706e-04 -1.38463924e-04] [ 1.75329227e-04 1.97967939e-05 4.42138806e-04] [-1.75329234e-04 -1.97967959e-05 4.42138774e-04] [-1.75329225e-04 -1.97967903e-05 -4.42138903e-04] [ 1.75329229e-04 1.97967918e-05 -4.42138959e-04]] Final stress: [ 7.17569843e-04 4.30416211e-04 3.58013000e-04 -1.09584460e-13 -7.33848203e-13 2.96011683e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.04489582e-03 -1.10123212e-03 1.12268781e-04] [ 1.04489591e-03 1.10123210e-03 1.12273549e-04] [ 1.04489586e-03 1.10123205e-03 -1.12265610e-04] [-1.04489582e-03 -1.10123210e-03 -1.12267346e-04] [ 5.46510931e-11 6.23087137e-10 -6.70619837e-10] [-5.66891367e-10 -3.58898793e-10 -6.38036041e-10] [ 4.44965009e-10 -2.46003218e-10 -7.32719774e-10] [ 7.13713062e-11 -3.57155105e-09 1.97626360e-11] [ 3.06563286e-09 1.73093728e-09 5.28629363e-11] [-3.19694154e-09 1.88614196e-09 1.29403141e-10] [-1.62591625e-04 1.11518071e-04 -1.69379692e-09] [ 2.85965405e-04 -6.89996780e-04 -1.61947522e-09] [-1.70355877e-04 -9.00888148e-04 -1.68852575e-09] [ 1.62591681e-04 -1.11519141e-04 -5.11651826e-10] [-2.85964504e-04 6.89997283e-04 -4.88138293e-10] [ 1.70354872e-04 9.00888737e-04 -4.98675352e-10] [ 6.19597470e-04 -3.82556329e-04 1.37069285e-04] [-6.19597452e-04 3.82556329e-04 1.37069332e-04] [-6.19597456e-04 3.82556331e-04 -1.37069477e-04] [ 6.19597468e-04 -3.82556332e-04 -1.37069581e-04] [-1.74754471e-04 1.94868180e-05 4.44454108e-04] [ 1.74754479e-04 -1.94868220e-05 4.44454217e-04] [ 1.74754469e-04 -1.94868204e-05 -4.44454460e-04] [-1.74754465e-04 1.94868170e-05 -4.44454459e-04]] Final stress: [ 7.17657171e-04 4.30470770e-04 3.58046280e-04 4.51114134e-14 1.88131971e-13 -2.96023849e-04] Minimization converged after 187 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 81 steps. Final forces: [[-0.00556594 0.00016047 -0.01573955] [-0.00486452 0.03370011 0.01183954] [-0.00314436 -0.02343363 -0.00364037] [ 0.01659699 -0.02292361 0.01385325] [ 0.00136351 -0.0175544 0.0032375 ] [-0.00162027 -0.00143477 0.00040674] [-0.01477818 0.01070359 -0.01388875] [ 0.00412759 -0.0107823 -0.00554743] [ 0.02388587 0.01038942 -0.00994078] [-0.01509102 0.009216 -0.02064658] [-0.0077913 0.00136092 0.00349214] [-0.01397486 0.00681982 -0.0032082 ] [ 0.01994814 -0.01455986 0.03412696] [-0.00543406 0.02808674 0.00671495] [-0.00080844 -0.02409507 0.00473852] [ 0.00480813 0.02679652 0.03592739] [ 0.00403656 -0.0107105 0.00325499] [-0.002258 0.01091256 0.00411943] [ 0.00714537 -0.02184792 0.00109611] [-0.00603377 0.02212648 0.00053742] [ 0.00186867 -0.00056682 -0.00462196] [-0.00377642 -0.00118004 -0.00393413] [-0.00680943 -0.01585194 -0.02061286] [ 0.00816972 0.00466824 -0.02156435]] Final stress: [ 3.52406520e-02 3.58319532e-02 1.44321571e-01 1.21981028e-04 -3.70811547e-05 -4.65361703e-04] Minimization converged after 26 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-1.19789900e-10 1.34955304e-04 -8.37727529e-09] [ 3.64656933e-11 -1.34953806e-04 1.52190629e-07] [ 1.57090481e-09 -1.34955843e-04 9.35922361e-08] [-9.63810420e-11 1.34957637e-04 1.31272940e-08] [-1.13809646e-09 -1.01978011e-07 -3.78877957e-08] [ 8.03400639e-08 5.03643091e-08 -3.36982656e-08] [-7.79687321e-08 4.76760253e-08 -3.21136042e-08] [ 9.28848517e-10 7.45187414e-08 -2.32961032e-08] [-6.61681736e-08 -3.82637522e-08 -2.34395298e-08] [ 6.45953681e-08 -3.62940181e-08 -2.26092047e-08] [ 3.24210159e-09 7.83478994e-05 -3.46869456e-08] [ 5.98336779e-06 4.09217925e-04 -3.44566565e-08] [-5.98897233e-06 4.09224815e-04 -3.34816448e-08] [ 5.41882705e-10 -7.84006294e-05 8.73849752e-09] [-5.93980453e-06 -4.09195681e-04 1.00136499e-08] [ 5.93898377e-06 -4.09194528e-04 9.29039761e-09] [-1.91346355e-10 4.98507126e-04 3.33884831e-04] [ 8.84032292e-11 -4.98506661e-04 3.33886960e-04] [-9.71903114e-11 -4.98506237e-04 -3.33885697e-04] [ 1.31278377e-10 4.98506631e-04 -3.33889234e-04] [ 3.30787620e-10 -8.16952058e-05 -6.89087499e-04] [ 1.56392625e-11 8.16952494e-05 -6.89085681e-04] [ 5.00230066e-11 8.16952331e-05 6.89087820e-04] [ 3.33241934e-10 -8.16952528e-05 6.89085594e-04]] Final stress: [ 8.09841538e-04 1.06008850e-03 1.07061373e-03 1.29803829e-12 -4.45125041e-12 1.13698438e-12] Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-2.05787609e-11 4.81758512e-05 -9.64401818e-05] [-3.61599964e-12 -4.81758500e-05 -9.64426066e-05] [ 1.85188674e-11 -4.81758434e-05 9.64407949e-05] [-1.86673454e-11 4.81757754e-05 9.64447943e-05] [-6.43797659e-11 -3.05747261e-10 -3.65618091e-10] [ 3.87015017e-10 2.48403360e-10 -4.57052868e-10] [-2.56679122e-10 9.66092761e-11 -3.71193853e-10] [ 5.01226591e-11 5.17630383e-11 -7.55525642e-11] [-1.63631775e-10 -8.48392467e-11 -1.06598841e-10] [ 9.67073088e-11 1.03083653e-11 -9.00149157e-11] [ 5.45179457e-11 4.29571758e-05 3.68319410e-10] [ 1.41230811e-04 -5.20372678e-05 3.86069214e-10] [-1.41230904e-04 -5.20371591e-05 3.72913690e-10] [ 4.86183316e-12 -4.29570246e-05 -7.29133531e-10] [-1.41230782e-04 5.20371693e-05 -7.65758508e-10] [ 1.41230788e-04 5.20371727e-05 -8.04105219e-10] [-7.11797288e-12 -2.36134221e-05 4.79093732e-05] [ 4.61236604e-12 2.36134291e-05 4.79093136e-05] [-5.57615065e-12 2.36134176e-05 -4.79094204e-05] [ 4.93105556e-12 -2.36134171e-05 -4.79093350e-05] [ 4.36328751e-12 7.15474896e-05 -3.71560400e-05] [-1.56403737e-12 -7.15475000e-05 -3.71561188e-05] [-7.07202959e-13 -7.15475005e-05 3.71560165e-05] [ 4.25265378e-12 7.15474875e-05 3.71560479e-05]] Final stress: [-1.85095234e-05 -3.32967741e-04 3.33216400e-04 2.02431473e-13 -5.85446042e-14 7.65643760e-15] Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.49211189e-08 2.09338588e-04 2.15488145e-04] [-1.21351111e-07 -2.22479865e-04 -3.75168033e-04] [ 1.04549207e-07 -2.09422459e-04 -2.14432053e-04] [ 3.51421806e-08 2.22513601e-04 3.76315758e-04] [-2.35434318e-08 5.51781244e-07 -8.46454597e-08] [-3.73858169e-07 -2.38364070e-07 -1.26045434e-07] [ 4.60477833e-07 -3.13857117e-07 -3.26859544e-08] [ 2.65550870e-08 5.63463694e-07 -2.53082839e-07] [-4.30690370e-07 -2.97116024e-07 -2.36700476e-07] [ 3.39294712e-07 -2.13899068e-07 -1.40589042e-07] [-1.20604325e-08 -4.14331176e-05 -3.80046810e-04] [ 5.80473570e-05 2.99839293e-05 -3.42575524e-04] [-5.80225780e-05 2.99541565e-05 -3.42362968e-04] [ 9.34607104e-08 4.10060864e-05 3.79596606e-04] [-5.76849477e-05 -2.98498928e-05 3.42131655e-04] [ 5.75193669e-05 -2.96439017e-05 3.42086395e-04] [-1.08099402e-08 1.72470481e-05 1.10439833e-04] [ 5.51259538e-10 -1.53352651e-04 -4.31076489e-05] [-1.66663006e-09 -1.72504718e-05 -1.10476899e-04] [ 1.25748401e-08 1.53340261e-04 4.30712392e-05] [-9.51162760e-10 -2.69274097e-04 -4.58786080e-04] [ 6.36770617e-09 2.03352813e-04 -2.01940828e-04] [ 1.42201384e-08 2.69269804e-04 4.58773420e-04] [-2.38175490e-09 -2.03351840e-04 2.01867543e-04]] Final stress: [ 4.20249435e-04 7.06497693e-04 3.95281950e-04 -2.48216563e-04 -6.85759280e-10 -4.85532580e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.54491381e-07 2.24028909e-04 -3.73922037e-04] [ 1.01605590e-07 -2.10891820e-04 2.15954268e-04] [-9.80165279e-08 -2.24112745e-04 3.76387001e-04] [-4.23309291e-08 2.10774147e-04 -2.13244436e-04] [-5.41238415e-08 8.68988748e-07 -1.85506046e-07] [-6.23898837e-07 -3.46454152e-07 -2.78782421e-07] [ 6.95598161e-07 -4.50892663e-07 -2.71815507e-07] [-3.45052840e-08 -4.46051922e-08 -4.32391622e-07] [ 2.63216829e-07 1.24563135e-07 -2.39678884e-07] [-8.57957059e-08 -1.17420417e-08 -4.56798842e-07] [ 1.14817348e-07 -4.21464509e-05 3.80457617e-04] [ 5.77267402e-05 3.07672609e-05 3.42941884e-04] [-5.79165338e-05 3.10070015e-05 3.42743688e-04] [-1.76194114e-07 4.11258113e-05 -3.81389094e-04] [-5.65238897e-05 -3.01278578e-05 -3.43752256e-04] [ 5.68531130e-05 -3.05177547e-05 -3.43854356e-04] [ 1.28319927e-09 1.53935146e-04 -4.27866036e-05] [-5.95969324e-09 -1.78605617e-05 1.10959465e-04] [-3.30824812e-11 -1.53942397e-04 4.27120404e-05] [-1.28335851e-08 1.78521036e-05 -1.11071748e-04] [ 6.36098607e-09 -2.03727379e-04 -2.03414036e-04] [-1.94246338e-08 2.69373004e-04 -4.60912877e-04] [-2.69941777e-08 2.03710799e-04 2.03292200e-04] [ 1.22900736e-08 -2.69387075e-04 4.60764255e-04]] Final stress: [4.20241641e-04 7.06400357e-04 3.95272005e-04 2.48186335e-04 2.48919057e-10 1.26939224e-10] Minimization converged after 53 steps. Minimization converged after 55 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.92060429e-04 8.68893214e-05 2.46999523e-04] [-6.78288847e-05 2.66041352e-04 -4.39395806e-04] [-3.18920872e-05 -2.02776834e-04 1.76607060e-04] [ 5.93853878e-05 1.39135602e-04 -2.98789560e-04] [-1.98422091e-05 -6.12949434e-05 -3.02489058e-04] [ 1.42388481e-04 1.12348253e-04 -3.07818841e-04] [-2.65356817e-05 -1.15856761e-04 -6.19992520e-05] [-5.75808334e-05 -2.89468412e-04 1.95127238e-04] [ 2.23340003e-04 5.63598439e-04 -3.91591034e-04] [ 1.77121774e-05 -1.48130571e-04 -2.39265768e-04] [ 1.71313086e-04 4.05042790e-04 1.25413650e-04] [-1.87240523e-04 2.31099773e-04 1.20516266e-04] [-1.22176164e-04 -5.09400858e-04 2.65979898e-05] [ 3.95101342e-04 4.36268095e-04 4.35833094e-06] [-3.58851794e-04 -3.10558560e-05 -1.46164095e-04] [-1.87352071e-04 -2.52490078e-04 -7.76499519e-05] [ 3.44040035e-05 -5.89693309e-05 1.01109337e-04] [ 6.16350306e-05 1.71393938e-04 2.24369297e-04] [ 7.59618878e-07 -7.21898445e-05 7.62615258e-05] [-1.06749909e-04 9.27285400e-05 1.64073695e-04] [ 1.85060451e-04 -3.87734187e-04 1.35147320e-04] [-1.85638518e-04 -1.43692235e-04 2.81921088e-04] [ 3.74486245e-04 -2.28136849e-04 9.79629368e-05] [-1.21836722e-04 -3.34934251e-06 2.88698109e-04]] Final stress: [3.21955164e-02 3.46123781e-02 1.34946246e-01 1.55835989e-06 8.05127448e-06 5.25627458e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 7.21903994e-04 -1.10132505e-04 -2.16452443e-04] [-7.21626036e-04 1.10368323e-04 -3.00135266e-04] [-7.21918453e-04 1.09761026e-04 2.45371365e-04] [ 7.21713423e-04 -1.09726974e-04 3.08308010e-04] [ 3.09383266e-08 -6.51642315e-07 -1.12311301e-06] [-9.41303602e-07 -2.39056029e-08 -3.72181255e-07] [ 8.70178246e-07 5.76683575e-08 -4.12988834e-07] [-1.73757860e-07 3.00681412e-05 -8.87515157e-06] [-2.49117530e-05 -1.46952726e-05 -7.95784534e-06] [ 2.50920054e-05 -1.50025402e-05 -8.44686013e-06] [ 1.92409731e-03 -4.22048787e-04 1.14479598e-05] [-3.13883630e-04 7.27398863e-04 1.18232399e-05] [-1.70747878e-03 -3.08274567e-04 1.15656238e-05] [-1.92412014e-03 4.09125115e-04 -1.48896761e-05] [ 3.24863326e-04 -7.21025309e-04 -1.49540181e-05] [ 1.69637748e-03 3.14690897e-04 -1.47287408e-05] [ 8.04197472e-05 -7.84976287e-05 -3.69837263e-05] [-8.05395583e-05 7.84627745e-05 -3.89619946e-05] [-8.04156249e-05 7.86277211e-05 3.70046443e-05] [ 8.04224597e-05 -7.86067022e-05 3.85243677e-05] [-3.60343938e-05 8.73538675e-06 1.21973645e-04] [ 3.60550419e-05 -8.71693885e-06 1.20471698e-04] [ 3.62079045e-05 -8.64812530e-06 -1.21416267e-04] [-3.60103728e-05 8.75498375e-06 -1.20780283e-04]] Final stress: [ 1.98704299e-04 3.71135703e-04 7.65192822e-05 -2.05432498e-09 -3.87244035e-09 -2.13778966e-04] Minimization converged after 188 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 84 steps. Final forces: [[-1.88160764e-04 2.97000664e-04 -1.95202830e-04] [ 1.37130246e-05 3.21593911e-04 -3.94028083e-05] [ 3.85607042e-05 4.29985627e-05 -4.77433644e-04] [ 1.60932907e-04 -6.25086508e-04 5.88818548e-04] [-1.53955946e-04 1.47560041e-04 -6.05245856e-04] [ 1.14711990e-04 -2.67997651e-05 4.89736844e-05] [-1.60372658e-04 -1.96023465e-04 -1.78997635e-04] [ 1.78423579e-04 -1.04194744e-04 -4.25465097e-04] [-1.52671256e-04 -1.32319710e-05 2.08549205e-04] [ 1.82990488e-04 1.97646150e-04 3.22840104e-06] [-7.43808080e-04 -9.92998449e-05 2.82265200e-04] [ 5.19841554e-04 4.92482154e-04 9.94558745e-04] [ 6.03262777e-04 -7.20348191e-04 -1.04455144e-03] [ 7.54525065e-04 -6.93924476e-05 1.04150662e-03] [-8.13301297e-04 -6.78232397e-04 -3.18161559e-05] [-3.67439255e-04 1.01324458e-03 2.34981742e-04] [ 1.08270724e-05 9.43111051e-04 2.26321556e-05] [-4.18560828e-04 -4.67199956e-04 8.82159224e-05] [ 1.89425240e-04 4.65642830e-04 3.67705390e-05] [ 2.33575340e-04 -9.24409635e-04 -3.68388976e-05] [-4.38230619e-05 1.17642658e-04 1.98449373e-04] [ 8.53228309e-04 -6.09173051e-04 -3.39491495e-04] [-5.48513546e-05 4.22892518e-04 -4.58495008e-04] [-7.57073549e-04 7.15768548e-05 8.39907283e-05]] Final stress: [ 3.58025342e-02 3.53148070e-02 1.44524013e-01 2.93989625e-06 -2.00291817e-06 -4.87460026e-04] Minimization converged after 6 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 3.34762232e-09 -8.10867314e-06 1.16245733e-04] [ 1.75238733e-09 3.87663260e-05 -1.22429030e-04] [ 5.42432978e-09 8.10871138e-06 -1.16620559e-04] [ 3.97374336e-09 -3.87763158e-05 1.22272303e-04] [ 7.07039485e-09 3.36531134e-07 8.45310330e-08] [-2.89448771e-07 -1.73221364e-07 8.02598315e-08] [ 2.75103444e-07 -1.56751673e-07 7.07631420e-08] [ 5.12477086e-09 -3.41174552e-07 8.79313715e-08] [ 3.10213417e-07 1.66700445e-07 8.93355838e-08] [-3.23033684e-07 1.80100349e-07 9.98905534e-08] [ 7.10398795e-10 8.55181281e-05 2.32035346e-05] [-1.12206772e-05 1.06958494e-04 -7.73400513e-06] [ 1.12182731e-05 1.06960662e-04 -7.72986920e-06] [ 8.75921169e-10 -8.58247710e-05 -2.31826183e-05] [ 1.14822841e-05 -1.06807260e-04 7.74201667e-06] [-1.14850162e-05 -1.06804458e-04 7.74148369e-06] [ 6.47736670e-10 -4.57056371e-05 -1.24011930e-04] [ 5.64946367e-10 1.61734505e-04 -1.10193909e-04] [ 8.27688085e-10 4.57049043e-05 1.24015609e-04] [ 7.59308200e-10 -1.61736398e-04 1.10186696e-04] [ 2.97261771e-10 1.74363995e-04 -9.13580221e-06] [ 2.36501540e-10 -8.48552088e-05 -1.73281765e-05] [ 4.00139052e-10 -1.74364080e-04 9.12653499e-06] [ 2.88540802e-10 8.48548930e-05 1.73192780e-05]] Final stress: [ 3.83730781e-04 3.87278289e-04 7.25508389e-04 -2.65741659e-04 -1.22982603e-11 -1.50476820e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 5.60686719e-10 -3.30146531e-05 -1.34012931e-04] [ 5.76710283e-09 2.50383083e-06 1.28144215e-04] [ 6.79203861e-09 3.30149380e-05 1.34236403e-04] [ 1.18611743e-08 -2.51332375e-06 -1.27898537e-04] [ 6.20436633e-09 -5.56588968e-08 -3.85951208e-08] [ 6.12322962e-08 2.35522303e-08 -4.08770109e-08] [-7.94014507e-08 4.11169418e-08 -5.78327666e-08] [ 1.37162348e-08 -6.85379531e-10 -2.29283516e-08] [-1.58543695e-08 -1.57596600e-08 -3.21960250e-08] [-9.29211930e-09 1.46276867e-08 -1.77532835e-08] [ 3.86820165e-09 8.31513945e-05 -2.11376618e-05] [-1.35799577e-05 1.07334531e-04 9.26663730e-06] [ 1.35715141e-05 1.07343821e-04 9.26682379e-06] [ 3.55530172e-09 -8.30239457e-05 2.10619258e-05] [ 1.34735963e-05 -1.07404747e-04 -9.33823166e-06] [-1.34815793e-05 -1.07395966e-04 -9.35143281e-06] [ 6.90526802e-10 -1.60117170e-04 -1.08303436e-04] [ 1.05059877e-09 4.39850802e-05 -1.22849718e-04] [ 1.24575061e-09 1.60115157e-04 1.08294240e-04] [ 1.57154301e-09 -4.39848451e-05 1.22845189e-04] [ 4.82863138e-10 8.46963943e-05 -1.84139990e-05] [ 7.20738054e-10 -1.73888055e-04 -9.07608781e-06] [ 6.81359065e-10 -8.46969246e-05 1.84069331e-05] [ 9.73740866e-10 1.73887290e-04 9.06985286e-06]] Final stress: [ 3.83689211e-04 3.87377965e-04 7.25443069e-04 2.65723160e-04 -3.52354442e-11 2.77131088e-13] Minimization converged after 51 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 3.43368369e-05 8.37036892e-05 1.96746747e-05] [ 3.42402187e-05 -8.37726864e-05 3.78161093e-06] [-3.42845314e-05 -8.36920033e-05 -2.41138404e-05] [-3.42848644e-05 8.37211234e-05 -7.97527745e-06] [-1.11772979e-07 -5.35831100e-06 -6.44227735e-07] [ 4.83797842e-06 2.82395884e-06 -7.40510010e-07] [-4.63961372e-06 2.58074099e-06 -6.49015763e-07] [ 1.67121141e-07 -6.75369184e-06 2.02160786e-06] [ 5.69634948e-06 3.19522437e-06 1.94814341e-06] [-5.98148381e-06 3.55338390e-06 2.06903214e-06] [-6.17164508e-09 -1.14767723e-04 3.59851585e-06] [-9.00812504e-06 -5.63904446e-05 -3.41706455e-05] [ 9.06891259e-06 -5.64325066e-05 4.12448029e-05] [ 1.02966091e-08 1.30528911e-04 -2.20242072e-06] [-4.62938324e-06 4.85163992e-05 3.55818595e-05] [ 4.57971030e-06 4.85573858e-05 -3.99232586e-05] [ 7.37574135e-05 1.12868696e-04 1.51898358e-04] [ 7.38058565e-05 -1.12876495e-04 1.51784356e-04] [-7.37935942e-05 -1.12876423e-04 -1.52030130e-04] [-7.37597772e-05 1.12880434e-04 -1.51407332e-04] [ 6.86296722e-05 -1.14413257e-04 5.78524707e-05] [ 6.86233415e-05 1.14405034e-04 5.78051777e-05] [-6.86178889e-05 1.14409948e-04 -5.79462420e-05] [-6.86365012e-05 -1.14411386e-04 -5.74577088e-05]] Final stress: [-3.49968780e-04 -3.63141033e-04 -6.88324259e-04 -3.69932779e-10 -2.95611140e-04 -4.91003817e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-2.12367583e-05 5.64424139e-05 2.90135163e-06] [-2.11738679e-05 -5.62387485e-05 2.70053729e-06] [ 2.12368418e-05 -5.63639985e-05 -1.69119134e-05] [ 2.12775976e-05 5.64742833e-05 -9.27044128e-06] [ 5.37929938e-08 2.53035923e-06 1.48360563e-06] [-2.73611837e-06 -1.44282390e-06 1.79795349e-06] [ 2.59667608e-06 -1.29953390e-06 1.66451671e-06] [-9.32431278e-09 -5.14044414e-07 1.64512121e-06] [ 1.73996703e-07 2.20850681e-07 1.54254856e-06] [-1.44471847e-07 1.92658957e-07 1.52075876e-06] [ 1.11869432e-08 -9.29058521e-05 2.26645542e-06] [ 1.67505621e-05 -7.49327535e-05 2.15020630e-05] [-1.68061525e-05 -7.48882487e-05 -1.67934521e-05] [ 9.84825860e-09 8.00140921e-05 9.20100202e-07] [-5.82510214e-06 8.12935514e-05 -1.81988838e-05] [ 5.79229164e-06 8.13241656e-05 2.00395000e-05] [-6.72201036e-05 1.07736543e-04 1.44261036e-04] [-6.72215141e-05 -1.07701471e-04 1.43962591e-04] [ 6.72286989e-05 -1.07695446e-04 -1.43763825e-04] [ 6.72312149e-05 1.07722934e-04 -1.43881927e-04] [-6.66510975e-05 -1.15127651e-04 5.38813497e-05] [-6.66587731e-05 1.15144642e-04 5.37365886e-05] [ 6.66629133e-05 1.15140916e-04 -5.34960823e-05] [ 6.66576624e-05 -1.15126838e-04 -5.35095516e-05]] Final stress: [-3.50773717e-04 -3.62371853e-04 -6.87877607e-04 2.48078725e-10 2.93166657e-04 8.93213072e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 5.87056700e-05 -5.84804085e-05 -1.56850937e-04] [-5.87058498e-05 5.84803991e-05 -1.56996179e-04] [-5.87057224e-05 5.84804358e-05 1.56840210e-04] [ 5.87054949e-05 -5.84804401e-05 1.56564146e-04] [-1.06874770e-09 3.52341122e-07 1.07148344e-07] [-3.04334957e-07 -1.75116693e-07 1.06995944e-07] [ 3.05784250e-07 -1.77190082e-07 1.07216769e-07] [-1.69504727e-11 -6.63592625e-09 2.48288434e-09] [ 5.74862757e-09 3.33561678e-09 2.49197962e-09] [-5.68802139e-09 3.28069760e-09 2.42644918e-09] [-1.30297452e-04 -3.70530490e-05 7.27548716e-09] [ 9.75811863e-06 5.04302371e-05 7.26252042e-09] [-9.08152724e-05 -7.11097864e-05 7.24997352e-09] [ 1.30297410e-04 3.71089025e-05 3.06912976e-08] [-9.80642197e-06 -5.04581053e-05 3.07083677e-08] [ 9.08636808e-05 7.10818061e-05 3.06466078e-08] [-1.16825734e-04 -4.29067609e-06 1.33002457e-04] [ 1.16825731e-04 4.29067382e-06 1.33004879e-04] [ 1.16825776e-04 4.29066894e-06 -1.33001457e-04] [-1.16825756e-04 -4.29067075e-06 -1.33002042e-04] [ 1.60825793e-04 -5.03336998e-06 -2.38588811e-04] [-1.60825844e-04 5.03336895e-06 -2.38591720e-04] [-1.60825785e-04 5.03337079e-06 2.38590997e-04] [ 1.60825740e-04 -5.03337153e-06 2.38585860e-04]] Final stress: [ 3.87088632e-04 3.86753705e-04 7.06186269e-04 -1.89549278e-14 -1.84266218e-13 3.14979053e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-4.94511443e-05 -5.98780912e-05 -2.77290687e-04] [ 4.94511862e-05 5.98781385e-05 -2.77319792e-04] [ 4.94514951e-05 5.98780144e-05 2.77617170e-04] [-4.94514370e-05 -5.98779444e-05 2.77567441e-04] [-5.98486945e-10 -1.86385182e-07 -5.79895553e-08] [ 1.61722756e-07 9.37404814e-08 -5.79382656e-08] [-1.60848780e-07 9.25435253e-08 -5.77742665e-08] [ 9.55734752e-10 2.90586510e-07 -8.58111183e-08] [-2.52550066e-07 -1.46256060e-07 -8.59512593e-08] [ 2.51171428e-07 -1.44356387e-07 -8.56951644e-08] [ 2.14529026e-04 -5.11604912e-06 -2.58827693e-08] [ 7.09595902e-06 -1.51727514e-04 -2.57627818e-08] [-7.30346994e-05 1.68748104e-04 -2.57760241e-08] [-2.14529182e-04 5.07796414e-06 -2.22064481e-08] [-7.06294916e-06 1.51746679e-04 -2.20645316e-08] [ 7.30018610e-05 -1.68729213e-04 -2.20795108e-08] [ 1.37144796e-04 -2.56392215e-05 9.67298414e-05] [-1.37144807e-04 2.56392357e-05 9.67295181e-05] [-1.37144778e-04 2.56392379e-05 -9.67316011e-05] [ 1.37144764e-04 -2.56392219e-05 -9.67323981e-05] [-1.57537206e-04 8.74152526e-08 -3.16910826e-04] [ 1.57537235e-04 -8.74113397e-08 -3.16912163e-04] [ 1.57537339e-04 -8.74167141e-08 3.16915058e-04] [-1.57537311e-04 8.74213544e-08 3.16913370e-04]] Final stress: [ 3.85665873e-04 3.83500697e-04 7.09457286e-04 -6.27558466e-14 1.68721041e-14 -3.13135888e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.58300046e-04 -9.84404777e-05 2.22526939e-05] [-1.58300332e-04 9.84404696e-05 2.19941182e-05] [-1.58300216e-04 9.84404703e-05 -2.20812511e-05] [ 1.58300009e-04 -9.84404954e-05 -2.23159666e-05] [-4.60527959e-10 1.61505186e-07 5.85699503e-08] [-1.39577087e-07 -8.02903762e-08 5.85028728e-08] [ 1.40284284e-07 -8.12186502e-08 5.86367959e-08] [-8.93983516e-11 4.13470365e-08 -2.15229675e-08] [-3.56553241e-08 -2.05628423e-08 -2.14731604e-08] [ 3.58276850e-08 -2.07598923e-08 -2.15190056e-08] [-9.07918750e-05 -1.30236940e-04 8.65382784e-09] [-2.29109129e-04 1.53936013e-05 8.62365334e-09] [-7.00967049e-05 3.88380335e-05 8.65697233e-09] [ 9.07909585e-05 1.30549154e-04 4.38851882e-09] [ 2.28839385e-04 -1.55488318e-05 4.37587720e-09] [ 7.03676403e-05 -3.89950001e-05 4.34167087e-09] [-9.17104448e-05 -2.33521068e-05 -1.08237432e-04] [ 9.17103957e-05 2.33521094e-05 -1.08232873e-04] [ 9.17104058e-05 2.33521136e-05 1.08233298e-04] [-9.17104529e-05 -2.33521126e-05 1.08238407e-04] [ 1.17995478e-04 1.03380327e-05 2.05360272e-04] [-1.17995486e-04 -1.03380362e-05 2.05359148e-04] [-1.17995461e-04 -1.03380359e-05 -2.05359962e-04] [ 1.17995453e-04 1.03380319e-05 -2.05360687e-04]] Final stress: [-3.60374766e-04 -3.62469714e-04 -6.91852932e-04 5.07660009e-14 -1.63263986e-13 3.11145226e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-1.67509969e-04 -1.80214999e-05 2.35124030e-05] [ 1.67510096e-04 1.80215272e-05 2.33343755e-05] [ 1.67510132e-04 1.80215229e-05 -2.33070356e-05] [-1.67509981e-04 -1.80214864e-05 -2.34713925e-05] [ 7.62163423e-12 1.68288307e-08 1.37148248e-08] [-1.45680512e-08 -8.42975884e-09 1.37198140e-08] [ 1.45337649e-08 -8.40226189e-09 1.37254743e-08] [ 1.70174954e-10 6.89662785e-08 -3.01473340e-08] [-6.01005234e-08 -3.46897933e-08 -3.02245682e-08] [ 5.98405195e-08 -3.43435889e-08 -3.02015002e-08] [ 9.99561771e-05 8.58805459e-05 -1.90837011e-09] [ 2.18689101e-04 -3.02964941e-06 -1.88055750e-09] [ 8.50316202e-05 -1.85749510e-05 -1.87143736e-09] [-9.99553098e-05 -8.55958663e-05 -4.35969710e-09] [-2.18936262e-04 2.88648048e-06 -4.30451937e-09] [-8.47855540e-05 1.84334179e-05 -4.33290128e-09] [ 8.28388143e-05 -2.13154490e-05 -9.90784693e-05] [-8.28387669e-05 2.13154598e-05 -9.90742079e-05] [-8.28387598e-05 2.13154496e-05 9.90736951e-05] [ 8.28388124e-05 -2.13154379e-05 9.90782703e-05] [-1.16134935e-04 -3.93205489e-06 2.14657472e-04] [ 1.16134917e-04 3.93205804e-06 2.14657766e-04] [ 1.16134928e-04 3.93205711e-06 -2.14657665e-04] [-1.16134944e-04 -3.93205373e-06 -2.14657141e-04]] Final stress: [-3.60072515e-04 -3.62099103e-04 -6.92471623e-04 -2.57655348e-14 -1.09746206e-13 -3.10825981e-04] Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-4.76358657e-04 6.42853335e-04 -8.24452234e-04] [-5.03616696e-05 1.19130601e-04 6.43243231e-04] [ 1.12877528e-03 6.17746791e-04 9.33246742e-04] [-8.59902233e-05 3.85809597e-04 -8.22524848e-04] [-1.02857408e-04 -9.14024146e-05 9.00815081e-05] [ 7.28552326e-05 -6.95366612e-04 -1.28988660e-03] [ 6.60460100e-04 1.69015928e-04 4.86146770e-04] [ 1.21614026e-03 -5.93828149e-04 1.12367183e-03] [-5.18776306e-05 -5.79683889e-05 1.04789406e-04] [ 8.70438242e-05 2.46620956e-04 -5.22788430e-04] [ 2.14211637e-03 9.60597634e-04 1.57796161e-04] [-2.23058021e-03 -1.68041436e-03 -5.42409635e-04] [-1.27709054e-03 9.22707137e-04 -1.87506535e-04] [ 1.14319081e-03 1.01671844e-04 -1.32670282e-04] [-1.33340861e-04 -7.92959597e-04 -2.19950419e-04] [-7.39301563e-04 1.07620867e-03 5.78026381e-04] [-1.77155232e-04 3.66425991e-05 3.28693611e-04] [-8.42330548e-04 -4.68510602e-04 -1.35581357e-04] [ 4.32008132e-04 -3.71488478e-04 1.91268041e-04] [ 7.38014792e-05 -6.77314914e-04 5.22538736e-04] [-8.97304032e-04 -5.27275278e-04 -5.69280270e-05] [ 3.57214581e-04 5.87931786e-04 -2.99498184e-04] [-1.94296123e-04 1.33050652e-04 4.20634109e-04] [-5.47613738e-05 -4.34587389e-05 -5.45939974e-04]] Final stress: [ 3.18812987e-02 3.37346970e-02 1.34824195e-01 2.34021831e-04 1.91853197e-04 -4.66529912e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.28261594e-05 9.32184827e-06 1.46645765e-05] [ 7.22815367e-05 4.96777185e-05 9.12170272e-06] [ 2.97027392e-05 -2.01278334e-05 -2.78792908e-05] [ 5.30778965e-05 3.89985474e-05 -1.48395473e-05] [ 1.82860518e-06 4.83212972e-05 6.78213251e-05] [-4.49123014e-05 8.43986305e-05 -5.39472105e-05] [-1.08834776e-05 -3.34142454e-07 5.66357231e-05] [-5.92472817e-05 4.02465308e-05 -9.78403858e-05] [-1.29136592e-05 -1.66088260e-06 9.87557491e-05] [ 1.96235887e-05 2.38753117e-05 3.88135177e-05] [-6.99112524e-06 -2.12246320e-05 -3.26577763e-05] [-1.19802452e-05 -5.12995813e-06 -3.37795299e-06] [ 1.24758723e-05 -3.04539477e-05 -7.31973280e-07] [ 2.86785987e-05 1.61891900e-06 -4.63601704e-05] [ 1.34449950e-05 6.09534353e-06 4.00556541e-05] [-4.03246220e-05 -4.06381502e-05 2.30925233e-05] [ 2.68673801e-05 -1.51676820e-05 3.03106000e-05] [ 2.14703129e-05 -1.67618107e-05 -2.31107195e-05] [ 2.77235152e-05 -1.00049939e-05 -2.96105031e-05] [ 4.05393450e-05 -1.01663876e-05 1.49217124e-05] [-5.65917200e-05 -5.94825078e-06 -4.17839444e-06] [ 2.15988752e-05 -2.41296553e-06 -1.49358446e-05] [-1.22963404e-04 -4.90475336e-05 3.91760564e-05] [-1.53315836e-05 -7.34749764e-05 -8.38993715e-05]] Final stress: [ 0.03277286 0.03332525 0.1352037 0.00109733 -0.00072858 -0.00046996] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[-2.64884521e-04 6.97420266e-04 1.93749228e-02] [-2.30363133e-04 -1.89029702e-03 1.44720346e-02] [ 1.68606924e-03 -9.39397789e-04 1.96211721e-02] [ 8.69204726e-04 1.68713599e-03 1.41812785e-02] [-4.57272211e-05 2.61587681e-03 -3.59253058e-03] [-1.75824475e-03 -1.18397306e-03 -3.78691207e-03] [ 1.65673863e-03 -1.17422691e-03 -4.02996128e-03] [ 1.06462526e-03 -2.59804680e-03 -4.66470332e-03] [ 1.44126306e-03 1.05416754e-04 -5.31073104e-03] [-3.73277983e-03 2.66653128e-03 -3.64370142e-03] [ 6.83178799e-03 5.46754731e-03 -6.35992679e-03] [-8.31638834e-03 1.64197778e-03 -5.72438994e-03] [ 2.01129204e-03 -7.31251587e-03 -5.98147248e-03] [-5.73710384e-03 5.95420031e-03 -6.16387839e-03] [-2.93488834e-03 -8.59469013e-03 -6.77849242e-03] [ 6.89657426e-03 3.00116171e-03 -6.50472489e-03] [ 3.70767850e-04 1.71779247e-03 7.78550287e-04] [ 1.54654162e-04 -1.91789082e-03 2.52420572e-04] [-4.27193807e-04 -1.81208891e-03 -2.14045212e-03] [ 1.11223906e-04 1.87427059e-03 -1.28550630e-03] [ 3.46349240e-04 7.87050907e-04 1.65598144e-05] [-3.59580741e-04 -7.93761875e-04 2.14380292e-04] [-5.39941427e-05 -7.98321222e-04 -1.46540880e-03] [ 4.20598297e-04 7.98828236e-04 -1.47852712e-03]] Final stress: [-2.52548142e-04 -1.71569609e-04 -2.37713520e-04 4.88014421e-04 -3.60048571e-04 -9.18525356e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.03853181e-04 -1.38223842e-04 1.72301926e-04] [-2.77697072e-04 4.24903380e-05 -5.10485628e-05] [-3.23172827e-05 -1.25750087e-04 6.57271450e-05] [-2.18135649e-04 1.58211123e-04 -9.55316298e-05] [-3.75454659e-05 -1.25506086e-04 -1.64393255e-04] [ 1.18719675e-04 5.92723888e-06 -5.17692172e-05] [-6.92969170e-06 -1.05054191e-04 -2.32484957e-04] [ 1.13767187e-04 -1.63545136e-04 -7.30592241e-06] [-1.70321842e-05 9.98026095e-05 -9.36753756e-05] [-1.60449386e-04 7.57313899e-05 -1.39477712e-05] [-2.10768227e-04 -5.50923675e-05 -6.69352265e-05] [ 4.81121807e-05 -1.41547516e-05 1.01003878e-04] [ 1.64775150e-04 -2.71750069e-05 7.70360116e-05] [-1.96461188e-04 -8.50871173e-05 -4.25673526e-05] [-3.29401890e-05 -9.13134749e-05 1.51389294e-04] [ 1.42731887e-04 5.25897677e-05 -2.69057548e-05] [ 1.33497023e-04 8.21769840e-05 -6.44225041e-05] [ 5.90027228e-05 5.99453752e-05 1.14540970e-05] [ 1.59106374e-04 1.85270436e-04 -5.56722357e-05] [-1.39431679e-04 5.85014120e-05 8.61319654e-05] [ 1.29190104e-04 4.22724000e-05 -4.99259558e-05] [-3.45897584e-05 5.92558729e-05 9.76380122e-05] [ 9.74733793e-05 -9.96802836e-07 2.13522635e-04] [-5.93109034e-06 9.72391594e-06 4.03807562e-05]] Final stress: [ 0.03327776 0.03234558 0.13481832 -0.00022698 -0.00024019 0.00080556] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.64185279e-04 3.84992294e-03 -3.33558221e-03] [-1.10582338e-03 -4.51273274e-03 4.02005447e-03] [ 5.64185373e-04 -3.84992296e-03 3.33554994e-03] [ 1.10582332e-03 4.51273259e-03 -4.02012828e-03] [-1.20313060e-10 4.68791545e-08 1.58584306e-08] [-4.03612057e-08 -2.32879746e-08 1.56335555e-08] [ 4.05560261e-08 -2.35254318e-08 1.56263054e-08] [ 1.43614226e-10 -3.34807215e-08 9.65559299e-09] [ 2.89410088e-08 1.65965617e-08 9.78714054e-09] [-2.91958771e-08 1.69080798e-08 9.88046547e-09] [-5.31263611e-03 9.08181922e-05 -1.82093866e-03] [ 6.12746113e-04 -2.07192664e-03 -2.36707656e-03] [ 3.11435493e-03 5.91540803e-03 -1.75620492e-04] [ 5.31263602e-03 -9.07870117e-05 1.82094841e-03] [-6.12772879e-04 2.07191119e-03 2.36708624e-03] [-3.11432806e-03 -5.91542362e-03 1.75630169e-04] [ 4.91961003e-04 2.26920211e-04 -1.17256232e-04] [-7.63795202e-04 2.86378038e-04 1.25442107e-04] [-4.91960999e-04 -2.26920260e-04 1.17256310e-04] [ 7.63795192e-04 -2.86378027e-04 -1.25441074e-04] [ 5.62149224e-05 -8.44812001e-04 -1.55715741e-04] [-2.19117498e-04 -1.58286975e-03 -3.22210072e-05] [-5.62148885e-05 8.44812025e-04 1.55715455e-04] [ 2.19117467e-04 1.58286971e-03 3.22207146e-05]] Final stress: [ 2.20293364e-05 -9.35596848e-07 2.07637035e-05 -2.64397905e-04 -1.50713942e-06 2.84514504e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.64166711e-04 3.85024672e-03 -3.33595616e-03] [ 1.10589634e-03 -4.51315773e-03 4.02047740e-03] [-5.64166782e-04 -3.85024676e-03 3.33589220e-03] [-1.10589637e-03 4.51315770e-03 -4.02047100e-03] [-8.35987547e-11 -2.09161312e-08 -4.77590562e-09] [ 1.81204063e-08 1.05377925e-08 -4.71605788e-09] [-1.79851168e-08 1.03573668e-08 -4.67742883e-09] [-1.93524517e-10 -6.29527119e-08 1.81421769e-08] [ 5.47651636e-08 3.16925689e-08 1.84867138e-08] [-5.44677095e-08 3.12828354e-08 1.84190070e-08] [ 5.31281289e-03 9.09017982e-05 -1.82110677e-03] [-3.11447991e-03 5.91569057e-03 -1.75735789e-04] [-6.12598970e-04 -2.07194159e-03 -2.36719842e-03] [-5.31281279e-03 -9.08782509e-05 1.82111220e-03] [ 3.11445957e-03 -5.91570243e-03 1.75741203e-04] [ 6.12619206e-04 2.07192996e-03 2.36720384e-03] [-4.92035130e-04 2.26938360e-04 -1.17272251e-04] [ 7.63852305e-04 2.86396513e-04 1.25448383e-04] [ 4.92035137e-04 -2.26938381e-04 1.17272210e-04] [-7.63852284e-04 -2.86396511e-04 -1.25447699e-04] [-5.62106508e-05 -8.44935498e-04 -1.55738339e-04] [ 2.19104266e-04 -1.58303736e-03 -3.22260904e-05] [ 5.62105988e-05 8.44935535e-04 1.55737052e-04] [-2.19104290e-04 1.58303735e-03 3.22271494e-05]] Final stress: [ 2.20299578e-05 -9.37395028e-07 2.07635678e-05 -2.64396468e-04 1.50608387e-06 -2.84511010e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.10604946e-03 4.51371199e-03 4.02032164e-03] [ 5.64335440e-04 -3.85078760e-03 -3.33583981e-03] [-1.10604946e-03 -4.51371207e-03 -4.02032865e-03] [-5.64335564e-04 3.85078795e-03 3.33569650e-03] [-2.01705154e-10 7.40462274e-08 2.64869713e-08] [-6.42773881e-08 -3.68871157e-08 2.69632719e-08] [ 6.46111626e-08 -3.73013301e-08 2.70314534e-08] [ 1.40137424e-10 -4.00269566e-08 9.43560474e-09] [ 3.44583668e-08 1.98722330e-08 9.26253307e-09] [-3.46392161e-08 2.01262741e-08 9.28896694e-09] [-5.31306513e-03 9.09229390e-05 1.82110354e-03] [ 6.12544104e-04 -2.07185906e-03 2.36733313e-03] [ 3.11470495e-03 5.91612402e-03 1.75497637e-04] [ 5.31306476e-03 -9.08097078e-05 -1.82108989e-03] [-6.12642082e-04 2.07180270e-03 -2.36731937e-03] [-3.11460650e-03 -5.91618108e-03 -1.75483915e-04] [ 7.63902267e-04 -2.86404838e-04 1.25453534e-04] [-4.92050383e-04 -2.26946461e-04 -1.17262917e-04] [-7.63902290e-04 2.86404976e-04 -1.25454504e-04] [ 4.92050333e-04 2.26946378e-04 1.17265448e-04] [ 2.19112914e-04 1.58310588e-03 -3.22407786e-05] [-5.62005095e-05 8.44942826e-04 -1.55747015e-04] [-2.19112868e-04 -1.58310593e-03 3.22401906e-05] [ 5.62004719e-05 -8.44942751e-04 1.55746758e-04]] Final stress: [ 2.20318656e-05 -9.39657511e-07 2.07635878e-05 2.64395514e-04 1.50812748e-06 2.84509382e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.10603258e-03 4.51357836e-03 4.02081932e-03] [-5.64341814e-04 -3.85066170e-03 -3.33626543e-03] [ 1.10603252e-03 -4.51357838e-03 -4.02086219e-03] [ 5.64341844e-04 3.85066189e-03 3.33621178e-03] [-1.32492251e-11 5.31468525e-09 5.35912786e-09] [-4.66820187e-09 -2.66571449e-09 5.45793957e-09] [ 4.67563555e-09 -2.70208234e-09 5.47015169e-09] [-2.22732438e-10 -6.63724753e-08 1.77135646e-08] [ 5.75207826e-08 3.33793637e-08 1.74945688e-08] [-5.71862770e-08 3.29417356e-08 1.74510955e-08] [ 5.31307498e-03 9.08264826e-05 1.82127001e-03] [-3.11472824e-03 5.91612475e-03 1.75673808e-04] [-6.12582046e-04 -2.07190352e-03 2.36751784e-03] [-5.31307465e-03 -9.07386349e-05 -1.82126106e-03] [ 3.11465191e-03 -5.91616904e-03 -1.75664815e-04] [ 6.12657987e-04 2.07185985e-03 -2.36750882e-03] [-7.63891681e-04 -2.86403193e-04 1.25466399e-04] [ 4.92033224e-04 -2.26939503e-04 -1.17272802e-04] [ 7.63891705e-04 2.86403280e-04 -1.25467231e-04] [-4.92033181e-04 2.26939440e-04 1.17274687e-04] [-2.19120006e-04 1.58309228e-03 -3.22335237e-05] [ 5.62027264e-05 8.44929810e-04 -1.55754431e-04] [ 2.19119938e-04 -1.58309232e-03 3.22320783e-05] [-5.62027382e-05 -8.44929737e-04 1.55755431e-04]] Final stress: [ 2.20316645e-05 -9.39315539e-07 2.07635748e-05 2.64395833e-04 -1.50847614e-06 -2.84510138e-04] Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.51718276e-05 -1.64919595e-05 -2.35043572e-05] [ 1.93281121e-05 -3.11968467e-05 -5.63782952e-05] [ 3.46033278e-05 2.46379899e-07 2.19539492e-07] [-4.90493268e-06 1.41272355e-06 2.95957463e-05] [-2.75394477e-05 -5.57970168e-05 3.20544197e-06] [ 4.26869123e-05 -2.08724900e-06 3.60733722e-05] [-2.49812101e-05 8.93656862e-06 1.51065180e-05] [-1.70813077e-05 2.37365123e-05 -3.24972903e-05] [-3.98831898e-06 -1.88026236e-05 6.91996122e-06] [-1.26071879e-05 -6.06866415e-06 -3.11859832e-05] [-3.04907193e-05 4.97672852e-05 1.95274190e-05] [ 6.04272074e-06 1.39433760e-05 -1.94704560e-05] [-3.02427160e-05 -2.43850608e-05 2.53992245e-05] [ 1.18810181e-06 3.94824773e-06 6.25715355e-07] [ 4.97375076e-05 -8.02814410e-07 -4.18635669e-05] [-1.89518978e-05 -1.01491335e-05 4.00736725e-05] [-4.12535885e-05 -2.90881099e-05 -2.79842446e-05] [ 1.55752062e-05 2.37928000e-05 -4.35756875e-05] [-8.20705987e-06 -1.42995271e-05 1.27714674e-05] [-8.91981857e-06 3.99008194e-06 -1.42318472e-06] [-9.80816203e-06 1.96487503e-05 4.62222551e-05] [ 2.72805050e-05 3.55683495e-05 1.47154408e-05] [ 4.83986971e-06 1.34548578e-05 7.04181389e-06] [ 2.25222762e-05 1.07230728e-05 2.03854778e-05]] Final stress: [ 3.35750414e-02 3.24533128e-02 1.35122105e-01 1.13017387e-05 -7.69789161e-04 5.10584394e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-6.23699343e-03 -9.90181582e-03 1.10855885e-02] [-3.14907807e-03 -5.23243467e-02 4.51625438e-03] [ 6.23405497e-03 9.90118624e-03 -1.13344554e-02] [ 3.14973600e-03 5.23242559e-02 -4.40463773e-03] [-5.24869939e-08 -5.61922703e-05 -1.99515349e-05] [ 4.93650871e-05 2.84597989e-05 -1.97525533e-05] [-4.89811569e-05 2.81852006e-05 -2.11583653e-05] [-9.92285868e-07 -1.65881849e-04 5.39880154e-05] [ 1.45931371e-04 8.47738217e-05 5.63435487e-05] [-1.42674667e-04 8.17644554e-05 5.20308715e-05] [-5.09125091e-02 -2.29391497e-03 9.96884411e-03] [ 2.97298405e-03 -1.58186955e-02 -5.70110473e-02] [ 3.74405289e-02 3.02987859e-02 -1.25163886e-02] [ 5.09121045e-02 2.15888951e-03 -9.95750713e-03] [-2.85518768e-03 1.58871032e-02 5.70240665e-02] [-3.75569259e-02 -3.02321024e-02 1.25277365e-02] [ 5.03024059e-03 1.58313891e-03 1.54212862e-03] [ 1.03910582e-02 4.00949545e-03 7.39869451e-03] [-5.02979480e-03 -1.58309721e-03 -1.53947717e-03] [-1.03916751e-02 -4.00953883e-03 -7.40009171e-03] [ 3.48353665e-03 1.03297057e-02 -6.07280028e-03] [-4.02945298e-03 3.21960320e-03 -1.48580285e-02] [-3.48452765e-03 -1.03300616e-02 6.07011521e-03] [ 4.02930496e-03 -3.21970019e-03 1.48595056e-02]] Final stress: [-9.35402738e-05 -6.25002853e-05 -4.38075681e-05 -2.13637004e-04 -1.37935225e-03 -1.27948601e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.69836364e-05 -5.38841772e-05 1.04716708e-04] [-9.14591494e-05 3.35394710e-05 5.19723336e-05] [ 5.58450035e-05 -3.22783594e-05 2.19234429e-05] [-1.39220826e-05 2.62527803e-05 -2.86643296e-05] [-8.10174770e-06 5.23053062e-05 -1.20439428e-04] [-5.46218865e-05 2.24520908e-05 1.63650531e-05] [ 8.90792182e-05 -2.45686975e-05 -3.60914463e-05] [-3.17456227e-05 -8.01906668e-05 -9.45813234e-05] [-8.53829155e-05 6.37442081e-05 5.60020712e-05] [ 3.85548945e-05 3.59032926e-05 -6.11836639e-06] [-1.95078511e-05 3.27186257e-05 1.23231205e-05] [-7.03488238e-06 -8.68243458e-05 1.31124490e-04] [ 3.83360788e-05 2.10524487e-05 7.85802803e-06] [ 1.26635217e-05 -5.47632722e-05 5.24410183e-05] [-1.25522479e-04 -7.87838350e-05 1.19148208e-04] [ 8.89858046e-06 3.60521792e-05 3.42587439e-06] [ 1.02787956e-05 3.41530774e-05 -8.83981704e-05] [ 1.01087969e-04 1.07491530e-05 -6.49013069e-05] [ 5.89738361e-05 -3.76279466e-05 -8.03060072e-05] [ 9.48296579e-05 1.45345523e-05 -6.70464485e-07] [-1.06078394e-04 -2.21146424e-06 3.98036703e-05] [ 4.53030089e-05 5.18926943e-05 -7.32285175e-05] [-1.00622311e-04 1.61541119e-06 2.99694414e-05] [ 6.31651201e-05 1.41674740e-05 -5.36741002e-05]] Final stress: [ 3.33103181e-02 3.23916035e-02 1.34848973e-01 -1.49887493e-05 -2.26465381e-04 1.32132931e-03] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-4.11389663e-05 -2.85238695e-05 7.45171661e-05] [ 9.67658794e-07 1.51896101e-05 -1.61895098e-05] [ 1.09936512e-05 -6.15903550e-06 2.62350856e-10] [-4.66890788e-06 -1.15036344e-05 -2.18717727e-06] [-1.86466683e-05 -1.98609560e-05 -2.92992666e-05] [ 1.08586052e-04 6.12126673e-05 -7.47903753e-07] [-2.81330660e-05 1.76639433e-05 -3.46912168e-05] [ 1.94377239e-05 -8.40883209e-05 7.14190347e-06] [-5.83500564e-05 1.47544166e-05 1.57190132e-05] [ 3.37233752e-05 9.36240850e-06 1.74096272e-05] [ 1.54900465e-05 1.02530493e-05 9.37491338e-06] [-2.72153089e-05 1.89044050e-05 -3.13011870e-05] [-4.11777261e-05 -3.14597311e-05 -2.60285946e-05] [-4.26871500e-06 -4.20343079e-05 -2.66581956e-05] [ 1.22482228e-05 4.00824401e-05 -4.34016517e-05] [ 2.00868508e-07 4.13906581e-05 1.12285184e-05] [-9.44868696e-06 -1.46240084e-05 -1.24299717e-06] [ 1.01992967e-05 -2.90183097e-06 1.50317046e-05] [-1.25805143e-06 3.34597565e-06 -1.71905088e-06] [ 1.66189761e-05 3.49566169e-05 3.45678155e-05] [-1.79877283e-05 -1.55598546e-05 1.28641629e-05] [ 1.20999909e-05 6.22310305e-06 -1.91497428e-05] [ 8.75677691e-06 -1.73998977e-05 1.90213150e-05] [ 2.97124257e-06 7.76153068e-07 1.57400918e-05]] Final stress: [ 3.35751772e-02 3.24542062e-02 1.35122290e-01 1.14805339e-05 7.69643756e-04 -5.10411138e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-6.69283895e-03 -1.48037246e-02 -1.85733353e-02] [ 6.69462133e-03 1.48045353e-02 -1.83018302e-02] [ 6.69282926e-03 1.48033589e-02 1.84927605e-02] [-6.69402753e-03 -1.48042844e-02 1.82857662e-02] [ 3.69147384e-07 -2.58744183e-05 -7.72254809e-06] [ 2.23032088e-05 1.25591024e-05 -7.42016461e-06] [-2.29298019e-05 1.33632664e-05 -7.62007131e-06] [ 4.31387800e-07 -1.99230948e-04 4.52263883e-05] [ 1.71354855e-04 9.91023720e-05 4.43328034e-05] [-1.72253264e-04 1.00107931e-04 4.33548137e-05] [ 9.66903302e-02 8.81559383e-03 -4.48725760e-05] [-6.58613067e-02 6.60033659e-02 -4.41649522e-05] [-2.82459863e-02 -1.00756657e-01 -4.47827413e-05] [-9.66926858e-02 -8.61178048e-03 4.23169207e-05] [ 6.56849397e-02 -6.61041185e-02 4.22774128e-05] [ 2.84247609e-02 1.00654068e-01 4.26294027e-05] [ 6.44245890e-03 9.92628759e-03 -1.21399746e-02] [-6.44346389e-03 -9.92670434e-03 -1.21304131e-02] [-6.44291286e-03 -9.92666638e-03 1.21356184e-02] [ 6.44269623e-03 9.92652066e-03 1.21333879e-02] [-7.35432971e-03 5.06318235e-04 7.57147231e-03] [ 7.35460191e-03 -5.06257695e-04 7.57820588e-03] [ 7.35554940e-03 -5.06220412e-04 -7.57789710e-03] [-7.35451166e-03 5.06337358e-04 -7.57731552e-03]] Final stress: [-2.91203663e-04 1.01158105e-03 1.42816962e-04 -1.25438883e-09 -1.05324723e-08 4.23232895e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.91696005e-02 -2.79964726e-02 -1.39526379e-01] [-1.91724582e-02 2.79969892e-02 -1.38786533e-01] [-1.91682478e-02 2.79967019e-02 1.39159358e-01] [ 1.91728245e-02 -2.79972403e-02 1.38986438e-01] [ 9.45121233e-07 2.30551834e-05 -1.43303275e-05] [-2.01110905e-05 -1.24550021e-05 -1.40953860e-05] [ 1.90116342e-05 -1.06711221e-05 -1.45816384e-05] [ 2.10515346e-07 -2.41912223e-04 7.46423399e-05] [ 2.07779723e-04 1.20140151e-04 7.32963053e-05] [-2.08651256e-04 1.20994915e-04 7.08945384e-05] [-1.50056451e-01 5.85176596e-02 -8.21614562e-05] [-2.98934093e-02 -1.37771314e-01 -8.39400155e-05] [ 1.64106601e-01 3.92713706e-02 -8.27824017e-05] [ 1.50056037e-01 -5.88893766e-02 8.27224328e-05] [ 3.02173938e-02 1.37957381e-01 8.41733622e-05] [-1.64430508e-01 -3.90856541e-02 8.35042419e-05] [-1.16940251e-02 7.31557996e-03 -1.15081374e-02] [ 1.16940533e-02 -7.31521206e-03 -1.15027015e-02] [ 1.16933919e-02 -7.31518611e-03 1.15128261e-02] [-1.16944326e-02 7.31584862e-03 1.14963940e-02] [-1.25855228e-03 2.96897652e-03 -2.43027586e-02] [ 1.25904346e-03 -2.96912226e-03 -2.42951950e-02] [ 1.25849107e-03 -2.96906022e-03 2.42979877e-02] [-1.25853679e-03 2.96897809e-03 2.42913592e-02]] Final stress: [ 5.25764207e-04 1.16807363e-03 9.02252541e-04 -1.25960439e-08 1.70073659e-08 -8.36718050e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 3.49310858e-11 2.19793928e-04 -6.92682522e-04] [-4.91813020e-10 -2.19793573e-04 -6.92625325e-04] [-6.97058094e-10 -2.19792980e-04 6.92681119e-04] [-2.37836834e-10 2.19793483e-04 6.92675056e-04] [-1.07663612e-09 -2.00597142e-08 -8.13838219e-09] [ 1.90670734e-08 1.14548689e-08 -9.28043620e-09] [-1.67379876e-08 8.79607331e-09 -7.61995667e-09] [-5.90352287e-10 -7.86468624e-09 1.38073641e-09] [ 5.11312359e-09 4.17178936e-09 7.83183740e-10] [-3.64950625e-09 2.64786409e-09 -4.13377284e-10] [-2.36910824e-10 5.44140797e-04 -9.42432085e-09] [ 1.69407649e-04 -2.48281903e-04 -9.38086827e-09] [-1.69407057e-04 -2.48282544e-04 -9.77782033e-09] [ 1.25208649e-09 -5.44172451e-04 1.90622763e-09] [-1.69381631e-04 2.48296583e-04 1.84619617e-09] [ 1.69379583e-04 2.48299243e-04 1.96429789e-09] [-1.01413045e-10 -7.30131815e-04 -6.16079319e-04] [-6.99791891e-11 7.30131870e-04 -6.16079101e-04] [-1.36104628e-10 7.30131748e-04 6.16079197e-04] [-7.72000797e-11 -7.30131658e-04 6.16077919e-04] [-5.35265721e-11 2.31781053e-04 1.23818669e-04] [ 1.09882436e-10 -2.31781000e-04 1.23819475e-04] [ 1.04471785e-10 -2.31780966e-04 -1.23819387e-04] [-6.91789959e-11 2.31781039e-04 -1.23819627e-04]] Final stress: [ 8.68261968e-04 5.16204458e-04 4.94116767e-04 -9.23080437e-13 1.33356660e-12 -7.15274794e-13] Minimization converged after 29 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 8 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-3.28362337e-11 -1.30842051e-05 -3.73487783e-04] [-5.96255160e-10 1.30850527e-05 -3.73463428e-04] [-3.11692369e-10 1.30848542e-05 3.73471100e-04] [ 1.86293647e-10 -1.30844852e-05 3.73449818e-04] [-2.03081936e-10 -3.25370109e-09 9.37905087e-10] [ 2.67075767e-09 1.75176245e-09 1.05505749e-09] [-2.12575935e-09 1.19640775e-09 1.55656044e-09] [-4.52854046e-10 1.73893544e-09 2.70548994e-09] [-1.99960948e-09 -5.35595790e-10 2.56506061e-09] [ 3.01645414e-09 -1.64665143e-09 1.82056690e-09] [-5.71701630e-10 -2.06567211e-04 -1.35920805e-09] [ 2.49700786e-04 -4.25429258e-05 -1.34639500e-09] [-2.49699635e-04 -4.25442495e-05 -9.13320161e-10] [ 8.00469135e-10 2.06572059e-04 7.01443420e-09] [-2.49707246e-04 4.25398912e-05 6.85721674e-09] [ 2.49705876e-04 4.25416334e-05 6.74824659e-09] [-3.45857787e-11 -9.62111212e-05 1.24261157e-04] [-6.17140228e-11 9.62111858e-05 1.24261844e-04] [-2.70490297e-11 9.62111353e-05 -1.24260775e-04] [-2.59752220e-11 -9.62111060e-05 -1.24261118e-04] [-8.95324370e-11 2.72579488e-05 -2.07024973e-05] [ 7.45282476e-11 -2.72578234e-05 -2.07022268e-05] [ 7.48258254e-11 -2.72578424e-05 2.07033886e-05] [-7.10064785e-11 2.72579584e-05 2.07028799e-05]] Final stress: [ 2.18133699e-04 4.66247732e-05 -1.98454552e-04 1.20025454e-12 -1.38962627e-12 -5.64848726e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-4.92672569e-12 -2.74720345e-05 -1.45654190e-05] [ 7.61574785e-11 2.74719747e-05 -1.45649254e-05] [-5.90666863e-11 2.74719908e-05 1.45661446e-05] [ 9.86701831e-11 -2.74719120e-05 1.45641055e-05] [ 1.87814325e-10 -7.65777997e-11 6.67695899e-11] [ 3.73909376e-11 -1.78508514e-10 2.01664074e-10] [-4.25304680e-10 2.64890943e-10 -6.36794784e-11] [-6.98391429e-11 -1.39875733e-09 1.43135725e-10] [ 1.33819333e-09 7.87061083e-10 2.14236184e-10] [-1.20317373e-09 6.33547437e-10 1.29944392e-10] [-7.23883176e-11 -1.31157646e-05 -3.07753905e-10] [-1.65242349e-05 3.73525495e-05 -2.91813303e-10] [ 1.65243492e-05 3.73524039e-05 -3.41954487e-10] [ 4.41038872e-11 1.31180760e-05 6.75943204e-11] [ 1.65221430e-05 -3.73537059e-05 1.96277333e-10] [-1.65222345e-05 -3.73535975e-05 1.80886634e-10] [ 2.45180265e-11 2.29674211e-05 1.78401954e-05] [-9.02339314e-12 -2.29674408e-05 1.78402505e-05] [ 2.20425345e-11 -2.29674377e-05 -1.78402413e-05] [-9.36828393e-12 2.29674299e-05 -1.78402463e-05] [-7.77383713e-12 -4.81544941e-05 -2.43230973e-05] [ 8.98727029e-12 4.81544994e-05 -2.43230190e-05] [ 4.74298232e-12 4.81544990e-05 2.43230103e-05] [-4.63079575e-12 -4.81544889e-05 2.43230468e-05]] Final stress: [-2.01988223e-04 -6.48906598e-06 2.13041151e-04 -3.97833552e-13 9.48379610e-14 -5.52848051e-14] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 1.00789768e-04 -5.95391363e-04 1.95695828e-05] [-3.16633532e-05 -5.52053368e-05 4.59093893e-05] [ 1.05630875e-04 -5.69406756e-04 -5.33634650e-05] [-1.45079595e-04 3.09265568e-04 9.91968782e-05] [ 3.79110432e-04 5.57267104e-04 1.93445124e-03] [-1.57944337e-04 5.22106271e-04 -1.25029139e-04] [-3.04826103e-04 9.31685675e-04 -2.87374061e-04] [-1.05074529e-04 1.19895273e-03 1.70048887e-04] [ 3.51679743e-04 9.98557500e-04 -8.13255701e-04] [-2.49345020e-04 4.10942933e-04 -7.20150265e-04] [ 2.78018216e-05 -6.93816064e-04 5.68515128e-04] [-2.41280682e-04 -6.18484649e-04 -3.09936374e-04] [ 1.82875413e-04 -6.50454485e-04 -9.74336683e-05] [-2.09291365e-04 -6.43074357e-04 -4.23469414e-04] [-2.86865291e-05 -2.08018668e-04 -1.71885111e-04] [ 3.63382989e-04 -7.06785069e-04 1.56900423e-04] [ 2.21841026e-05 1.43429297e-04 -5.21762375e-05] [-1.19387899e-05 -2.44635632e-04 3.00050953e-04] [ 1.93397925e-05 1.72702966e-04 1.41714513e-05] [-1.85195062e-05 3.25360232e-04 -2.32690532e-04] [ 3.54055519e-06 -1.56520921e-04 -4.86586808e-05] [-2.31116922e-05 -6.64536695e-05 6.85130943e-05] [-2.79279880e-05 -1.07963273e-04 -1.58949129e-04] [-1.64600298e-06 -2.54060039e-04 1.17044747e-04]] Final stress: [ 7.31332987e-05 1.42045160e-04 -2.62465254e-05 -2.59399559e-04 3.13843485e-07 1.86626280e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-3.92008762e-07 6.92855865e-04 1.41626926e-03] [-4.78672384e-07 -2.95039756e-04 -2.36913424e-04] [-6.25036799e-07 -6.98372254e-04 9.21827908e-04] [-3.33782603e-08 2.95632364e-04 -1.27328254e-04] [-3.73343751e-07 6.79970909e-05 3.83317059e-05] [-5.77450722e-05 -3.33509257e-05 3.80331485e-05] [ 5.85683902e-05 -3.42567450e-05 3.86406649e-05] [-7.00466133e-07 1.60076234e-03 -5.20721016e-04] [-1.37644900e-03 -7.96670199e-04 -5.15009997e-04] [ 1.37805151e-03 -7.98408820e-04 -5.16240001e-04] [-7.54927715e-07 1.52317160e-04 -3.83707456e-04] [-4.66201182e-04 2.64907733e-05 -1.76014053e-04] [ 4.67645763e-04 2.47811646e-05 -1.76014512e-04] [ 2.26080302e-07 8.79063708e-04 2.05551279e-04] [-4.22554162e-04 -5.40510475e-04 1.43386282e-07] [ 4.22245115e-04 -5.40068525e-04 -8.74163931e-08] [-3.71190345e-08 2.89250145e-04 6.39017304e-04] [-9.19705311e-08 -6.91917904e-04 6.75083517e-04] [-3.63631077e-08 -2.89141884e-04 -6.64759515e-04] [-7.34766746e-08 6.91195752e-04 -6.68947662e-04] [-1.09018757e-07 6.36526973e-05 -4.68899592e-04] [ 9.78675773e-09 -1.79929123e-04 -5.61534011e-04] [ 4.74474188e-09 -6.65906779e-05 4.90812217e-04] [-9.61847719e-08 1.80258225e-04 5.52466523e-04]] Final stress: [ 4.29700215e-04 2.96470224e-04 2.22028403e-04 1.87373793e-04 -5.92997536e-10 -4.49118656e-10] Minimization converged after 59 steps. Minimization converged after 58 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-5.02147424e-05 4.06033708e-05 -5.78327236e-05] [-4.96729769e-05 -4.16205055e-05 -1.30738451e-04] [ 5.08154499e-05 -4.19156851e-05 -2.86088183e-05] [ 5.01704045e-05 4.07658763e-05 1.57135334e-04] [ 2.68846449e-07 -7.60055818e-06 5.89698479e-07] [ 7.13438754e-06 3.68545534e-06 2.92660657e-07] [-7.79029621e-06 4.37480669e-06 -2.39519866e-07] [ 1.05548386e-07 5.23020950e-05 -1.10527840e-06] [-4.30079984e-05 -2.57759646e-05 -7.90593113e-09] [ 4.26801206e-05 -2.54623339e-05 2.43719710e-07] [ 9.49023076e-07 1.83505704e-04 3.15469987e-05] [-7.35512501e-05 -5.39520931e-05 4.01608043e-05] [ 7.15565638e-05 -5.17027531e-05 2.31691059e-05] [-2.03733993e-07 -3.62484638e-04 -1.46526879e-05] [ 2.31017881e-04 1.43208265e-04 -2.32693941e-05] [-2.30569799e-04 1.42714194e-04 -6.16682003e-06] [ 8.61953320e-06 5.59960767e-05 7.81130746e-05] [ 8.66761118e-06 -5.60717808e-05 7.23267535e-05] [-8.63931437e-06 -5.60319561e-05 -7.34706916e-05] [-8.53847562e-06 5.59108015e-05 -7.32930562e-05] [-2.19190432e-05 6.99678111e-05 2.28157932e-05] [-2.21487569e-05 -7.01816485e-05 1.91317906e-05] [ 2.21004570e-05 -7.02261806e-05 -1.84098820e-05] [ 2.21705605e-05 6.99916400e-05 -1.77305049e-05]] Final stress: [4.62843452e-04 2.72842645e-04 2.43341775e-04 9.93506708e-10 1.65850640e-04 7.11443483e-10] Minimization converged after 42 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 6.28457627e-04 -2.35548500e-03 2.84251061e-03] [-6.57512675e-04 2.28379171e-03 8.14491445e-04] [-6.27078781e-04 2.34697494e-03 -5.83529794e-03] [ 6.47855083e-04 -2.36696306e-03 -2.37779310e-03] [ 8.04199924e-06 -3.85437877e-04 2.27881709e-04] [ 4.51709283e-04 2.14170579e-04 1.54624528e-04] [-4.66550312e-04 2.32584129e-04 1.51484241e-04] [-3.94443353e-05 1.96950407e-04 3.16220474e-04] [-4.72536377e-05 -4.60815681e-05 3.55723431e-04] [ 1.07381511e-04 -1.25916407e-04 3.28262923e-04] [ 4.95778589e-02 1.79904335e-02 9.80191085e-04] [-2.13250357e-02 2.84794072e-02 8.96240859e-04] [-1.25153844e-02 -2.31042422e-05 9.38519592e-04] [-4.95527307e-02 -1.94017372e-02 -5.00877556e-05] [ 2.25921865e-02 -2.77799907e-02 -5.24693791e-05] [ 1.12141075e-02 7.68788558e-04 -5.88456907e-05] [-1.72183920e-03 -1.04493363e-02 -9.51190804e-03] [ 1.72321296e-03 1.04407151e-02 -9.60357507e-03] [ 1.72709865e-03 1.04390403e-02 9.62421083e-03] [-1.73156681e-03 -1.04486860e-02 9.66799059e-03] [ 2.98887305e-04 5.14438879e-03 -1.58726238e-03] [-2.93144438e-04 -5.14915855e-03 -1.62651030e-03] [-3.02599534e-04 -5.15217903e-03 1.68282858e-03] [ 3.03343238e-04 5.14683069e-03 1.72256877e-03]] Final stress: [ 4.34104008e-04 -6.17101355e-04 2.48560005e-04 1.62856810e-08 5.68634396e-08 4.44964868e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.82073730e-04 -5.30356675e-04 2.70314917e-06] [ 3.82073484e-04 5.30356868e-04 2.72040427e-06] [ 3.82073533e-04 5.30356665e-04 -2.66637131e-06] [-3.82073541e-04 -5.30356610e-04 -2.68886748e-06] [-8.08495865e-11 -3.22810303e-08 -9.54401591e-09] [ 2.79044795e-08 1.61518680e-08 -9.38700323e-09] [-2.77573593e-08 1.59839559e-08 -9.37881944e-09] [-1.50622614e-10 1.94608163e-08 -6.92432234e-09] [-1.69298795e-08 -9.59241242e-09 -6.87691659e-09] [ 1.72558191e-08 -9.94108657e-09 -7.17711884e-09] [ 2.77691399e-05 -1.66790161e-04 -6.79188462e-09] [ 2.43006016e-04 -2.83291287e-04 -6.65026989e-09] [ 1.98428316e-05 -3.93693738e-04 -6.56979415e-09] [-2.77691753e-05 1.66813666e-04 3.97904509e-10] [-2.43026377e-04 2.83279547e-04 5.41642409e-10] [-1.98223454e-05 3.93681895e-04 3.79139318e-10] [ 3.47601730e-04 -2.00785858e-04 1.23977417e-05] [-3.47601752e-04 2.00785868e-04 1.23985829e-05] [-3.47601718e-04 2.00785855e-04 -1.23984828e-05] [ 3.47601708e-04 -2.00785853e-04 -1.23985567e-05] [-8.36339402e-05 1.49560260e-05 4.61563946e-04] [ 8.36339153e-05 -1.49560069e-05 4.61564529e-04] [ 8.36339331e-05 -1.49560249e-05 -4.61564004e-04] [-8.36339542e-05 1.49560413e-05 -4.61564090e-04]] Final stress: [ 4.58408914e-04 2.78509081e-04 2.30827532e-04 2.89882266e-13 -5.12017884e-13 -1.83935184e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 6.67140111e-03 5.50221715e-04 2.92104441e-03] [-6.67702770e-03 -5.26252202e-04 1.42709787e-03] [-6.69170360e-03 -5.25903114e-04 -2.94308521e-03] [ 6.65548407e-03 5.23752401e-04 -1.53577412e-03] [-8.37543371e-06 -2.31928977e-05 1.16809556e-05] [ 8.23444158e-06 2.03402183e-05 6.42352758e-06] [ 1.60325251e-05 -3.27150244e-06 2.82039932e-05] [-1.99227888e-05 -7.24681582e-05 1.81368855e-05] [ 5.03662304e-05 5.09998658e-05 1.12017543e-05] [-7.74493172e-06 3.48903329e-06 -1.87023974e-05] [ 3.07626296e-02 8.09744210e-03 2.73200308e-04] [-8.51220016e-03 1.74521476e-02 2.78597042e-04] [-6.08898140e-03 -6.52887798e-03 2.67944942e-04] [-3.07717606e-02 -8.12752450e-03 -2.36568315e-04] [ 8.54643327e-03 -1.74267913e-02 -2.66708097e-04] [ 6.07761997e-03 6.52998898e-03 -2.47764033e-04] [-1.33527233e-03 -3.35559051e-03 -4.64598543e-03] [ 1.33522778e-03 3.35854481e-03 -4.68326615e-03] [ 1.33310187e-03 3.35689215e-03 4.65010661e-03] [-1.33937777e-03 -3.35509281e-03 4.68304834e-03] [ 1.70715458e-03 6.87819063e-04 1.12379031e-03] [-1.70688584e-03 -6.86473967e-04 1.10658067e-03] [-1.70946737e-03 -6.87302351e-04 -1.12712802e-03] [ 1.70503445e-03 6.87103342e-04 -1.10207585e-03]] Final stress: [-5.64960609e-04 -6.91563970e-04 -3.05941140e-04 3.39147832e-08 1.77561322e-07 2.23034724e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-6.54507584e-03 5.17946979e-04 3.14829270e-03] [ 6.58401853e-03 -5.08986744e-04 1.24595880e-03] [ 6.59123803e-03 -5.02589920e-04 -3.34705592e-03] [-6.59386968e-03 4.95629792e-04 -1.39721311e-03] [-2.06385555e-06 -6.38610522e-05 -4.69422237e-07] [ 5.44080930e-05 3.68553970e-05 -8.76210653e-06] [-4.60197693e-05 2.95815459e-05 -1.09506101e-07] [ 3.31813820e-05 -3.83246550e-05 3.25043009e-05] [ 1.16234047e-06 -2.44642931e-05 -3.99371491e-06] [-7.64918950e-05 5.71538571e-05 5.34733715e-05] [-3.08685057e-02 8.18617001e-03 3.95006697e-04] [ 6.06784780e-03 -6.54392412e-03 3.93508511e-04] [ 8.55382788e-03 1.72420206e-02 3.81387250e-04] [ 3.08788583e-02 -8.04862049e-03 -2.92526378e-04] [-6.19157865e-03 6.46391472e-03 -3.30952543e-04] [-8.45147504e-03 -1.72983367e-02 -2.92053288e-04] [ 1.44220710e-03 -3.29127242e-03 -4.64665756e-03] [-1.43894570e-03 3.29105408e-03 -4.69030801e-03] [-1.44409686e-03 3.29085138e-03 4.65157523e-03] [ 1.44773599e-03 -3.29075864e-03 4.70088862e-03] [-1.73345606e-03 6.63593792e-04 1.11575520e-03] [ 1.73329992e-03 -6.64977773e-04 1.08839477e-03] [ 1.73689297e-03 -6.62796616e-04 -1.11288867e-03] [-1.73309935e-03 6.64141200e-04 -1.08375524e-03]] Final stress: [-5.67345695e-04 -6.90016273e-04 -3.06603808e-04 1.79639869e-09 3.23723418e-09 -2.25816917e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.76641729e-10 -6.27494365e-05 1.02293968e-04] [ 1.54961522e-10 6.27495246e-05 1.02308122e-04] [ 3.29915127e-11 6.27494504e-05 -1.02293526e-04] [ 2.68225997e-11 -6.27494979e-05 -1.02300726e-04] [ 3.53741545e-11 -5.98423749e-09 -1.79264442e-09] [ 5.13872786e-09 2.93612783e-09 -1.72156450e-09] [-5.28524152e-09 3.06259124e-09 -1.88446078e-09] [ 2.30607748e-10 8.98199515e-10 -1.95542138e-10] [-8.61118954e-10 -7.08412773e-10 -3.34417605e-10] [ 3.82423704e-10 -1.65019165e-10 -7.97905145e-12] [ 8.90432172e-12 4.44203777e-04 -2.30207098e-09] [-4.08802302e-05 -9.99963556e-05 -2.12836841e-09] [ 4.08801728e-05 -9.99963139e-05 -2.32350001e-09] [ 9.16342002e-11 -4.44205462e-04 1.64454605e-09] [ 4.08813247e-05 9.99970277e-05 1.53391887e-09] [-4.08815056e-05 9.99972416e-05 1.63444519e-09] [ 1.19855237e-11 8.11740580e-05 -7.48302541e-05] [ 3.00045544e-11 -8.11740601e-05 -7.48300266e-05] [-6.31772412e-13 -8.11740562e-05 7.48302465e-05] [ 1.83372206e-11 8.11740391e-05 7.48299722e-05] [ 9.41996481e-12 -1.22529662e-04 1.34118153e-04] [ 1.80815179e-11 1.22529677e-04 1.34118389e-04] [ 1.39390159e-11 1.22529680e-04 -1.34118160e-04] [ 4.44561055e-12 -1.22529671e-04 -1.34118279e-04]] Final stress: [ 5.21515720e-04 9.11776305e-04 4.76874318e-04 4.25603785e-13 7.78463913e-13 -6.36473616e-14] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.43482448e-12 -2.62721902e-05 2.13154227e-06] [ 8.68135100e-11 2.62718311e-05 2.19287235e-06] [-2.16776223e-10 2.62717945e-05 -2.12333470e-06] [ 3.30771521e-12 -2.62721127e-05 -2.12003488e-06] [ 2.16641352e-10 -3.33420871e-08 -1.20979619e-08] [ 2.89414022e-08 1.64852343e-08 -1.20980042e-08] [-2.94231031e-08 1.70159763e-08 -1.24515809e-08] [-6.77930409e-11 2.88515276e-08 -7.48005458e-09] [-2.43802677e-08 -1.42352854e-08 -7.15498705e-09] [ 2.44796861e-08 -1.43680668e-08 -7.20054608e-09] [-4.57809901e-10 2.80073430e-05 -8.91943698e-09] [-9.64565953e-06 6.29009079e-05 -8.78280915e-09] [ 9.64642573e-06 6.28999372e-05 -9.01155990e-09] [-2.18415563e-10 -2.80851045e-05 1.46546424e-09] [ 9.71507870e-06 -6.28610742e-05 1.46594730e-09] [-9.71472076e-06 -6.28615268e-05 1.56214386e-09] [ 3.64744901e-11 4.74092435e-05 3.82662608e-05] [-4.32565095e-12 -4.74092794e-05 3.82656219e-05] [ 2.13390972e-11 -4.74092553e-05 -3.82653681e-05] [-1.54753710e-11 4.74092186e-05 -3.82673486e-05] [-4.35346204e-11 -4.51083025e-05 -1.61749275e-04] [-1.36057149e-11 4.51082327e-05 -1.61748942e-04] [-2.18229453e-11 4.51082401e-05 1.61749680e-04] [-4.54299376e-11 -4.51083104e-05 1.61749029e-04]] Final stress: [ 5.02211881e-04 6.94207086e-04 6.81723912e-04 -5.10006474e-14 8.55162952e-13 -1.28885073e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 7.28724026e-11 -1.25829670e-04 -3.96320218e-04] [-5.06590699e-11 1.25829357e-04 -3.96317230e-04] [-5.20211023e-10 1.25829314e-04 3.96320917e-04] [-1.21759436e-10 -1.25829364e-04 3.96319315e-04] [-1.48687533e-10 -2.94755104e-09 -5.77742520e-10] [ 3.12066183e-09 1.62733598e-09 -6.07993378e-10] [-2.79160273e-09 1.26775945e-09 -3.78350490e-10] [-2.52720809e-10 1.94559746e-09 -9.06551056e-10] [-2.35803821e-10 -4.64225214e-10 -2.42615816e-10] [ 8.21477997e-10 -1.09185611e-09 -6.98339574e-10] [-4.21917279e-10 -1.99851384e-04 -2.71644495e-10] [ 8.86715890e-05 2.15236818e-04 -1.53516544e-10] [-8.86707627e-05 2.15235861e-04 -6.30538411e-10] [ 1.29037447e-10 1.99846314e-04 4.18316683e-10] [-8.86658760e-05 -2.15233831e-04 4.20734162e-10] [ 8.86656310e-05 -2.15233514e-04 6.67675391e-10] [ 6.90525415e-12 2.06033175e-04 1.52963533e-04] [-2.18833285e-11 -2.06033272e-04 1.52963447e-04] [-2.92384450e-11 -2.06033240e-04 -1.52963359e-04] [-4.52020921e-11 2.06033165e-04 -1.52963558e-04] [-5.07091591e-11 -1.52334894e-05 -6.39017733e-05] [ 1.46136553e-11 1.52334515e-05 -6.39016211e-05] [ 2.85380983e-12 1.52334355e-05 6.39017147e-05] [-5.92998983e-11 -1.52334638e-05 6.39017943e-05]] Final stress: [ 4.72073036e-05 2.16371843e-04 -1.99343884e-04 -7.29262855e-13 1.91180438e-12 -1.66840469e-13] Minimization converged after 31 steps. Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-2.06508317e-07 6.31943133e-05 -9.54385110e-05] [ 7.50673545e-08 -4.01934373e-05 -1.73276871e-04] [-1.70262954e-07 -6.37265752e-05 9.63445769e-05] [ 1.63299241e-08 4.04057387e-05 1.87470795e-04] [-7.20685274e-08 2.39236886e-06 -6.77868055e-07] [-2.20885413e-06 -1.18697866e-06 -5.39369977e-07] [ 2.32569309e-06 -1.33777233e-06 -4.89045012e-07] [-4.96345399e-07 1.75132216e-05 -3.95712819e-06] [-1.36138125e-05 -7.94666233e-06 -3.07226800e-06] [ 1.46506929e-05 -9.11682899e-06 -3.78670528e-06] [ 2.74239026e-07 2.28752262e-04 -1.85595872e-04] [-2.81250443e-04 -8.51584109e-05 -1.38301290e-04] [ 2.80808767e-04 -8.45886127e-05 -1.38387734e-04] [ 1.32138857e-07 -2.66851758e-04 1.84457754e-04] [ 3.14297210e-04 1.03844849e-04 1.37571459e-04] [-3.14487192e-04 1.04106618e-04 1.37509391e-04] [-6.82240439e-09 6.09198646e-05 2.27576373e-04] [-6.01514635e-08 1.15251063e-04 2.36155972e-04] [-6.38592201e-09 -6.08826168e-05 -2.27013599e-04] [-6.24810035e-08 -1.15385147e-04 -2.36769342e-04] [ 1.83029608e-08 -9.30270999e-05 -9.69951022e-05] [ 1.27273475e-08 1.36864590e-04 -9.44090185e-05] [ 1.99429383e-09 9.30009587e-05 9.75652327e-05] [ 2.81645599e-08 -1.36843947e-04 9.40581708e-05]] Final stress: [ 2.80262360e-04 4.53457235e-04 2.36032458e-04 -1.61953046e-04 6.60002748e-11 6.50977008e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-2.49039263e-08 -6.55115010e-06 -1.40433048e-05] [ 7.20350344e-08 1.52170955e-06 -1.44111640e-05] [-2.41739512e-08 6.54714567e-06 1.89916577e-05] [ 4.81284487e-08 -1.56145234e-06 1.80060105e-05] [ 9.50876193e-08 -6.96563624e-07 -4.85971872e-07] [ 5.56352363e-07 2.47098666e-07 -4.44274264e-07] [-7.70136744e-07 4.80256520e-07 -6.04712622e-07] [-4.28746397e-08 3.18297592e-06 -1.18324179e-06] [-2.71297188e-06 -1.53864143e-06 -1.13920713e-06] [ 2.80624996e-06 -1.64193701e-06 -1.20735358e-06] [ 2.54205491e-08 3.37388022e-05 9.78202083e-06] [-3.86682736e-05 -1.20471896e-05 1.08236415e-05] [ 3.86176227e-05 -1.19887625e-05 1.07796014e-05] [-1.05765099e-08 -3.56892712e-05 -1.08426187e-05] [ 4.03766954e-05 1.30137041e-05 -1.18683107e-05] [-4.03631953e-05 1.29941186e-05 -1.18870942e-05] [ 1.25177600e-08 -3.77366190e-05 4.98822418e-05] [-5.53229940e-09 -6.07150228e-06 5.00954891e-05] [ 1.17982015e-08 3.77299853e-05 -4.99302499e-05] [-6.89590271e-09 6.07234286e-06 -5.02132527e-05] [ 2.27802849e-09 -4.72019489e-05 -4.34844104e-06] [ 1.90262065e-09 4.09908360e-05 -1.46164387e-06] [-2.11099191e-09 4.72010812e-05 4.33122769e-06] [ 5.55704838e-09 -4.09950185e-05 1.37895057e-06]] Final stress: [2.68521531e-04 4.66244349e-04 2.46526402e-04 1.66890839e-04 6.62598011e-11 1.61273016e-11] Minimization converged after 53 steps. Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 2.02160769e-05 3.23813905e-06 2.14986580e-05] [ 2.02014284e-05 -3.21011362e-06 -1.16324943e-05] [-2.02724822e-05 -3.22311942e-06 -1.17750292e-05] [-2.02295323e-05 3.20813988e-06 1.79230654e-06] [-1.40790462e-08 4.62968667e-06 1.83492208e-06] [-3.96699902e-06 -2.29473762e-06 1.80732819e-06] [ 3.99288320e-06 -2.32586036e-06 1.83348317e-06] [-1.29578865e-08 7.57584093e-06 -2.21751375e-06] [-6.61373967e-06 -3.77916530e-06 -2.22114141e-06] [ 6.65955217e-06 -3.82036223e-06 -2.25202262e-06] [-2.12654508e-08 -1.46970182e-05 4.34602694e-06] [-1.96188910e-05 -2.40518209e-05 -2.29734732e-05] [ 1.96983338e-05 -2.41220047e-05 3.16995636e-05] [-5.08603053e-08 2.19879194e-05 -3.99726289e-06] [ 1.33403194e-05 2.04834101e-05 2.33422942e-05] [-1.32827276e-05 2.03915500e-05 -3.13591334e-05] [ 1.11031819e-04 -6.81644975e-05 3.45172017e-04] [ 1.11041494e-04 6.81639344e-05 3.44748781e-04] [-1.11037450e-04 6.81615318e-05 -3.45240495e-04] [-1.11042118e-04 -6.81581915e-05 -3.44588273e-04] [-1.47048347e-05 -1.52187502e-04 -1.35246160e-04] [-1.47066665e-05 1.52189235e-04 -1.35758151e-04] [ 1.46978755e-05 1.52191991e-04 1.35454317e-04] [ 1.46948219e-05 -1.52186985e-04 1.35731452e-04]] Final stress: [ 2.79962779e-04 4.62426490e-04 2.34794654e-04 -3.20818327e-11 -1.79715927e-04 -1.87854340e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.72479591e-05 2.14644767e-07 7.71142929e-06] [-1.72122843e-05 -2.39189480e-07 4.66661430e-06] [ 1.72037836e-05 -1.97268303e-07 -9.56878896e-06] [ 1.72240823e-05 1.91293190e-07 -2.72162165e-06] [ 8.82815064e-08 -1.82849008e-06 -3.83562811e-07] [ 1.65444919e-06 8.46703347e-07 -4.06271715e-07] [-1.81714715e-06 1.04233132e-06 -4.96182245e-07] [-4.34511490e-08 3.37764946e-06 -3.18473953e-07] [-2.96431782e-06 -1.65260197e-06 -3.16415283e-07] [ 3.04915562e-06 -1.75176822e-06 -3.75413533e-07] [-5.78891048e-08 -1.64253802e-05 1.18468811e-06] [-1.66560419e-05 -1.58216485e-05 2.90361613e-05] [ 1.67451563e-05 -1.59398107e-05 -2.66918950e-05] [-5.79389990e-08 1.16300587e-05 -6.00188656e-07] [ 2.09108891e-05 1.83436096e-05 -2.84718622e-05] [-2.08066327e-05 1.82167523e-05 2.72865042e-05] [-1.13494959e-04 -7.25139205e-05 3.46507737e-04] [-1.13507737e-04 7.25085014e-05 3.46331590e-04] [ 1.13512697e-04 7.25002361e-05 -3.46367702e-04] [ 1.13502805e-04 -7.25024010e-05 -3.46316023e-04] [ 2.10894678e-05 -1.50789240e-04 -1.34086656e-04] [ 2.10880673e-05 1.50788706e-04 -1.34238924e-04] [-2.11013579e-05 1.50792887e-04 1.34310204e-04] [-2.11011182e-05 -1.50791653e-04 1.34325054e-04]] Final stress: [ 2.80257606e-04 4.62203871e-04 2.34690164e-04 -8.60120274e-11 1.79775919e-04 7.62757272e-12] Minimization converged after 48 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.68775713e-04 -9.15094006e-04 1.45054810e-04] [ 1.68775631e-04 9.15093985e-04 1.45057804e-04] [ 1.68775662e-04 9.15094148e-04 -1.45053264e-04] [-1.68775629e-04 -9.15094070e-04 -1.45057518e-04] [ 1.16979109e-11 1.19089005e-09 1.55128799e-10] [-1.21514902e-09 -6.09887030e-10 1.56053975e-10] [ 1.19735638e-09 -5.91122207e-10 1.41585049e-10] [-6.21192347e-11 1.75357284e-10 -1.42915457e-10] [-1.27899913e-10 -5.06977793e-11 -1.85984450e-10] [ 2.49109455e-10 -1.81086812e-10 -2.76333109e-10] [-5.13364653e-04 2.26451195e-04 -7.76031311e-10] [ 3.43551691e-05 -1.38056886e-04 -9.61740980e-10] [-2.78607318e-04 -6.00227635e-04 -9.04768602e-10] [ 5.13364647e-04 -2.26450980e-04 4.40097526e-10] [-3.43553870e-05 1.38056782e-04 4.08281991e-10] [ 2.78607553e-04 6.00227510e-04 3.37475507e-10] [-3.92558743e-04 1.56482040e-04 -6.28788254e-05] [ 3.92558732e-04 -1.56482033e-04 -6.28787347e-05] [ 3.92558747e-04 -1.56482029e-04 6.28787660e-05] [-3.92558746e-04 1.56482042e-04 6.28786945e-05] [ 6.76360027e-05 -1.01934122e-04 4.09803534e-04] [-6.76360087e-05 1.01934123e-04 4.09803566e-04] [-6.76360067e-05 1.01934129e-04 -4.09803566e-04] [ 6.76360061e-05 -1.01934125e-04 -4.09803658e-04]] Final stress: [ 2.72160488e-04 4.56715732e-04 2.32722534e-04 -2.41140182e-13 -3.65134177e-13 1.78468971e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.80320610e-04 -9.20187694e-04 1.34708453e-04] [-1.80320615e-04 9.20187646e-04 1.34715611e-04] [-1.80320612e-04 9.20187630e-04 -1.34709282e-04] [ 1.80320596e-04 -9.20187588e-04 -1.34714451e-04] [-4.31607020e-11 -2.23186175e-09 -5.83319004e-10] [ 1.93943238e-09 1.14912992e-09 -5.64630287e-10] [-1.86704530e-09 1.06176146e-09 -5.33186439e-10] [-1.55237175e-11 4.27783142e-10 9.94824223e-11] [-3.39738127e-10 -1.91621163e-10 1.52173274e-10] [ 3.56611796e-10 -1.98212835e-10 1.49461103e-10] [ 5.06091826e-04 2.23489016e-04 -9.79455654e-10] [ 3.02411243e-04 -5.92591285e-04 -9.70983574e-10] [-4.23658432e-05 -1.47807793e-04 -9.81426557e-10] [-5.06091820e-04 -2.23487254e-04 1.16688898e-09] [-3.02412825e-04 5.92590389e-04 1.25050855e-09] [ 4.23674215e-05 1.47806912e-04 1.25775949e-09] [ 3.97115954e-04 1.57939204e-04 -6.06639084e-05] [-3.97115958e-04 -1.57939205e-04 -6.06637226e-05] [-3.97115962e-04 -1.57939197e-04 6.06638987e-05] [ 3.97115955e-04 1.57939202e-04 6.06638011e-05] [-6.97132572e-05 -1.03664931e-04 4.06289575e-04] [ 6.97132591e-05 1.03664930e-04 4.06289679e-04] [ 6.97132593e-05 1.03664929e-04 -4.06289507e-04] [-6.97132604e-05 -1.03664928e-04 -4.06289610e-04]] Final stress: [ 2.72055486e-04 4.56561933e-04 2.32670925e-04 -2.35420322e-13 1.01416572e-13 -1.78378679e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[-1.04865229e-04 -2.51371768e-05 -7.32695492e-05] [ 1.06342467e-04 2.45409082e-05 -8.27195799e-05] [ 1.05360368e-04 2.33095161e-05 6.76277337e-05] [-1.07570628e-04 -2.37499593e-05 7.93050081e-05] [-3.54326290e-07 -1.05346707e-06 1.19839278e-07] [ 2.29584728e-06 1.02617510e-06 -2.80469694e-07] [-1.31401938e-06 5.88559463e-08 6.60217556e-07] [-9.92119726e-07 1.09315414e-06 6.87205900e-08] [-4.25983007e-07 7.48338277e-07 1.21423068e-06] [ 1.62149568e-06 -1.07499783e-06 1.07919798e-06] [ 1.13175696e-03 7.33582347e-05 2.04791815e-06] [-6.86656089e-04 1.45790464e-03 3.71292238e-06] [-7.96202327e-04 -1.33324416e-03 2.65248948e-06] [-1.13209864e-03 -7.07824568e-05 -1.91253025e-06] [ 6.85518890e-04 -1.45863220e-03 -2.05880835e-06] [ 7.97918785e-04 1.33179972e-03 8.89105530e-07] [ 1.00148973e-05 -7.10836968e-05 -2.94050846e-05] [-9.98934872e-06 7.10803716e-05 -2.95740799e-05] [-1.01765624e-05 7.11068785e-05 2.95071517e-05] [ 9.84399336e-06 -7.11014797e-05 2.98312955e-05] [-1.54837487e-04 8.44132750e-05 8.87306051e-05] [ 1.54936119e-04 -8.44187372e-05 8.85282620e-05] [ 1.54869281e-04 -8.46232701e-05 -8.84211367e-05] [-1.54996336e-04 8.44615252e-05 -8.83334591e-05]] Final stress: [-5.42110205e-04 -6.65700984e-04 -4.21180563e-04 -5.91889281e-10 1.10308752e-08 1.20594646e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 1.37566081e-04 -9.91184478e-06 -2.21113932e-05] [-1.37588107e-04 1.04975819e-05 -4.75822509e-06] [-1.36750135e-04 9.90073705e-06 1.65382724e-05] [ 1.37089388e-04 -9.94493707e-06 3.08906050e-06] [-2.69811699e-07 -1.36443461e-06 4.38680136e-07] [ 7.62115291e-07 8.40116349e-07 6.28792136e-07] [-5.19745645e-08 1.11229953e-07 1.24794106e-06] [ 3.94794244e-07 1.63079321e-06 1.42499562e-06] [-2.46867373e-06 -1.41775328e-06 8.73109714e-07] [ 1.37381859e-06 -3.07710035e-07 1.83254850e-06] [-1.19806994e-03 1.34015637e-04 -3.09331280e-06] [ 8.32156353e-04 -1.29647135e-03 -2.86978683e-06] [ 7.91418192e-04 1.37285414e-03 -2.33873656e-06] [ 1.19823417e-03 -1.34010912e-04 2.79999107e-06] [-8.32806416e-04 1.29617513e-03 2.61880035e-06] [-7.91094047e-04 -1.37276325e-03 2.81317050e-06] [-2.84061192e-06 -6.59585069e-05 -4.72424808e-05] [ 2.86263608e-06 6.60290845e-05 -4.68250618e-05] [ 2.77836904e-06 6.60160368e-05 4.72162117e-05] [-2.77633102e-06 -6.59750828e-05 4.69132550e-05] [ 1.42205124e-04 8.56447478e-05 8.72454963e-05] [-1.42163991e-04 -8.56176528e-05 8.73726389e-05] [-1.42076129e-04 -8.56590259e-05 -8.67310162e-05] [ 1.42115128e-04 8.56872319e-05 -8.70829507e-05]] Final stress: [-5.42184223e-04 -6.65642960e-04 -4.20629493e-04 1.31940496e-09 1.24356969e-11 -1.20658631e-04] Minimization converged after 9 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-1.79042000e-04 -1.15620623e-03 5.72553778e-04] [-2.58636648e-04 -3.53135945e-04 -3.13353632e-04] [ 2.38180173e-04 -1.12915107e-03 5.40437535e-04] [ 1.93875505e-04 -2.88402664e-04 -2.96536821e-04] [-3.80516927e-04 -1.07390199e-04 -1.06604521e-03] [-2.09764184e-04 -3.47801721e-04 -3.71613494e-04] [ 4.08048853e-04 4.47525087e-04 -3.65004543e-04] [-1.25246309e-04 2.01608403e-04 1.85483519e-03] [-5.04426899e-05 4.27262519e-04 -6.20587596e-04] [ 1.61541374e-04 -7.58565451e-05 -5.85350179e-04] [ 3.08573726e-04 1.05532623e-03 3.18355074e-05] [-3.85065112e-04 1.17006507e-04 -2.24830630e-04] [ 1.32128507e-04 3.44589995e-04 4.08064619e-04] [ 3.00701225e-05 1.00026360e-03 -9.45977078e-05] [-2.44228878e-04 -7.63924103e-05 4.73158629e-04] [ 2.55018142e-04 6.05697932e-04 1.69757055e-04] [-2.24508153e-05 -6.56627314e-05 1.39385829e-04] [-3.54088803e-05 -2.70643909e-04 -1.66799680e-04] [ 2.31123283e-05 -1.36930448e-04 -1.01396849e-04] [-1.67221003e-06 -1.69733553e-04 1.66910824e-04] [ 1.65683857e-05 -5.87053395e-05 2.39865125e-05] [ 2.03069441e-05 -1.03512059e-04 -4.50989974e-05] [ 4.13372239e-05 7.72200229e-05 -1.74094188e-04] [ 6.37133696e-05 6.30245199e-05 4.43840462e-05]] Final stress: [-1.46613074e-04 1.16851477e-04 1.93250148e-04 -2.52750269e-04 -2.52184951e-06 1.06906869e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.41384908e-08 -2.33040186e-05 -3.30193305e-05] [-3.69658486e-09 -8.63668778e-07 3.97055965e-05] [-3.10466928e-08 2.32341078e-05 2.42342439e-05] [-4.89370225e-08 8.14392499e-07 -1.33647153e-05] [ 2.17918888e-08 -2.79606400e-05 -7.78738936e-06] [ 2.42223724e-05 1.39745924e-05 -7.87921804e-06] [-2.42344939e-05 1.40067464e-05 -7.85969841e-06] [-5.93452059e-08 -1.24522299e-05 3.28506337e-06] [ 1.10662064e-05 6.33273550e-06 3.38975639e-06] [-1.09650783e-05 6.20603406e-06 3.33913091e-06] [-2.00766864e-08 2.69876816e-05 3.72171648e-05] [-8.61973703e-06 2.18387207e-05 5.53644095e-05] [ 8.65897902e-06 2.17927597e-05 5.53539640e-05] [-1.98583182e-08 -1.74098480e-05 -3.85754948e-05] [ 4.47265485e-07 -2.65606473e-05 -5.67925264e-05] [-4.08146004e-07 -2.66059620e-05 -5.67047043e-05] [ 3.03979852e-09 -5.31150116e-05 -3.84839490e-05] [-3.24647864e-09 6.91179692e-06 -5.31237072e-05] [-9.84837323e-10 5.31184421e-05 3.82844741e-05] [-7.13161774e-09 -6.93745591e-06 5.32026364e-05] [-1.69083053e-09 1.03092619e-05 -5.78875904e-05] [-2.69513325e-09 -8.39755599e-05 -4.89974000e-05] [-3.29698685e-09 -1.03179795e-05 5.74305101e-05] [-4.33184483e-09 8.39757499e-05 4.96687735e-05]] Final stress: [ 2.44418450e-04 2.48696325e-04 4.54893428e-04 1.67004119e-04 2.58862088e-10 -8.25954536e-13] Minimization converged after 57 steps. Minimization converged after 57 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 4.55020198e-06 -1.34883084e-04 -1.42550605e-05] [-4.55040002e-06 1.34883108e-04 -1.44904715e-05] [-4.55042698e-06 1.34883102e-04 1.44557788e-05] [ 4.55022456e-06 -1.34883037e-04 1.41323746e-05] [-2.79734850e-10 1.94542211e-07 6.86799710e-08] [-1.68454063e-07 -9.70346308e-08 6.87530975e-08] [ 1.68837886e-07 -9.75780434e-08 6.87630019e-08] [-2.62520582e-10 8.41883645e-08 -3.21652771e-08] [-7.27365423e-08 -4.18206846e-08 -3.20865587e-08] [ 7.31961090e-08 -4.23871365e-08 -3.22889349e-08] [-8.65672503e-05 -8.78308229e-05 -1.75173473e-10] [-5.08628265e-05 -1.47388188e-05 -1.91465326e-10] [-1.10961336e-04 -2.82462701e-05 -1.80019712e-10] [ 8.65667009e-05 8.81264134e-05 1.55527494e-08] [ 5.06071555e-05 1.45915407e-05 1.55941405e-08] [ 1.11217749e-04 2.80979312e-05 1.55676014e-08] [-6.48336083e-05 -7.74694303e-06 7.30755372e-05] [ 6.48335733e-05 7.74695125e-06 7.30811302e-05] [ 6.48336065e-05 7.74695815e-06 -7.30791770e-05] [-6.48336305e-05 -7.74694653e-06 -7.30756072e-05] [ 9.44205185e-05 -1.85359121e-06 -1.61252182e-04] [-9.44205376e-05 1.85359442e-06 -1.61253383e-04] [-9.44205259e-05 1.85359385e-06 1.61253966e-04] [ 9.44205108e-05 -1.85358920e-06 1.61251271e-04]] Final stress: [ 2.47192569e-04 2.47302305e-04 4.46815104e-04 -1.19603427e-13 -1.36438388e-13 1.95285870e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.20349830e-03 3.04383814e-03 5.49795766e-03] [-2.38529877e-03 -3.03995549e-03 3.06444390e-03] [-2.05728691e-03 -3.06638829e-03 -2.00691993e-03] [ 1.85104907e-03 3.10276681e-03 1.31297982e-02] [-3.46603609e-04 -9.67655541e-03 -3.37394884e-03] [ 8.69972604e-03 5.26640286e-03 -3.57198628e-03] [-7.83565572e-03 4.36586073e-03 -3.00244478e-03] [ 1.42783583e-04 3.64051280e-03 -1.15185464e-03] [-3.28854823e-03 -1.99380405e-03 -1.23042249e-03] [ 2.95423139e-03 -1.63527106e-03 -1.01713879e-03] [-7.17108743e-03 -2.83697101e-03 5.68966904e-04] [ 7.77022996e-03 -6.30903353e-03 5.14370463e-04] [ 2.53640520e-03 1.30981571e-02 6.43219048e-04] [ 6.90208990e-03 -4.64320689e-03 -2.61749029e-03] [-1.09669380e-03 1.03303660e-02 -2.64731879e-03] [-8.72834246e-03 -9.66511337e-03 -2.51908034e-03] [-1.16663930e-03 3.84120961e-04 -1.96448123e-03] [ 1.12583479e-03 -3.70180913e-04 -2.28881999e-03] [ 1.09012778e-03 -3.68431801e-04 1.93384779e-03] [-1.10315241e-03 3.74001400e-04 2.03129757e-03] [-1.62358945e-05 1.19031939e-03 3.94424400e-04] [-4.52299767e-05 -1.18769197e-03 3.07150511e-04] [ 1.61948483e-05 -1.18836434e-03 -4.35207963e-04] [-5.13963562e-05 1.18462191e-03 -2.58362143e-04]] Final stress: [-7.76799150e-05 -5.42406439e-05 2.99816381e-04 -4.64338228e-08 -5.93221766e-07 -5.82250112e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 1.60415566e-03 -4.78557383e-02 3.15373397e-02] [-1.64914607e-03 4.78035981e-02 2.72137592e-02] [-1.63849426e-03 4.78052888e-02 -2.65648914e-02] [ 1.65868132e-03 -4.77842408e-02 -2.70172272e-02] [ 1.66798859e-06 -4.56025636e-04 -1.98506108e-04] [ 3.64023358e-04 2.19687721e-04 -1.56678339e-04] [-3.64541728e-04 2.22018184e-04 -1.72552268e-04] [-6.71233789e-06 2.00582108e-03 -9.31064443e-04] [-1.67592809e-03 -9.71499303e-04 -7.67919371e-04] [ 1.70687942e-03 -9.97569369e-04 -8.65180277e-04] [ 1.50482710e-01 5.30677702e-02 3.38519118e-05] [-8.75514818e-02 7.14684688e-02 1.97441319e-05] [-2.54047870e-02 -4.73239216e-02 2.80305510e-05] [-1.50507800e-01 -4.94596624e-02 -7.00259497e-04] [ 8.44741748e-02 -7.32409932e-02 -6.45072595e-04] [ 2.85459336e-02 4.54941295e-02 -6.65889728e-04] [ 4.51194407e-02 4.07285385e-03 4.56111991e-03] [-4.51329074e-02 -4.07351312e-03 4.57117534e-03] [-4.51414064e-02 -4.07479757e-03 -4.66291352e-03] [ 4.51179208e-02 4.07346509e-03 -4.56533421e-03] [ 5.00970588e-03 2.20020652e-02 -1.87598341e-03] [-5.00888748e-03 -2.20010143e-02 -1.90224946e-03] [-5.01261338e-03 -2.19972952e-02 1.84989057e-03] [ 5.00941244e-03 2.20011042e-02 1.87681055e-03]] Final stress: [ 1.48265464e-03 -6.88044996e-04 -1.15529864e-03 8.53692286e-08 5.61714606e-08 5.48563496e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 2.30653110e-03 -1.52872283e-02 2.81386964e-03] [-2.29261657e-03 1.52665113e-02 2.03998531e-04] [-2.28593248e-03 1.52272292e-02 4.22943664e-03] [ 2.28735683e-03 -1.52623088e-02 -2.69133608e-04] [-6.90434864e-07 3.27811569e-04 1.98300346e-05] [-2.88448529e-04 -1.64867244e-04 2.27644525e-05] [ 2.89016963e-04 -1.66411612e-04 1.85671357e-05] [ 2.16225597e-06 4.53769767e-03 -1.61648304e-03] [-3.86140676e-03 -2.25154922e-03 -1.53686094e-03] [ 3.84674920e-03 -2.24050264e-03 -1.45212745e-03] [-1.17403421e-01 2.37057334e-02 -5.76385579e-04] [ 2.39586388e-02 -7.56591752e-02 -5.46352600e-04] [ 5.92287405e-02 1.33957477e-01 -5.52452583e-04] [ 1.17389542e-01 -2.15828698e-02 -2.23579746e-04] [-2.57766600e-02 7.45962830e-02 -2.19806715e-04] [-5.74098689e-02 -1.35006464e-01 -2.02559781e-04] [-1.52046596e-02 -6.19552225e-03 9.49572397e-03] [ 1.52095757e-02 6.19692994e-03 9.55215659e-03] [ 1.52105314e-02 6.19693291e-03 -9.57728679e-03] [-1.52104941e-02 -6.19482908e-03 -9.56108975e-03] [ 4.16676186e-04 1.21189849e-02 9.84221163e-03] [-4.12921013e-04 -1.21197854e-02 9.80992820e-03] [-4.12065406e-04 -1.21184657e-02 -9.80931133e-03] [ 4.13663702e-04 1.21183890e-02 -9.86505690e-03]] Final stress: [ 1.86686568e-03 6.54766510e-05 -1.12356878e-03 -3.84911484e-08 1.02822401e-07 -6.17475745e-04] Minimization converged after 53 steps. Minimization converged after 53 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.14397219e-04 -7.95615915e-05 -1.55074102e-04] [-8.22769407e-05 7.79615711e-05 1.93541917e-06] [ 1.95773019e-06 -1.38131864e-04 -1.21480410e-04] [-1.12701940e-04 1.44079884e-04 -2.59427535e-04] [-2.41247235e-05 1.50077268e-04 3.58373430e-05] [-1.21545115e-04 2.50072771e-05 6.56394373e-05] [ 1.52242609e-04 8.34372436e-05 2.55708816e-05] [-1.23106032e-04 -8.48413582e-05 1.81047012e-04] [ 3.49277477e-04 4.33438989e-05 4.29585678e-05] [-9.30322667e-05 -1.47016211e-05 -7.22195909e-05] [ 2.06814325e-04 2.53614734e-04 -7.05978964e-06] [-1.43188582e-04 1.58063742e-04 7.76637312e-05] [-1.45305844e-04 -8.48261250e-05 1.07634537e-06] [ 8.19398742e-05 -2.27835309e-04 1.46525842e-04] [-1.91785317e-04 1.24370244e-05 7.12648755e-05] [-2.14818952e-04 -2.73341895e-05 -4.73234881e-05] [ 7.00406780e-05 1.00168800e-04 1.69908279e-04] [-7.92162385e-05 -8.48263061e-05 -2.09721673e-04] [-7.58731103e-06 -4.72162437e-05 3.26163236e-05] [-7.43203794e-05 -5.00037702e-05 -2.48874887e-06] [ 1.49173769e-04 -7.96942287e-05 -3.07356476e-05] [ 8.03262784e-05 -4.40598606e-05 -3.01474159e-05] [ 1.23319685e-04 -1.19331893e-06 8.37294586e-05] [ 8.35199971e-05 -8.39656576e-05 -9.51156631e-08]] Final stress: [0.03276663 0.03331882 0.13518674 0.00101018 0.00064226 0.00047359] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-2.64239515e-06 -5.63780081e-06 -2.94817998e-06] [ 2.52054966e-06 -2.58822863e-06 -3.96625716e-06] [ 3.28829490e-06 3.53354411e-06 -5.84157402e-06] [ 8.09739609e-06 3.57699629e-06 2.31565841e-06] [ 3.32491604e-06 -1.54452388e-06 3.16745395e-07] [-2.20021274e-06 -2.18001475e-07 -1.09365561e-06] [-1.26965837e-06 -2.13570666e-06 -3.26130226e-06] [ 9.85872452e-06 1.17085851e-07 4.02016213e-06] [-1.19113624e-06 5.10522060e-08 4.85369963e-06] [-2.94707533e-07 -1.18389577e-06 -3.16123267e-06] [ 5.60424118e-06 -4.63104258e-06 -7.83786284e-07] [ 1.68881715e-06 -1.41261940e-08 -1.24939107e-07] [-4.04510122e-06 4.41803267e-06 9.42240448e-07] [-9.06113674e-07 3.06431427e-06 3.47010376e-06] [ 3.32649734e-07 4.77010884e-06 -5.22215639e-06] [-2.60311362e-06 -1.61267526e-06 9.23758413e-07] [-2.45687018e-06 1.98773371e-06 6.36576158e-06] [-4.09454103e-06 6.02343631e-06 -6.18097571e-06] [-7.58032410e-06 1.41557619e-06 6.46283312e-07] [-3.76843082e-06 -2.12670841e-06 3.96946248e-06] [-2.70121936e-06 -1.55067157e-06 1.22048086e-06] [-4.19412140e-06 -3.70354918e-06 1.23254260e-06] [ 5.22130046e-06 5.83375117e-06 4.48979956e-06] [ 1.10557125e-08 -7.84470119e-06 -2.18263938e-06]] Final stress: [ 0.03276558 0.03331835 0.13518685 0.00101068 -0.0006424 -0.0004737 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[ 0.01734633 0.00256174 0.04463316] [-0.01120876 -0.00147312 0.04205884] [ 0.01489578 0.0010046 0.04238747] [-0.01599 0.0052246 0.04213898] [-0.02796283 0.05081493 -0.00541911] [-0.02040114 0.00639196 -0.0233136 ] [ 0.08016423 -0.0607162 0.01900544] [ 0.0274957 -0.03607637 -0.00567886] [-0.00451394 -0.01631771 -0.0307066 ] [-0.05453837 0.04987524 0.01167087] [ 0.03275857 -0.01988977 -0.02076191] [-0.00645334 0.01953212 -0.02562858] [-0.0221926 -0.01162972 -0.01621719] [-0.02385646 -0.01094996 -0.0184268 ] [ 0.01516786 -0.01547406 -0.02249257] [-0.0021831 0.0350201 -0.01388719] [-0.00367361 0.00934621 0.00203481] [ 0.00267862 -0.00866445 0.00080787] [-0.00322177 -0.0089007 -0.00604262] [ 0.00406389 0.00918652 -0.00557103] [-0.00022105 0.00026859 -0.00097133] [-0.00048128 0.00169685 -0.0014721 ] [ 0.00259031 -0.00021407 -0.00411145] [-0.00026304 -0.00061732 -0.00403651]] Final stress: [-4.90988599e-04 1.74072549e-04 -4.00918050e-04 3.83353488e-04 -3.08623673e-04 -3.65971867e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.12084362e-04 -2.61542134e-05 2.85038524e-05] [-4.63088626e-05 1.30482160e-04 -9.29205497e-05] [ 1.36259925e-04 -5.33396844e-05 -4.46851465e-06] [-2.55210737e-05 -1.05858752e-04 2.65052066e-05] [-1.91922823e-05 -1.38322038e-04 -4.57813439e-05] [ 6.66801885e-05 -8.56288829e-05 -6.31638881e-05] [ 5.23132698e-06 -1.56255089e-05 7.29224273e-06] [-1.53421563e-05 1.76459089e-04 6.64385679e-05] [-9.02419579e-05 1.91356214e-05 -1.55269485e-05] [ 4.52900004e-05 -1.38055042e-05 9.00959464e-05] [ 9.96084736e-06 2.37922571e-05 1.44908429e-05] [ 5.30643509e-06 -2.42830023e-05 5.34486593e-05] [ 1.04771697e-04 5.76570828e-05 6.71873889e-05] [ 3.83235180e-05 -6.64958451e-06 8.69226972e-06] [-8.36181629e-06 5.61826029e-05 1.31740114e-05] [-2.55167396e-05 -3.94180182e-05 2.03467535e-05] [ 2.42630434e-05 3.53356185e-05 -4.03443051e-05] [-2.27926003e-05 6.01316223e-05 1.22414514e-04] [ 4.22296026e-05 -5.63012267e-05 -2.34718221e-06] [ 7.34616276e-06 8.99663807e-05 1.16108171e-05] [-7.16559562e-05 5.51571596e-05 4.29623772e-05] [-8.78930487e-05 -5.92619975e-05 -1.59039636e-04] [-6.35110589e-05 -1.15916761e-05 -2.66728082e-05] [-1.21409557e-04 -6.80595059e-05 -1.22898273e-04]] Final stress: [ 0.03276438 0.03330038 0.13516543 -0.00100649 0.00036274 -0.00048358] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 2.01177491e-05 1.28079273e-04 -1.68068172e-05] [-1.95840518e-05 -1.62234259e-04 1.57073501e-05] [-2.01175993e-05 -1.28079273e-04 1.66034628e-05] [ 1.95830368e-05 1.62231855e-04 -1.75626981e-05] [-2.47489082e-09 1.32647029e-06 4.23836013e-07] [-1.14416700e-06 -6.60094284e-07 4.19466233e-07] [ 1.14760935e-06 -6.64943614e-07 4.20106274e-07] [ 7.42855642e-10 -3.39070817e-07 8.75124231e-08] [ 2.93853305e-07 1.68956195e-07 8.83379602e-08] [-2.94878927e-07 1.70388717e-07 8.85932335e-08] [-4.17590098e-04 8.02302089e-06 -3.29385034e-05] [ 9.28983048e-05 -2.36845856e-04 -6.79687319e-05] [ 1.64678082e-04 3.59495285e-04 3.77123056e-05] [ 4.17589009e-04 -7.35394089e-06 3.31157864e-05] [-9.34752502e-05 2.36513126e-04 6.81450616e-05] [-1.64099676e-04 -3.59830102e-04 -3.75360582e-05] [ 1.69337779e-05 3.53034696e-05 -9.57537636e-07] [-5.01974736e-05 5.10483799e-05 4.08167158e-06] [-1.69337396e-05 -3.53041181e-05 9.56412609e-07] [ 5.01973537e-05 -5.10481823e-05 -4.06217873e-06] [ 1.06410873e-04 -5.32909838e-05 6.93910116e-06] [-1.23396324e-04 -1.33388380e-04 6.00361159e-06] [-1.06410746e-04 5.32911782e-05 -6.93897779e-06] [ 1.23396088e-04 1.33387800e-04 -6.02111278e-06]] Final stress: [ 1.34509211e-05 1.52735373e-05 1.49591460e-05 -1.70265131e-04 1.68752601e-06 1.96080380e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-2.02841610e-05 1.27767152e-04 -1.86127957e-05] [ 1.94758029e-05 -1.62412572e-04 1.71141479e-05] [ 2.02826087e-05 -1.27770683e-04 1.58562048e-05] [-1.94764198e-05 1.62414271e-04 -1.60494769e-05] [-9.26374802e-10 -5.21294857e-07 -1.90704274e-07] [ 4.50945025e-07 2.61246093e-07 -1.89095349e-07] [-4.49590539e-07 2.59392173e-07 -1.88815998e-07] [-3.50074704e-09 -1.88401589e-06 6.03952576e-07] [ 1.63790822e-06 9.46350401e-07 6.10319872e-07] [-1.63299583e-06 9.39481223e-07 6.09308645e-07] [ 4.17578898e-04 6.26801325e-06 -3.27342848e-05] [-1.63557782e-04 3.60213951e-04 3.72862176e-05] [-9.38879701e-05 -2.35971039e-04 -6.80401090e-05] [-4.17581054e-04 -7.65355544e-06 3.28782328e-05] [ 1.64760500e-04 -3.59518518e-04 -3.71402296e-05] [ 9.26882141e-05 2.36662335e-04 6.81861802e-05] [-1.69391098e-05 3.54329319e-05 -9.47323017e-07] [ 5.01660622e-05 5.11725140e-05 4.06989515e-06] [ 1.69389589e-05 -3.54321766e-05 9.76309744e-07] [-5.01660814e-05 -5.11736084e-05 -4.08374295e-06] [-1.06393253e-04 -5.33453992e-05 6.91080859e-06] [ 1.23367052e-04 -1.33478879e-04 6.01648297e-06] [ 1.06392947e-04 5.33446036e-05 -6.94074798e-06] [-1.23367053e-04 1.33479501e-04 -6.00073544e-06]] Final stress: [ 1.34498402e-05 1.52726136e-05 1.49631918e-05 -1.70273636e-04 -1.69040035e-06 -1.96078570e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.91026719e-05 1.61308551e-04 1.23415362e-05] [-2.05493470e-05 -1.27141536e-04 -1.62719529e-05] [-1.91003886e-05 -1.61302890e-04 -1.66358202e-05] [ 2.05478710e-05 1.27143639e-04 1.36171075e-05] [-5.02797376e-09 2.56715628e-06 7.43265667e-07] [-2.22438105e-06 -1.27966175e-06 7.49740705e-07] [ 2.23127890e-06 -1.28945254e-06 7.51166250e-07] [ 5.57623994e-09 -3.03269231e-06 9.74663773e-07] [ 2.61577858e-06 1.50920008e-06 9.64581052e-07] [-2.62350858e-06 1.52011424e-06 9.65956548e-07] [-4.17601184e-04 7.19724306e-06 3.26941571e-05] [ 9.41543530e-05 -2.36941713e-04 6.71279587e-05] [ 1.63324342e-04 3.59585194e-04 -3.75645776e-05] [ 4.17603705e-04 -8.50742097e-06 -3.20947830e-05] [-9.30270457e-05 2.37591897e-04 -6.65300869e-05] [-1.64454877e-04 -3.58930242e-04 3.81620991e-05] [ 5.01824579e-05 -5.10485878e-05 4.06002496e-06] [-1.69984822e-05 -3.52795508e-05 -8.97817598e-07] [-5.01820325e-05 5.10485765e-05 -4.00860124e-06] [ 1.69983301e-05 3.52810338e-05 9.08942711e-07] [ 1.23381240e-04 1.33255738e-04 5.96550934e-06] [-1.06428436e-04 5.32861122e-05 6.95783959e-06] [-1.23380676e-04 -1.33254404e-04 -5.99314431e-06] [ 1.06427781e-04 -5.32863036e-05 -6.98776539e-06]] Final stress: [ 1.34475103e-05 1.52771360e-05 1.49592858e-05 1.70261099e-04 -1.69267219e-06 1.96079579e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-9.29651817e-06 1.44726944e-04 -2.48019006e-05] [ 3.02297889e-05 -1.11538194e-04 1.16117532e-05] [ 9.29266413e-06 -1.44716823e-04 1.75634598e-05] [-3.02298183e-05 1.11536306e-04 -1.15764120e-05] [ 2.34447932e-09 1.06390624e-06 2.25329468e-07] [-9.24154938e-07 -5.34341761e-07 2.27818513e-07] [ 9.21085815e-07 -5.29853567e-07 2.27169887e-07] [-8.64237532e-09 -4.74875144e-06 1.56291324e-06] [ 4.10774281e-06 2.38008585e-06 1.54890460e-06] [-4.09569967e-06 2.36315050e-06 1.54676840e-06] [ 4.17674560e-04 1.10145226e-05 1.99520358e-05] [-1.58082233e-04 3.50794298e-04 -3.74721621e-05] [-1.00721632e-04 -2.46349370e-04 4.63465967e-05] [-4.17681151e-04 -1.47781165e-05 -1.93288118e-05] [ 1.61339780e-04 -3.48908907e-04 3.80900099e-05] [ 9.74727436e-05 2.48222248e-04 -4.57283603e-05] [-4.89451783e-05 -5.12846387e-05 3.37843236e-06] [ 1.73449423e-05 -3.50235318e-05 -1.63452143e-07] [ 4.89445475e-05 5.12830990e-05 -3.28803164e-06] [-1.73449505e-05 3.50266333e-05 1.37795021e-07] [-1.23165987e-04 1.31583209e-04 5.40161209e-06] [ 1.06767594e-04 5.36781371e-05 7.47917221e-06] [ 1.23165250e-04 -1.31580500e-04 -5.45778500e-06] [-1.06767079e-04 -5.36795125e-05 -7.48285563e-06]] Final stress: [ 1.33902214e-05 1.53377354e-05 1.49552527e-05 1.70350132e-04 1.79804528e-06 -1.96096083e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 5.82826673e-06 -7.97572530e-05 4.80494923e-06] [ 5.82843987e-06 7.97582583e-05 5.02737908e-06] [-5.82623902e-06 7.97580146e-05 -4.61531740e-06] [-5.82975113e-06 -7.97585376e-05 -5.33609135e-06] [ 7.89079551e-10 3.24151260e-07 8.17968644e-08] [-2.80929524e-07 -1.62735546e-07 8.05607270e-08] [ 2.80339611e-07 -1.61440815e-07 8.22488878e-08] [-3.67744003e-10 -1.00117590e-07 -5.89705951e-09] [ 8.63409877e-08 5.01709667e-08 -6.54122267e-09] [-8.62573901e-08 4.96421854e-08 -6.24912475e-09] [ 8.07323985e-10 1.04630631e-04 -9.77936753e-08] [ 7.81005433e-06 2.37906380e-04 1.28239014e-06] [-7.81316389e-06 2.37909075e-04 -1.47725789e-06] [-2.20599872e-10 -1.04371250e-04 7.22585393e-08] [-8.03686296e-06 -2.38037074e-04 -1.31032259e-06] [ 8.03846931e-06 -2.38038214e-04 1.45253928e-06] [ 5.19813216e-05 -1.08382569e-04 2.55858275e-04] [ 5.19812906e-05 1.08382729e-04 2.55872870e-04] [-5.19814298e-05 1.08382532e-04 -2.55866293e-04] [-5.19809252e-05 -1.08382631e-04 -2.55873412e-04] [-6.68562889e-05 -1.30349208e-04 2.94789502e-04] [-6.68568568e-05 1.30349417e-04 2.94796517e-04] [ 6.68566049e-05 1.30349167e-04 -2.94798645e-04] [ 6.68565687e-05 -1.30349139e-04 -2.94807465e-04]] Final stress: [ 4.47799730e-05 2.01986179e-06 1.02349047e-05 7.58055984e-12 -3.52995395e-04 1.90883091e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-5.77897411e-06 -7.96200469e-05 4.11224153e-06] [-5.78217563e-06 7.96208056e-05 5.09551850e-06] [ 5.77775534e-06 7.96236029e-05 -4.44239556e-06] [ 5.78014349e-06 -7.96232720e-05 -4.91176818e-06] [-7.81136045e-10 1.29194590e-07 2.21070967e-09] [-1.10736577e-07 -6.31592765e-08 2.31866193e-10] [ 1.12829979e-07 -6.52839796e-08 1.65710740e-09] [ 3.10143404e-12 -3.15353188e-07 8.12475999e-08] [ 2.73723534e-07 1.57322482e-07 7.91859615e-08] [-2.72724012e-07 1.56779023e-07 7.88892719e-08] [-1.02132669e-09 1.04172357e-04 -1.40014699e-07] [ 8.00763237e-06 2.37763392e-04 -1.51185175e-06] [-8.00302944e-06 2.37759566e-04 1.22729146e-06] [ 3.80756260e-10 -1.04525941e-04 1.20553567e-07] [-7.70110026e-06 -2.37585879e-04 1.48739158e-06] [ 7.69871994e-06 -2.37584024e-04 -1.25184790e-06] [-5.19726021e-05 -1.08175151e-04 2.55805362e-04] [-5.19717653e-05 1.08175172e-04 2.55816653e-04] [ 5.19720264e-05 1.08174921e-04 -2.55804021e-04] [ 5.19720307e-05 -1.08175131e-04 -2.55826144e-04] [ 6.68839348e-05 -1.30413698e-04 2.94677806e-04] [ 6.68840154e-05 1.30413866e-04 2.94690425e-04] [-6.68837892e-05 1.30413702e-04 -2.94688417e-04] [-6.68844966e-05 -1.30413740e-04 -2.94700205e-04]] Final stress: [ 4.47660858e-05 2.02893834e-06 1.02396256e-05 6.16645165e-12 3.52992757e-04 -2.86749773e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 2.19245959e-05 1.95204323e-04 -1.24803448e-04] [-4.69341627e-05 -1.51961794e-04 4.77494754e-05] [-2.19248315e-05 -1.95204326e-04 1.24568920e-04] [ 4.69342987e-05 1.51961808e-04 -4.77253100e-05] [-1.05779285e-10 3.69428883e-08 6.22753776e-09] [-3.19684877e-08 -1.83769412e-08 6.19635929e-09] [ 3.20988898e-08 -1.85823586e-08 6.28997734e-09] [ 1.27917079e-10 -1.29724051e-07 4.53333499e-08] [ 1.12316519e-07 6.47705706e-08 4.55572536e-08] [-1.12377818e-07 6.49639854e-08 4.51170259e-08] [ 3.19835344e-04 3.26332026e-05 1.78764940e-04] [-2.75362159e-04 4.34795364e-04 1.65296424e-04] [-2.32086274e-04 -2.59174953e-04 1.15291706e-04] [-3.19835039e-04 -3.28140548e-05 -1.78746525e-04] [ 2.75518648e-04 -4.34705191e-04 -1.65277878e-04] [ 2.31929538e-04 2.59265627e-04 -1.15273423e-04] [ 8.68699195e-05 -8.42870219e-06 2.43681288e-05] [-7.66010861e-06 -1.64863560e-05 -2.14011082e-05] [-8.68698088e-05 8.42870267e-06 -2.43643483e-05] [ 7.65999121e-06 1.64863567e-05 2.13993035e-05] [ 3.85533626e-06 -3.09579996e-05 -1.67406779e-05] [-2.18892517e-04 1.84854237e-05 2.82985613e-05] [-3.85542818e-06 3.09579953e-05 1.67396779e-05] [ 2.18892567e-04 -1.84854210e-05 -2.82991405e-05]] Final stress: [ 1.69159193e-05 1.17402177e-05 1.50875988e-05 2.26504783e-06 -1.69734597e-04 1.95504076e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-4.71669625e-05 1.52249564e-04 4.60989553e-05] [ 2.19053673e-05 -1.97860790e-04 -1.25625857e-04] [ 4.71662961e-05 -1.52249571e-04 -4.64282143e-05] [-2.19052096e-05 1.97860793e-04 1.25732888e-04] [-8.24376743e-12 -1.80823784e-08 -1.17154642e-08] [ 1.56450806e-08 9.03892812e-09 -1.16552147e-08] [-1.56642772e-08 9.04365294e-09 -1.17622254e-08] [-4.96123800e-10 -1.95716557e-07 6.63942152e-08] [ 1.69938757e-07 9.84004147e-08 6.68227387e-08] [-1.69067641e-07 9.73311269e-08 6.59882022e-08] [-3.19411208e-04 3.30598576e-05 -1.77193243e-04] [ 2.32808273e-04 -2.58358869e-04 -1.15995072e-04] [ 2.74858102e-04 4.35240369e-04 -1.66253221e-04] [ 3.19410763e-04 -3.32936667e-05 1.77212533e-04] [-2.32605417e-04 2.58476246e-04 1.16014534e-04] [-2.75060210e-04 -4.35123938e-04 1.66272345e-04] [-7.81038008e-06 1.63659829e-05 -2.14054591e-05] [ 8.70608915e-05 8.27077379e-06 2.43638310e-05] [ 7.81046662e-06 -1.63659840e-05 2.14100880e-05] [-8.70610700e-05 -8.27077561e-06 -2.43664185e-05] [-2.19231898e-04 -1.85500166e-05 2.82742069e-05] [ 3.38801826e-06 3.08814967e-05 -1.67538064e-05] [ 2.19231736e-04 1.85500084e-05 -2.82765342e-05] [-3.38790590e-06 -3.08814958e-05 1.67543713e-05]] Final stress: [ 1.69186158e-05 1.17345804e-05 1.50930569e-05 -2.28283332e-06 -1.69726731e-04 -1.95494820e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 3.98807825e-05 1.11808849e-04 8.00468784e-05] [-2.25455905e-05 -1.15894334e-04 -1.02974847e-04] [-3.98810194e-05 -1.11808864e-04 -7.99736977e-05] [ 2.25458681e-05 1.15894345e-04 1.02742587e-04] [-8.13448464e-11 1.17125775e-07 4.24898348e-08] [-1.01478183e-07 -5.85285440e-08 4.27345253e-08] [ 1.01464865e-07 -5.86187601e-08 4.22720065e-08] [ 1.99203692e-11 -7.20056215e-09 -3.74837084e-09] [ 6.27313668e-09 3.59378705e-09 -3.70426567e-09] [-6.25657448e-09 3.62004821e-09 -3.75882194e-09] [ 3.32726658e-04 2.05522248e-05 -2.04233416e-04] [-2.79408282e-04 4.14266827e-04 -1.45243606e-04] [-2.21802691e-04 -2.90718661e-04 -1.02559216e-04] [-3.32727020e-04 -2.03390609e-05 2.04247529e-04] [ 2.79223858e-04 -4.14373094e-04 1.45257885e-04] [ 2.21987463e-04 2.90611769e-04 1.02573170e-04] [ 3.12806525e-06 1.84722495e-05 -2.08517594e-05] [-8.11072252e-05 1.19335807e-05 2.44120820e-05] [-3.12793232e-06 -1.84722460e-05 2.08492394e-05] [ 8.11070864e-05 -1.19335798e-05 -2.44080174e-05] [ 2.08632354e-04 -1.82971108e-05 2.87371821e-05] [-1.79198122e-05 3.38443743e-05 -1.62818225e-05] [-2.08632427e-04 1.82971091e-05 -2.87374719e-05] [ 1.79199227e-05 -3.38443704e-05 1.62810159e-05]] Final stress: [ 1.67693514e-05 1.19643330e-05 1.49589804e-05 -1.91785614e-06 1.69964281e-04 1.95781663e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.17921666e-05 2.26892498e-04 -1.36749636e-04] [ 4.97962568e-05 -1.54885424e-04 2.96787469e-05] [ 2.17921590e-05 -2.26892489e-04 1.36606170e-04] [-4.97959558e-05 1.54885426e-04 -2.98064314e-05] [ 1.23475647e-10 4.97913653e-08 2.04323540e-08] [-4.32373259e-08 -2.50408215e-08 2.05656812e-08] [ 4.29901097e-08 -2.47548405e-08 2.02991971e-08] [-2.27757165e-10 -1.64636212e-07 4.59896750e-08] [ 1.42671335e-07 8.25172730e-08 4.57690460e-08] [-1.42444316e-07 8.21145280e-08 4.61767104e-08] [-3.14740123e-04 3.88075721e-05 1.59852814e-04] [ 2.40900996e-04 -2.49917289e-04 1.24029086e-04] [ 2.69190087e-04 4.39446733e-04 1.77074482e-04] [ 3.14740432e-04 -3.86832052e-05 -1.59829020e-04] [-2.41008998e-04 2.49854761e-04 -1.24005239e-04] [-2.69082662e-04 -4.39508575e-04 -1.77050752e-04] [-8.91610788e-05 -6.51432010e-06 2.43432660e-05] [ 9.52445886e-06 -1.50186011e-05 -2.14832525e-05] [ 8.91611781e-05 6.51432008e-06 -2.43439062e-05] [-9.52446277e-06 1.50186056e-05 2.14864496e-05] [ 1.83243812e-06 -3.00960302e-05 -1.69035250e-05] [ 2.23035373e-04 1.93391952e-05 2.80064121e-05] [-1.83251514e-06 3.00960234e-05 1.69004313e-05] [-2.23035294e-04 -1.93391925e-05 -2.80053287e-05]] Final stress: [ 1.69460971e-05 1.16745341e-05 1.51535094e-05 2.48106960e-06 1.69640158e-04 -1.95392019e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-6.01493042e-02 -2.76646921e-02 -5.79072222e-02] [ 6.01615156e-02 2.76667164e-02 -5.66165640e-02] [ 6.01476725e-02 2.76650694e-02 5.76452954e-02] [-6.01599987e-02 -2.76664274e-02 5.68581758e-02] [-1.98639079e-06 -1.29173760e-05 -2.68329792e-05] [ 1.04659446e-05 7.78214886e-06 -2.59870298e-05] [-9.57346808e-06 4.93180756e-06 -2.76297166e-05] [ 2.21576432e-06 -2.52329177e-04 6.65446246e-05] [ 2.14120134e-04 1.22671116e-04 6.06930093e-05] [-2.20254675e-04 1.28734745e-04 6.49621266e-05] [ 1.13921649e-01 9.59000645e-03 -1.95605114e-04] [-9.31584805e-02 4.14635160e-02 -2.05513427e-04] [ 1.66984953e-02 -1.87881922e-01 -2.03934423e-04] [-1.13922772e-01 -9.85037418e-03 1.72273303e-04] [ 9.33825014e-02 -4.13350284e-02 1.81495246e-04] [-1.69216413e-02 1.88009366e-01 1.76474968e-04] [ 3.23040311e-02 3.65254494e-02 -3.51630429e-02] [-3.23055981e-02 -3.65256804e-02 -3.51398892e-02] [-3.23031874e-02 -3.65242222e-02 3.51634370e-02] [ 3.23072402e-02 3.65282766e-02 3.51342414e-02] [-6.40573135e-02 -1.86017073e-03 -4.20601266e-02] [ 6.40551049e-02 1.86005012e-03 -4.20446648e-02] [ 6.40602013e-02 1.86106411e-03 4.20526358e-02] [-6.40551030e-02 -1.85986989e-03 4.20407836e-02]] Final stress: [-2.79398691e-03 2.21417987e-03 6.23177340e-04 6.63817997e-09 -1.41165561e-07 -8.64316872e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.98992524e-02 -1.65985211e-02 -2.54500477e-02] [-1.99000818e-02 1.65990977e-02 -2.52905409e-02] [-1.98994368e-02 1.65979303e-02 2.54523749e-02] [ 1.99005391e-02 -1.65985869e-02 2.52068005e-02] [ 5.70509488e-07 6.46959573e-05 1.78571447e-05] [-5.69165814e-05 -3.32523534e-05 1.81370282e-05] [ 5.52488604e-05 -3.16305143e-05 1.74803683e-05] [ 1.78896848e-07 -6.47329027e-05 1.13448686e-05] [ 5.65277469e-05 3.24650947e-05 1.13803507e-05] [-5.64188842e-05 3.26043779e-05 1.15993699e-05] [ 5.85961531e-03 1.05337433e-02 -3.72613457e-05] [ 8.62811382e-03 -5.26369967e-02 -3.65494943e-05] [ 1.50947408e-02 2.86506907e-02 -3.68779720e-05] [-5.85893903e-03 -1.04351144e-02 3.62815115e-05] [-8.71423800e-03 5.25871940e-02 3.64199297e-05] [-1.50094025e-02 -2.86994575e-02 3.64957819e-05] [-1.17905070e-02 -4.02137379e-03 9.22629620e-04] [ 1.17912611e-02 4.02122970e-03 9.29011006e-04] [ 1.17908474e-02 4.02126837e-03 -9.24644522e-04] [-1.17908566e-02 -4.02132413e-03 -9.27904943e-04] [ 1.02569754e-02 2.07881180e-03 9.43813781e-04] [-1.02566293e-02 -2.07879693e-03 9.47301971e-04] [-1.02576155e-02 -2.07880424e-03 -9.46311986e-04] [ 1.02571708e-02 2.07886016e-03 -9.48789281e-04]] Final stress: [-4.45783940e-04 -2.09882940e-04 -3.67252388e-04 6.21281959e-10 1.60384524e-08 2.11106567e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.38690670e-10 1.53161356e-05 -7.72222356e-05] [-5.87648772e-11 -1.53162762e-05 -7.72184690e-05] [ 1.36038973e-10 -1.53161178e-05 7.72241915e-05] [ 8.61246630e-11 1.53158881e-05 7.72145609e-05] [-1.32673663e-11 2.22304064e-09 7.59916741e-10] [-1.59705235e-09 -1.01359814e-09 5.41417855e-10] [ 1.58918279e-09 -1.02423187e-09 5.15742449e-10] [ 6.25597327e-11 -4.45661885e-09 5.96773519e-10] [ 3.79586818e-09 2.11235807e-09 4.36034986e-10] [-4.01259809e-09 2.30982483e-09 6.58338248e-10] [ 1.16299748e-11 1.12970451e-04 -1.32292730e-09] [ 3.08852849e-05 -7.79239149e-05 -1.51597054e-09] [-3.08853175e-05 -7.79238775e-05 -1.33480426e-09] [ 2.02068751e-10 -1.12961411e-04 1.13811705e-09] [-3.08922365e-05 7.79193235e-05 9.41464113e-10] [ 3.08918546e-05 7.79197790e-05 9.68356668e-10] [-9.21934751e-12 -5.62869283e-05 -2.74136084e-05] [ 6.72478739e-12 5.62869154e-05 -2.74133348e-05] [-4.94387864e-12 5.62868930e-05 2.74134273e-05] [ 1.48875634e-11 -5.62869128e-05 2.74133895e-05] [ 5.53163071e-12 6.41710986e-05 7.38299652e-05] [ 2.53253647e-11 -6.41711464e-05 7.38301775e-05] [ 2.93975016e-11 -6.41711390e-05 -7.38302170e-05] [ 6.45900000e-12 6.41710886e-05 -7.38302295e-05]] Final stress: [ 5.76471463e-04 3.31780330e-04 3.02343605e-04 2.42384140e-13 -4.03235371e-13 -7.47494560e-14] Minimization converged after 27 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.97633576e-12 2.01460912e-05 -4.62299807e-05] [-1.80468569e-13 -2.01460828e-05 -4.62309591e-05] [ 3.26041033e-13 -2.01460972e-05 4.62305087e-05] [ 1.35453315e-11 2.01460848e-05 4.62309462e-05] [-3.20406104e-12 -5.14248089e-11 9.72105729e-12] [ 5.37373479e-11 2.83490731e-11 1.17704180e-11] [-6.03417871e-11 2.81555890e-11 -3.12253001e-12] [ 9.01873227e-12 6.92888413e-10 -1.70229275e-10] [-6.09113981e-10 -3.55666496e-10 -1.73173809e-10] [ 5.95809624e-10 -3.37651684e-10 -1.68164715e-10] [-3.57452956e-12 -5.09103189e-05 1.08908939e-10] [ 1.15180492e-05 -2.70134115e-05 1.25215509e-10] [-1.15180414e-05 -2.70134215e-05 1.26924017e-10] [-2.31803465e-12 5.09101214e-05 -1.35811124e-10] [-1.15178789e-05 2.70135159e-05 -1.31084212e-10] [ 1.15178780e-05 2.70135145e-05 -1.46075196e-10] [-4.65710803e-13 -5.90778584e-05 4.06719193e-06] [ 4.48308057e-13 5.90778591e-05 4.06717184e-06] [ 4.70179451e-14 5.90778581e-05 -4.06718688e-06] [ 1.15632504e-12 -5.90778594e-05 -4.06717334e-06] [-6.91835478e-13 5.80633432e-05 1.00827549e-05] [ 5.68687187e-13 -5.80633429e-05 1.00827346e-05] [-1.68371773e-13 -5.80633429e-05 -1.00827330e-05] [ 5.07871523e-13 5.80633426e-05 -1.00827300e-05]] Final stress: [ 1.37133421e-04 -1.07946183e-04 1.03691535e-05 6.21578898e-14 -3.80280827e-14 5.23754522e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.27354738e-10 3.71738046e-04 -6.84173427e-04] [ 6.06647511e-11 -3.71737696e-04 -6.84223787e-04] [-9.52520417e-11 -3.71738046e-04 6.84221990e-04] [-3.41688067e-11 3.71737686e-04 6.84205238e-04] [-1.68166482e-10 6.91449342e-10 1.91160671e-09] [-4.83430310e-10 -2.01565951e-10 1.92940244e-09] [ 7.33674288e-10 -5.53202539e-10 2.01612915e-09] [-7.09970028e-12 3.20000324e-08 -1.00707090e-08] [-2.76760121e-08 -1.59515715e-08 -9.87701443e-09] [ 2.79150917e-08 -1.61067455e-08 -1.02254197e-08] [ 1.89167570e-10 -5.07523408e-04 1.77604361e-09] [-2.23363323e-04 4.30248142e-04 2.13594270e-09] [ 2.23363019e-04 4.30248535e-04 2.01516313e-09] [ 3.04422043e-11 5.07559347e-04 -3.85090505e-09] [ 2.23332345e-04 -4.30266269e-04 -4.17796573e-09] [-2.23332356e-04 -4.30266225e-04 -4.22528745e-09] [-1.70580494e-11 2.43248982e-04 3.21120756e-04] [ 1.72029058e-13 -2.43248958e-04 3.21120913e-04] [-1.89224747e-11 -2.43248981e-04 -3.21121361e-04] [-5.15018583e-12 2.43248956e-04 -3.21120422e-04] [ 3.90065757e-12 -3.85033611e-05 -2.26473864e-04] [ 6.67892505e-12 3.85033771e-05 -2.26474362e-04] [-1.56203918e-11 3.85033833e-05 2.26474452e-04] [ 2.31009101e-11 -3.85033888e-05 2.26474516e-04]] Final stress: [-9.23475586e-05 1.12598223e-04 -3.23693893e-06 1.71006340e-12 2.36056929e-13 6.18436782e-14] Minimization converged after 10 steps. Minimization converged after 27 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-4.44818473e-08 7.43016023e-05 -2.48041706e-04] [ 3.25695756e-08 5.61477288e-05 2.16408998e-04] [-7.74015472e-08 -7.37856204e-05 2.74646528e-04] [ 5.05568340e-08 -5.63340080e-05 -1.98603248e-04] [ 1.27459192e-08 -1.29698349e-05 -4.24620930e-06] [ 1.15336369e-05 6.53541308e-06 -4.38714130e-06] [-1.16021731e-05 6.58885949e-06 -4.47029270e-06] [ 9.18384117e-10 1.78100807e-05 -5.62673479e-06] [-1.66969953e-05 -9.16200383e-06 -6.25926793e-06] [ 1.67500362e-05 -9.19201559e-06 -6.34263057e-06] [-7.11374791e-08 -8.11277299e-05 1.02899693e-05] [ 1.51071840e-05 6.77475606e-05 -8.88933286e-05] [-1.49806424e-05 6.75914345e-05 -8.89841427e-05] [ 2.19765939e-09 8.56920354e-05 -1.43771677e-05] [-1.89426473e-05 -6.99716630e-05 8.46682408e-05] [ 1.89379605e-05 -6.99664985e-05 8.45936784e-05] [ 5.53824178e-09 1.11643057e-04 2.28246990e-04] [-3.06184800e-09 -8.44886755e-05 2.40743092e-04] [ 4.18236684e-09 -1.11684152e-04 -2.28583683e-04] [-3.05105971e-09 8.46169033e-05 -2.40917580e-04] [-1.02203631e-08 5.72796295e-05 -9.10272509e-05] [ 2.50784256e-09 -1.44751132e-04 -7.00396633e-05] [-2.23838747e-09 -5.72676220e-05 9.11616709e-05] [-5.98378047e-09 1.44746651e-04 7.00408797e-05]] Final stress: [ 2.88745908e-04 1.85210490e-04 1.48325526e-04 -1.15460240e-04 4.22494783e-11 -3.31970150e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.03601432e-08 -1.89477370e-05 1.42010228e-04] [ 7.31003048e-08 6.53224366e-05 -2.91517086e-04] [-1.77516798e-08 1.85998446e-05 -1.27882666e-04] [ 5.15691840e-08 -6.53678304e-05 2.94531474e-04] [ 1.50271861e-08 -2.28896718e-06 -7.82198911e-07] [ 2.19337429e-06 1.15663020e-06 -8.38058239e-07] [-2.26986809e-06 1.21917874e-06 -9.29949131e-07] [ 6.92991570e-08 9.32511203e-06 -3.30233744e-06] [-7.44057864e-06 -4.57276410e-06 -2.94842665e-06] [ 7.31820685e-06 -4.42161956e-06 -2.88373468e-06] [ 1.34690137e-08 -3.62253980e-05 -2.59019056e-05] [-2.70730336e-05 1.37942363e-04 1.75426756e-04] [ 2.70415964e-05 1.37975559e-04 1.75321056e-04] [ 8.04119565e-08 4.10836928e-05 2.40635835e-05] [ 2.28983278e-05 -1.40433994e-04 -1.77063749e-04] [-2.30495334e-05 -1.40253193e-04 -1.77072262e-04] [ 6.17926918e-09 1.69624739e-05 3.02491182e-04] [ 7.01883129e-09 -1.56563540e-04 2.75222961e-04] [ 1.59865154e-09 -1.69798764e-05 -3.02678173e-04] [ 3.78450571e-09 1.56502525e-04 -2.75261337e-04] [ 3.21793203e-09 9.32553275e-05 -1.58887247e-04] [ 1.23460479e-08 -1.64636549e-04 -1.71286495e-04] [ 8.89351536e-09 -9.32854285e-05 1.58940317e-04] [ 2.98437713e-09 1.64631754e-04 1.71228069e-04]] Final stress: [ 2.86646799e-04 1.84852722e-04 1.46553845e-04 1.17221523e-04 2.56182244e-10 -3.08180249e-11] Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[ 0.01047503 0.00973615 0.02387889] [ 0.00097472 0.02288589 0.03888442] [ 0.00063966 0.01534167 0.02721576] [-0.0061255 0.03230447 0.04439658] [ 0.00832701 -0.03644734 0.06509575] [ 0.02283691 0.01585862 -0.01781138] [-0.03057592 0.01667805 -0.00873801] [-0.0092658 0.05362776 -0.06005655] [-0.04301418 -0.03844757 -0.04072969] [ 0.04601031 -0.04401931 -0.02657842] [-0.00079923 0.01529543 -0.02442639] [-0.01315341 -0.01085636 0.00304438] [ 0.01500945 -0.01912401 0.00194069] [ 0.00033364 0.01160428 -0.02588015] [-0.01544445 -0.02143276 -0.00707219] [ 0.01330101 -0.01423183 0.01108444] [ 0.00070767 0.00449426 -0.00705888] [-0.00043537 -0.00251192 0.00214125] [ 0.00015983 0.0013003 -0.00473764] [-0.00086526 -0.00233142 0.00542827] [ 0.00059025 0.00017125 -0.00241404] [-0.00032277 -0.01050609 0.00707705] [ 0.00120599 0.00077147 -0.01344857] [-0.00056957 -0.00016099 0.00876443]] Final stress: [-4.04678345e-04 -5.01333026e-04 -2.49733278e-04 1.93461102e-04 5.55207285e-05 -8.59472622e-06] Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.67837943e-05 7.98124308e-05 1.81675964e-04] [-1.71247872e-05 -7.96714418e-05 5.63948789e-05] [ 1.75814635e-05 -7.94651863e-05 -1.78997602e-04] [ 1.71159956e-05 7.97845088e-05 -6.10801613e-05] [ 1.23010597e-08 -4.65170058e-06 -3.72599407e-07] [ 3.87741813e-06 2.26917085e-06 -2.67215907e-07] [-3.88974546e-06 2.29026602e-06 -2.56714644e-07] [ 5.95107446e-07 -1.11536142e-06 2.40002575e-07] [-5.19030704e-07 -3.63728543e-07 -7.10308629e-07] [-8.46714136e-07 1.11204210e-06 3.37077675e-07] [-9.93965527e-09 2.02503576e-04 2.22600360e-05] [-1.32068604e-04 -6.33761844e-05 -8.63572518e-05] [ 1.31910294e-04 -6.32963352e-05 1.30703896e-04] [ 1.49600113e-07 -1.91003195e-04 -2.13845007e-05] [ 1.21762356e-04 5.73804315e-05 8.70251791e-05] [-1.21976498e-04 5.76769403e-05 -1.29697568e-04] [-1.28032850e-04 3.57793084e-05 5.45039919e-05] [-1.27979123e-04 -3.57424314e-05 5.18540597e-05] [ 1.28025668e-04 -3.57752569e-05 -5.45607640e-05] [ 1.28124055e-04 3.58055706e-05 -5.16058816e-05] [-2.80859599e-05 5.20108252e-05 1.51949863e-05] [-2.80955152e-05 -5.19836354e-05 1.33246306e-05] [ 2.81391846e-05 -5.19827113e-05 -1.52281575e-05] [ 2.81191174e-05 5.20020972e-05 -1.29959784e-05]] Final stress: [ 2.93629504e-04 1.77656496e-04 1.54323000e-04 -6.80978984e-11 1.02714607e-04 2.22997730e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 4.51990768e-06 7.62292020e-06 1.26395199e-04] [ 4.43579432e-06 -7.47301163e-06 -5.89206954e-05] [-4.36384446e-06 -7.61087255e-06 1.25776047e-04] [-4.47203047e-06 7.76661236e-06 -7.44417532e-05] [ 7.68340670e-08 6.80348898e-05 2.59590032e-05] [-5.97898407e-05 -3.42682345e-05 2.62896518e-05] [ 5.96605667e-05 -3.41055033e-05 2.63245125e-05] [ 1.03058422e-07 2.10477896e-04 -6.20279993e-05] [-1.82636542e-04 -1.05402837e-04 -6.22104312e-05] [ 1.82422940e-04 -1.05160889e-04 -6.17893288e-05] [-6.55056359e-09 2.60240044e-05 -3.91821507e-06] [-3.44321560e-05 -4.47116724e-05 -2.34224531e-05] [ 3.44237605e-05 -4.47146520e-05 1.56776238e-05] [-1.88435420e-08 6.81333297e-05 -1.25136885e-06] [-4.70673656e-05 -2.35638966e-06 1.83008538e-05] [ 4.70957550e-05 -2.39450183e-06 -2.07058706e-05] [ 4.66890436e-05 -6.38026036e-05 -1.94219699e-04] [ 4.67199206e-05 6.38296181e-05 -1.92604863e-04] [-4.67008153e-05 6.38710060e-05 1.92921960e-04] [-4.66674276e-05 -6.38450513e-05 1.94194012e-04] [ 5.08444710e-06 -9.18869644e-05 7.50358683e-05] [ 5.04990733e-06 9.19303407e-05 7.21870393e-05] [-5.04813243e-06 9.19507617e-05 -7.02245706e-05] [-5.07838690e-06 -9.19081951e-05 -7.33245223e-05]] Final stress: [-2.67449952e-04 -1.52270130e-04 -1.26426078e-04 1.56263236e-11 -1.11351255e-04 1.20637679e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.15176081e-05 9.63564845e-06 8.78456518e-05] [-1.13671034e-05 -9.66885994e-06 -5.83524893e-05] [ 1.15740795e-05 -9.67676043e-06 -1.46080985e-06] [ 1.14875425e-05 9.56055812e-06 4.32730617e-05] [-3.40681127e-08 -3.24991917e-05 -5.34665927e-06] [ 2.84035603e-05 1.63282476e-05 -5.45971939e-06] [-2.83769894e-05 1.62736728e-05 -5.44089991e-06] [ 1.25176459e-07 3.72005145e-05 -1.39819330e-05] [-3.22066273e-05 -1.87233397e-05 -1.39613272e-05] [ 3.19547180e-05 -1.84336730e-05 -1.38482246e-05] [ 8.47109851e-08 3.39537283e-05 1.47165213e-05] [-5.05399350e-05 -4.99972924e-05 3.18233146e-05] [ 5.02929285e-05 -4.97571476e-05 -2.38084103e-06] [ 2.40780892e-08 7.71392727e-05 -1.94543294e-05] [-4.58260719e-05 -5.64980381e-06 -3.65381358e-05] [ 4.58751609e-05 -5.65015017e-06 -2.45387006e-06] [-4.97091004e-05 -7.00138205e-05 -2.08298638e-04] [-4.97474434e-05 7.00012383e-05 -2.08780202e-04] [ 4.97393321e-05 7.00111800e-05 2.06444193e-04] [ 4.97351713e-05 -7.00088547e-05 2.10356510e-04] [-7.02102695e-06 -9.71056565e-05 6.92399328e-05] [-7.00608885e-06 9.70872370e-05 6.81485166e-05] [ 7.00363881e-06 9.71079766e-05 -6.91065422e-05] [ 7.05196523e-06 -9.71147240e-05 -6.69830805e-05]] Final stress: [-2.67259682e-04 -1.53650230e-04 -1.25767027e-04 -2.25946944e-10 1.11956531e-04 1.15986650e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 3.80568523e-04 -2.95103727e-04 6.04019158e-04] [-3.80568519e-04 2.95103761e-04 6.04015944e-04] [-3.80568541e-04 2.95103813e-04 -6.03997185e-04] [ 3.80568431e-04 -2.95103850e-04 -6.04029887e-04] [ 7.60845250e-12 -3.13271642e-09 2.45105936e-10] [ 2.84276538e-09 1.60648239e-09 1.37168582e-10] [-2.82070012e-09 1.60341734e-09 1.79228493e-10] [-9.18441797e-11 1.23637078e-09 -1.85057591e-09] [-1.17133736e-09 -5.43795897e-10 -1.90184013e-09] [ 1.32373879e-09 -7.66556096e-10 -1.96060715e-09] [ 1.12332300e-04 -2.40245503e-04 -3.08746937e-09] [ 7.28462639e-04 6.43942450e-05 -3.09180985e-09] [-3.50791315e-04 -2.51856970e-05 -3.09009273e-09] [-1.12332413e-04 2.40291223e-04 2.23166844e-09] [-7.28502113e-04 -6.44169793e-05 2.10579658e-09] [ 3.50830958e-04 2.51627070e-05 2.22549834e-09] [-2.48086183e-04 -1.34353277e-04 1.47724884e-05] [ 2.48086170e-04 1.34353281e-04 1.47735551e-05] [ 2.48086174e-04 1.34353265e-04 -1.47732800e-05] [-2.48086193e-04 -1.34353265e-04 -1.47728920e-05] [ 8.34040961e-05 1.37661072e-05 3.47450799e-04] [-8.34040987e-05 -1.37661061e-05 3.47451269e-04] [-8.34040987e-05 -1.37661030e-05 -3.47451043e-04] [ 8.34040940e-05 1.37661026e-05 -3.47451069e-04]] Final stress: [2.97450128e-04 1.78600261e-04 1.49225470e-04 1.66235162e-13 2.59954732e-13 1.22176650e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.07616303e-04 -3.57331241e-04 2.33670333e-04] [ 3.07616367e-04 3.57331204e-04 2.33658377e-04] [ 3.07616445e-04 3.57331195e-04 -2.33633625e-04] [-3.07616330e-04 -3.57331254e-04 -2.33668206e-04] [ 3.44127424e-11 3.16134341e-10 4.43492076e-10] [-1.50221627e-10 -1.62897376e-10 3.87771121e-10] [ 8.74122996e-11 -8.77380391e-11 3.57276986e-10] [ 1.13565306e-10 1.03175475e-08 -5.42171996e-09] [-9.01813679e-09 -5.27543531e-09 -5.46348045e-09] [ 8.77510531e-09 -5.01093461e-09 -5.30316394e-09] [-7.52803018e-05 -1.03455348e-04 -3.84214712e-09] [ 2.50199723e-04 -1.28302905e-04 -3.84426500e-09] [-3.55521718e-04 -1.53404005e-04 -3.79877259e-09] [ 7.52804178e-05 1.03494822e-04 2.10910508e-10] [-2.50233920e-04 1.28283060e-04 2.17288644e-10] [ 3.55555720e-04 1.53384402e-04 2.11606260e-10] [ 1.73992041e-04 -9.66841880e-05 -9.93605618e-06] [-1.73992022e-04 9.66841802e-05 -9.93519271e-06] [-1.73992030e-04 9.66841743e-05 9.93515882e-06] [ 1.73992050e-04 -9.66841826e-05 9.93550324e-06] [-6.67547776e-05 5.50487342e-06 2.69227335e-04] [ 6.67547866e-05 -5.50487789e-06 2.69227615e-04] [ 6.67547899e-05 -5.50487810e-06 -2.69227648e-04] [-6.67547804e-05 5.50487359e-06 -2.69227750e-04]] Final stress: [ 2.95171388e-04 1.78478876e-04 1.51489934e-04 3.34858057e-14 -1.01875262e-13 -1.20187930e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[ 3.07352649e-02 -1.36504826e-02 -8.77890074e-03] [-3.08712224e-02 1.37089995e-02 -1.45174008e-02] [-3.07058727e-02 1.39996844e-02 5.44882057e-03] [ 3.06514899e-02 -1.37193512e-02 1.01229704e-02] [-8.66979359e-05 -1.38214847e-03 3.24808523e-04] [ 1.07343305e-03 7.80519476e-04 2.72390448e-04] [-8.30178038e-04 5.39469591e-04 4.92518235e-04] [-4.40625535e-05 9.49381791e-04 3.95159868e-04] [-1.26166515e-03 -5.54649395e-04 9.10816897e-05] [ 1.33999153e-03 -6.54372983e-04 6.51350917e-05] [ 1.31695733e-02 -3.56088898e-04 1.97270000e-03] [-1.43881287e-02 3.97722917e-02 1.67428736e-03] [ 1.82450041e-02 -4.32185454e-02 1.81150864e-03] [-1.31912460e-02 3.44819678e-04 -3.17747780e-05] [ 1.42065342e-02 -3.97848576e-02 -7.83052892e-05] [-1.79895519e-02 4.31334998e-02 -2.85636392e-05] [ 1.43480467e-02 -8.91576295e-03 6.02426128e-04] [-1.43578867e-02 8.93153829e-03 4.74611902e-04] [-1.43674350e-02 8.92724238e-03 -4.21652346e-04] [ 1.43441873e-02 -8.88615388e-03 -3.04591849e-04] [-9.24863360e-03 5.22126080e-03 -1.14266401e-02] [ 9.24189134e-03 -5.21330996e-03 -1.14962752e-02] [ 9.22983462e-03 -5.19668886e-03 1.16144419e-02] [-9.24267026e-03 5.22370482e-03 1.17212439e-02]] Final stress: [-3.30992698e-04 -5.79108292e-04 -1.78845414e-05 -6.87140907e-07 -3.33498193e-08 -4.51933567e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-2.56041235e-04 -4.54227340e-04 7.79651923e-04] [ 2.61171708e-04 4.42120004e-04 8.85727753e-04] [ 2.55169297e-04 4.48297378e-04 -1.01121420e-03] [-2.68598008e-04 -4.50251475e-04 -1.10198911e-03] [-8.24973861e-06 -5.93698702e-05 1.74843486e-05] [ 5.17844222e-05 3.97324223e-05 1.05338787e-05] [-3.53623223e-05 2.07395000e-05 2.06432177e-05] [-5.42718445e-07 8.87009304e-05 1.23102178e-05] [-4.36729781e-05 -3.82189364e-05 2.50508123e-05] [ 4.43796792e-05 -3.94147860e-05 2.45075277e-05] [-3.13602238e-03 1.23837001e-04 3.81858057e-05] [ 9.86500474e-04 -1.86032003e-03 3.32723462e-05] [ 8.10107385e-04 1.92017892e-03 2.34983971e-05] [ 3.13395562e-03 -8.25557280e-05 6.77105667e-05] [-1.00850082e-03 1.84495408e-03 6.18369145e-05] [-7.83355338e-04 -1.94079320e-03 7.22098308e-05] [ 1.39041802e-04 -1.65383756e-04 -3.07582327e-05] [-1.39142657e-04 1.64063780e-04 -2.73099418e-05] [-1.40923338e-04 1.66017042e-04 3.93741554e-05] [ 1.38970462e-04 -1.66515707e-04 3.81237545e-05] [ 1.36884416e-04 1.29685113e-04 -4.70274953e-04] [-1.36752091e-04 -1.31115085e-04 -4.69891558e-04] [-1.36074978e-04 -1.30080493e-04 4.81892825e-04] [ 1.35273339e-04 1.29920235e-04 4.79423722e-04]] Final stress: [-4.54036907e-04 -4.34558172e-04 -3.57610523e-04 -2.35725081e-08 5.92724055e-08 -2.23163625e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.98724204e-10 -3.32270945e-05 4.55528737e-05] [-4.55971378e-11 3.32267503e-05 4.55571169e-05] [-1.99240381e-10 3.32271534e-05 -4.55447134e-05] [ 3.94572708e-11 -3.32271601e-05 -4.55522977e-05] [-6.48842294e-11 -3.01100456e-09 -9.77331438e-10] [ 3.02530133e-09 1.69791048e-09 -1.31548644e-09] [-2.90084190e-09 1.55032648e-09 -1.23818358e-09] [-4.41079677e-10 3.02596437e-09 -1.46684676e-09] [-1.67296554e-09 -9.25700849e-10 -1.02334841e-09] [ 2.60513161e-09 -1.97837197e-09 -1.67729597e-09] [ 3.21778715e-11 2.02906461e-04 -1.63291063e-09] [-1.22679336e-05 -9.68422623e-06 -2.00898680e-09] [ 1.22679265e-05 -9.68418617e-06 -2.01623647e-09] [ 1.23639599e-10 -2.02902572e-04 3.02801814e-10] [ 1.22646523e-05 9.68218490e-06 2.87670140e-10] [-1.22648360e-05 9.68243187e-06 1.88378957e-10] [-7.27967686e-12 3.59867047e-05 -3.07768883e-05] [-5.58508795e-11 -3.59867531e-05 -3.07766949e-05] [-4.56862326e-12 -3.59867443e-05 3.07767087e-05] [-5.10340659e-11 3.59867247e-05 3.07766222e-05] [-8.51063664e-12 -6.72175248e-05 9.08164859e-05] [ 1.06375919e-11 6.72175021e-05 9.08166244e-05] [ 3.38699544e-12 6.72175154e-05 -9.08166013e-05] [ 1.62292402e-12 -6.72175264e-05 -9.08166585e-05]] Final stress: [ 3.33006342e-04 5.75709240e-04 3.01695504e-04 -9.55624524e-13 -2.43275726e-13 -2.81884603e-14] Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.98673189e-10 1.30048734e-05 8.82563908e-06] [ 5.38232684e-10 -1.30065233e-05 6.37677229e-06] [-4.33628059e-10 -1.30062408e-05 -5.56960600e-06] [ 6.65566380e-10 1.30047766e-05 -8.31605848e-06] [ 6.11024697e-10 5.65190919e-07 2.66521204e-07] [-4.84753740e-07 -2.82284099e-07 2.64407139e-07] [ 4.83198742e-07 -2.80684896e-07 2.63103283e-07] [-9.25119695e-10 1.63581077e-06 -5.93113298e-07] [-1.41278946e-06 -8.16073172e-07 -5.90178462e-07] [ 1.41455601e-06 -8.18154985e-07 -5.91287116e-07] [ 6.87607193e-11 -7.93213229e-05 -8.26193466e-08] [-4.31801444e-05 5.42380808e-05 -8.24147134e-08] [ 4.31799958e-05 5.42382414e-05 -8.28450028e-08] [ 6.06285855e-10 8.25355056e-05 -2.95383025e-08] [ 4.03926944e-05 -5.58458449e-05 -2.92556665e-08] [-4.03937987e-05 -5.58445055e-05 -2.95692038e-08] [ 8.71100692e-11 4.75592102e-05 1.49047411e-05] [-1.25558175e-10 -4.75595883e-05 1.49578511e-05] [ 7.74377229e-11 -4.75596165e-05 -1.49601715e-05] [-1.25285948e-10 4.75592394e-05 -1.49138920e-05] [ 3.66423558e-12 -2.95451590e-05 -5.98857855e-05] [ 9.57601539e-11 2.95451144e-05 -5.98937072e-05] [ 6.23124889e-11 2.95451794e-05 5.99019909e-05] [ 3.35234618e-11 -2.95452247e-05 5.98890156e-05]] Final stress: [ 3.19526554e-04 4.40286522e-04 4.30142555e-04 -2.76999864e-13 3.05041694e-13 -2.47767027e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 3.33940348e-10 -2.54812503e-05 -1.63938477e-06] [-1.46477894e-10 2.54803704e-05 -1.60289280e-06] [ 1.22212942e-10 2.54814941e-05 1.63360548e-06] [-3.57699315e-10 -2.54810512e-05 1.63295441e-06] [-7.40156793e-10 -1.90112622e-08 -6.44797632e-09] [ 1.64004592e-08 1.03158762e-08 -6.88386159e-09] [-1.50077225e-08 8.65806654e-09 -6.04925776e-09] [ 5.11851304e-10 -1.05309561e-09 7.71527287e-10] [ 1.23133315e-09 -6.84291512e-11 3.26859095e-10] [-2.39127701e-09 1.17647819e-09 1.18539739e-09] [-2.09964546e-10 3.55252426e-05 -3.67408286e-09] [-9.69807625e-06 5.63366767e-05 -4.74715009e-09] [ 9.69838118e-06 5.63362494e-05 -4.96909824e-09] [-4.90942287e-11 -3.55367395e-05 2.11287130e-09] [ 9.71025930e-06 -5.63303610e-05 2.05023554e-09] [-9.71017742e-06 -5.63304589e-05 2.28993718e-09] [-7.52347629e-11 5.45218787e-05 -3.61452235e-06] [ 6.62733757e-11 -5.45219405e-05 -3.61426545e-06] [-9.48764955e-11 -5.45218298e-05 3.61454569e-06] [ 4.80162299e-11 5.45218824e-05 3.61395542e-06] [ 3.72868403e-13 -2.14448597e-05 3.70907292e-05] [-7.38888977e-12 2.14447459e-05 3.70911822e-05] [ 1.06133244e-11 2.14447947e-05 -3.70908475e-05] [-3.19929083e-11 -2.14448616e-05 -3.70910249e-05]] Final stress: [ 3.15631821e-05 1.45081597e-04 -1.17576091e-04 -3.74838466e-12 1.22969114e-12 -1.41234392e-13] Minimization converged after 31 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 3.19691197e-08 4.78641916e-06 -7.68752826e-06] [-5.17208167e-08 2.35264012e-06 1.21703650e-05] [ 5.16576129e-08 -4.80341363e-06 6.38988906e-07] [-6.45185699e-08 -2.30247721e-06 1.15981229e-05] [-1.24363911e-07 -9.96914478e-06 -3.90282371e-06] [ 8.73293524e-06 5.12226006e-06 -3.95466719e-06] [-8.47225489e-06 4.82774515e-06 -3.77388793e-06] [ 8.17248996e-08 3.26677217e-06 -2.45499982e-07] [-2.87248591e-06 -1.72095897e-06 -2.87115766e-07] [ 2.69776049e-06 -1.52590480e-06 -1.63244960e-07] [ 2.75685126e-08 -1.37730347e-05 8.86672345e-06] [ 1.02127029e-05 4.91170936e-06 -2.13410642e-06] [-1.02591471e-05 4.97028137e-06 -2.10769349e-06] [-1.93798271e-08 -1.42404422e-05 -1.03373350e-05] [ 1.39354201e-05 9.06500524e-06 6.68980766e-07] [-1.38979960e-05 9.02123741e-06 6.87866861e-07] [-1.55656250e-08 5.03076180e-06 6.21602876e-05] [ 1.02732691e-08 3.60124765e-05 5.99377268e-05] [-1.48063887e-08 -5.01881379e-06 -6.17968006e-05] [ 1.01449194e-08 -3.60277829e-05 -6.04571385e-05] [ 4.84396706e-09 -3.49344562e-05 -6.73606296e-06] [-4.89731078e-09 4.55107742e-05 -8.65538079e-06] [-3.17639807e-10 3.49334529e-05 6.84050753e-06] [ 4.52934468e-10 -4.54951063e-05 8.66971588e-06]] Final stress: [ 1.74902960e-04 2.96593734e-04 1.55850927e-04 -1.05080261e-04 -1.95240330e-11 2.10433394e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 5.77060468e-07 3.37889115e-04 3.82674926e-03] [ 7.11735023e-07 -4.37419071e-04 5.77486772e-05] [ 2.12649131e-06 -3.35750288e-04 3.47150210e-03] [ 7.71647835e-08 4.33678343e-04 8.73956062e-04] [ 1.64832374e-06 -1.87458979e-03 -4.76340578e-04] [ 1.63501541e-03 9.39057220e-04 -4.80103286e-04] [-1.63805969e-03 9.42707025e-04 -4.81857216e-04] [ 1.66555420e-06 4.60025891e-03 -1.54066924e-03] [-3.99726534e-03 -2.30767930e-03 -1.53348949e-03] [ 3.99325988e-03 -2.30344771e-03 -1.53029482e-03] [ 1.77068469e-06 1.84825534e-03 -3.47958677e-04] [-1.93218338e-03 -9.69374206e-04 -2.35713096e-04] [ 1.92877549e-03 -9.65378974e-04 -2.34390902e-04] [-1.37739037e-06 2.05640789e-03 -3.75486363e-04] [-1.46114058e-03 -9.82614930e-04 -4.88236022e-04] [ 1.46335443e-03 -9.85473874e-04 -4.87913581e-04] [ 1.20402232e-07 1.68988432e-04 5.39127568e-04] [ 2.21343044e-07 -3.84574542e-04 5.89466238e-04] [ 1.92855776e-07 -1.66417176e-04 -6.38874928e-04] [ 2.28800538e-07 3.82251871e-04 -5.67718358e-04] [ 2.65912057e-07 -2.44666275e-04 -5.34909727e-04] [-1.37756108e-07 1.08484915e-05 -5.92746979e-04] [-7.43976893e-08 2.50365477e-04 5.78991861e-04] [ 2.26998093e-07 -1.33219886e-05 6.09161513e-04]] Final stress: [ 1.85975948e-04 2.63786520e-04 1.32455825e-04 1.05058300e-04 -2.67902363e-09 1.36493180e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 4.40741962e-09 -1.76892697e-05 4.97270534e-06] [ 5.87323072e-08 5.45830835e-05 1.70954219e-06] [ 7.34861310e-08 1.77096187e-05 -4.71879652e-07] [ 1.47069956e-08 -5.44520088e-05 1.05516538e-05] [-2.00090151e-09 8.27613933e-06 7.40806319e-07] [-7.46480148e-06 -4.20516352e-06 8.99853398e-07] [ 7.45202536e-06 -4.19993652e-06 8.76509947e-07] [ 5.78959513e-09 1.95139657e-05 -4.56965797e-06] [-1.71541088e-05 -9.80926191e-06 -4.71367388e-06] [ 1.71265860e-05 -9.78686365e-06 -4.68128178e-06] [ 1.86095457e-07 1.59727479e-05 1.99071956e-05] [ 2.05379720e-05 6.16826753e-05 -2.01495029e-05] [-2.08698691e-05 6.20892516e-05 -2.01361722e-05] [ 2.16965181e-08 -6.09760909e-05 -2.16507652e-05] [ 1.83100103e-05 -3.93992584e-05 1.84717184e-05] [-1.83486016e-05 -3.93518574e-05 1.84577585e-05] [-2.06797079e-09 1.57541557e-04 -2.26188544e-04] [ 3.57419039e-10 -4.80203657e-05 -2.24210307e-04] [ 5.92974003e-10 -1.57491846e-04 2.26783871e-04] [-3.48227558e-11 4.80369177e-05 2.23396382e-04] [ 2.13503782e-08 1.30086574e-04 4.21727818e-05] [ 2.76656876e-09 -8.51840742e-05 6.14968403e-05] [ 3.35675659e-09 -1.30116001e-04 -4.16065212e-05] [ 2.15524791e-08 8.51894672e-05 -6.20593126e-05]] Final stress: [-1.56283127e-04 -2.66977145e-04 -1.25003989e-04 -1.13424750e-04 -7.06593863e-11 7.46289511e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-6.38644053e-08 -5.19960453e-05 2.11240804e-05] [-3.52540133e-08 1.46185743e-05 -5.13613211e-06] [-9.44075276e-08 5.19108322e-05 2.43982138e-05] [ 8.86459109e-09 -1.44861227e-05 -1.05840612e-05] [-3.59059756e-08 9.89026301e-06 3.01192555e-06] [-8.68833993e-06 -4.93629523e-06 3.08609648e-06] [ 8.77284787e-06 -5.02690352e-06 3.15164383e-06] [-1.86949321e-07 2.85670600e-05 -9.76091596e-06] [-2.42900343e-05 -1.40018812e-05 -9.47645198e-06] [ 2.46838229e-05 -1.44453306e-05 -9.75144840e-06] [-1.18668794e-08 4.04326331e-05 -1.94608894e-05] [-4.90197111e-06 4.29680684e-05 1.56686925e-05] [ 4.94433048e-06 4.29296073e-05 1.56644379e-05] [ 9.63293082e-08 -1.82991057e-05 1.62298135e-05] [-1.46930775e-05 -5.41675115e-05 -1.88150914e-05] [ 1.45422337e-05 -5.39691270e-05 -1.88341445e-05] [-3.61478469e-09 4.41433138e-05 -2.11336521e-04] [-2.27495022e-08 -1.49372797e-04 -2.13636876e-04] [-4.00403161e-09 -4.41225733e-05 2.10776647e-04] [-2.11217730e-08 1.49345781e-04 2.13763824e-04] [-6.30415892e-09 8.36528028e-05 5.75078033e-05] [ 8.46574128e-09 -1.23844476e-04 3.85099856e-05] [ 6.01548255e-09 -8.36587644e-05 -5.71895152e-05] [-3.44490986e-09 1.23867998e-04 -3.89111159e-05]] Final stress: [-1.55792910e-04 -2.66786487e-04 -1.25436392e-04 1.13083779e-04 -3.81629077e-11 -4.90359394e-11] Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.62408968e-05 -1.22906329e-05 2.69498761e-05] [-1.62022942e-05 1.22741651e-05 1.79612635e-05] [ 1.62179940e-05 1.22729860e-05 -2.68818143e-05] [ 1.62292235e-05 -1.22634500e-05 -1.83362335e-05] [ 3.12994051e-08 -3.65226643e-07 -3.04034430e-08] [ 2.66834029e-07 1.40864509e-07 4.14676957e-09] [-3.34211555e-07 2.15800689e-07 -4.35785774e-08] [-1.59532568e-08 3.61078365e-07 -5.03171546e-08] [-2.91341841e-07 -1.57809557e-07 -2.81018130e-08] [ 3.24034527e-07 -1.95238837e-07 -5.08622870e-08] [-6.83022267e-09 -9.67258419e-06 1.64313628e-06] [-3.14084548e-05 8.56343640e-07 -3.44960699e-06] [ 3.14093307e-05 8.47920986e-07 6.72716895e-06] [-2.05444537e-08 1.03440944e-05 -1.51481387e-06] [ 3.08729955e-05 -1.15946600e-06 3.60413109e-06] [-3.08304744e-05 -1.20771095e-06 -6.58801923e-06] [-5.46607459e-05 -5.32453398e-05 1.75632821e-04] [-5.46684622e-05 5.32442826e-05 1.75442443e-04] [ 5.46689500e-05 5.32475083e-05 -1.75628065e-04] [ 5.46641301e-05 -5.32447729e-05 -1.75414805e-04] [-5.78006632e-06 -7.28883664e-05 -6.75703740e-05] [-5.78135732e-06 7.28860205e-05 -6.77177044e-05] [ 5.77662302e-06 7.28864640e-05 6.75954553e-05] [ 5.78021853e-06 -7.28869311e-05 6.77442573e-05]] Final stress: [ 1.79567198e-04 2.95318478e-04 1.51444338e-04 -1.03549051e-10 1.09110228e-04 1.39389341e-11] Minimization converged after 46 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-4.12877639e-04 -1.23954312e-03 -6.58259912e-05] [ 4.12877818e-04 1.23954318e-03 -6.58223496e-05] [ 4.12877674e-04 1.23954310e-03 6.58288443e-05] [-4.12877654e-04 -1.23954320e-03 6.58267088e-05] [ 3.99015867e-11 -2.11289658e-09 -9.48724210e-10] [ 1.66883429e-09 1.00674562e-09 -8.53802223e-10] [-1.81415011e-09 1.07773934e-09 -9.84655107e-10] [ 1.19771179e-10 8.37016678e-10 -4.15164791e-10] [-6.00347438e-10 -5.22058841e-10 -3.82751164e-10] [ 3.84451027e-10 -2.51559718e-10 -2.97718000e-10] [-6.62406478e-04 3.15405445e-04 -1.04280949e-09] [ 3.22348795e-04 -2.44683002e-04 -9.24219307e-10] [-6.99555413e-04 -7.91708947e-04 -1.09271199e-09] [ 6.62406527e-04 -3.15403272e-04 7.69901791e-11] [-3.22350685e-04 2.44681841e-04 -3.81316142e-11] [ 6.99557195e-04 7.91707954e-04 -3.79083389e-11] [-2.42981038e-04 6.30981819e-05 1.08109734e-04] [ 2.42981061e-04 -6.30981820e-05 1.08109854e-04] [ 2.42981049e-04 -6.30981768e-05 -1.08109872e-04] [-2.42981038e-04 6.30981619e-05 -1.08109882e-04] [ 1.80431276e-06 -1.08039482e-04 2.66650218e-04] [-1.80429627e-06 1.08039484e-04 2.66650264e-04] [-1.80430391e-06 1.08039481e-04 -2.66650267e-04] [ 1.80431553e-06 -1.08039486e-04 -2.66650320e-04]] Final stress: [1.79532530e-04 2.87240527e-04 1.40576307e-04 4.73660996e-13 4.06128411e-13 9.86956775e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 3.67993016e-04 -1.52392936e-03 2.99120589e-05] [-3.67993026e-04 1.52392927e-03 2.99378465e-05] [-3.67993145e-04 1.52392897e-03 -2.99146796e-05] [ 3.67993104e-04 -1.52392889e-03 -2.99516110e-05] [-1.20242782e-10 1.19909736e-08 3.78258869e-09] [-1.05239495e-08 -5.95459457e-09 3.94770269e-09] [ 1.06986822e-08 -6.25962043e-09 4.08009923e-09] [ 2.42626565e-10 4.67961625e-09 -8.18269341e-10] [-3.98264388e-09 -2.46230136e-09 -5.31855116e-10] [ 3.66984904e-09 -2.01524292e-09 -5.07136909e-10] [ 6.96169655e-04 2.86210877e-04 -4.73831442e-09] [ 8.39872662e-04 -8.35456894e-04 -4.44275667e-09] [-3.55599859e-04 -3.10544318e-04 -4.66824715e-09] [-6.96169805e-04 -2.86221109e-04 6.36136372e-09] [-8.39863685e-04 8.35462122e-04 6.79200416e-09] [ 3.55591087e-04 3.10549338e-04 6.62058861e-09] [ 2.53797559e-04 1.67011495e-05 3.10855242e-04] [-2.53797538e-04 -1.67011550e-05 3.10855781e-04] [-2.53797579e-04 -1.67011242e-05 -3.10854909e-04] [ 2.53797576e-04 1.67011229e-05 -3.10855809e-04] [ 1.85763345e-05 -1.14640797e-04 -4.18531233e-06] [-1.85763279e-05 1.14640807e-04 -4.18501140e-06] [-1.85763499e-05 1.14640787e-04 4.18563940e-06] [ 1.85763366e-05 -1.14640777e-04 4.18488696e-06]] Final stress: [ 1.78281123e-04 2.73600170e-04 1.29975827e-04 -2.52497688e-13 6.48723785e-13 -8.66294348e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 2.96970819e-04 6.21920077e-04 -9.77928608e-04] [-2.94471030e-04 -6.22890069e-04 -5.62670171e-03] [-2.86093905e-04 -6.19364528e-04 7.44391456e-04] [ 3.29056191e-04 6.30604580e-04 5.44576449e-03] [ 1.78077946e-05 6.70590926e-06 2.83912951e-05] [-3.56684294e-05 -3.05190825e-05 5.80137799e-05] [-1.15626634e-05 1.75418198e-05 1.63174688e-05] [ 1.55224542e-05 1.04688180e-04 1.68882486e-05] [-1.26532780e-04 -7.44020075e-05 -3.84920672e-06] [ 9.52506514e-05 -3.84912883e-05 1.80339887e-05] [-7.40923822e-03 2.48989788e-03 8.84047955e-04] [ 1.13654004e-03 -1.08204533e-03 8.79604204e-04] [ 2.03396235e-03 4.54501049e-03 8.87711317e-04] [ 7.41271567e-03 -2.70539230e-03 -8.08023710e-04] [-9.36245018e-04 1.18584469e-03 -7.86557745e-04] [-2.24773827e-03 -4.42917030e-03 -8.13585651e-04] [-3.79631674e-04 -1.46903764e-03 -1.47295124e-03] [ 3.88941005e-04 1.47373844e-03 -1.58832342e-03] [ 3.84636136e-04 1.46967627e-03 1.48495797e-03] [-3.86258705e-04 -1.47238269e-03 1.59239696e-03] [-7.04624886e-04 5.46923186e-04 5.36167993e-04] [ 7.11353760e-04 -5.45027936e-04 4.62653930e-04] [ 7.04626033e-04 -5.48180653e-04 -5.22421754e-04] [-7.09317314e-04 5.44352300e-04 -4.54998011e-04]] Final stress: [-3.79422517e-04 -6.10264992e-04 -2.80968077e-04 1.27125270e-07 1.52502746e-07 -1.13320145e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 3.92869626e-04 7.98268933e-05 1.35630507e-03] [-4.27958124e-04 -8.46271350e-05 -1.13855249e-03] [-4.03722564e-04 -9.17346300e-05 -2.00191556e-03] [ 3.50019904e-04 1.00803194e-04 2.81847029e-04] [-6.07201100e-05 -1.57572238e-04 8.86352661e-05] [ 1.72506982e-04 1.46104295e-04 5.57065013e-05] [-3.79675427e-05 -2.01520705e-06 1.56272292e-04] [-1.02836292e-06 1.13957689e-04 5.81326006e-05] [-6.63632644e-05 -4.80294785e-05 7.65836895e-05] [ 7.16329255e-05 -5.24708332e-05 7.07563576e-05] [ 2.33029316e-03 -1.73088900e-04 5.76084369e-04] [-1.54908566e-03 2.87639895e-03 5.73946595e-04] [-9.72369599e-04 -1.60155029e-03 5.78072438e-04] [-2.36225475e-03 1.73158670e-04 -2.92018511e-04] [ 1.56736332e-03 -2.84083924e-03 -2.91317044e-04] [ 1.02114670e-03 1.56125293e-03 -2.72589798e-04] [ 8.63642004e-05 -1.58728775e-04 -5.02567078e-04] [-9.58567678e-05 1.60134116e-04 -5.62018300e-04] [-1.00843645e-04 1.61752127e-04 5.34050023e-04] [ 9.76336662e-05 -1.63525713e-04 5.87987553e-04] [ 1.05966403e-04 1.04021337e-04 -2.55441468e-04] [-1.14683773e-04 -1.02052899e-04 -2.85951325e-04] [-1.08920024e-04 -1.04806818e-04 2.83053697e-04] [ 1.05977288e-04 1.03631949e-04 3.24938102e-04]] Final stress: [-4.47558359e-04 -5.44579909e-04 -3.16384910e-04 3.93739651e-08 -9.87314955e-08 -4.40810352e-05] Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-1.13587839e-06 1.40698258e-04 9.75607159e-05] [-3.68345686e-06 -4.59114522e-05 -7.49354106e-04] [-3.88120842e-07 -1.34019962e-04 1.26719607e-04] [-3.07301728e-06 5.68391514e-05 -7.45005667e-04] [-3.79021099e-06 9.76332163e-04 3.07350706e-04] [-8.61905515e-04 -4.87790817e-04 3.14758221e-04] [ 8.71202125e-04 -4.97548904e-04 3.22367960e-04] [-2.62584698e-06 -7.35643472e-05 6.41197473e-06] [ 4.85214143e-05 3.62503848e-05 1.47062755e-07] [-4.36937375e-05 3.04391020e-05 -2.64002681e-06] [-1.11098988e-06 3.73743216e-04 1.19037281e-04] [-4.12559715e-04 -3.11327920e-04 3.75990813e-05] [ 4.15070346e-04 -3.14070573e-04 4.02032430e-05] [-1.31514953e-06 5.69858779e-04 -1.34293726e-05] [-4.16005586e-04 -1.60590338e-04 6.93761088e-05] [ 4.18876990e-04 -1.63748755e-04 7.05069932e-05] [-5.32009360e-07 2.02740395e-04 -5.37587726e-05] [-2.49748506e-07 -8.99309550e-05 -4.93426458e-05] [-4.71578078e-07 -2.01120519e-04 4.33404247e-05] [-1.91618850e-07 9.14039359e-05 7.06091707e-05] [-1.84958363e-07 1.59793854e-04 -3.80994709e-04] [-3.11585168e-07 1.43238360e-04 -3.85238582e-04] [-1.79941952e-07 -1.58557842e-04 3.83680836e-04] [-2.62209577e-07 -1.43155217e-04 3.70094496e-04]] Final stress: [ 1.31329481e-04 1.71006532e-04 2.94275209e-04 -1.13705002e-04 -3.87503887e-09 8.86307154e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 3.48118023e-06 5.38311083e-05 -2.17947777e-04] [-8.12909821e-06 -1.48113190e-04 -6.14245415e-05] [ 5.00261506e-06 -6.08613674e-05 -2.03096630e-04] [-6.44202026e-06 1.51274591e-04 -3.16898225e-05] [-1.15740106e-05 1.10265111e-03 2.47442856e-04] [-9.57465848e-04 -5.39891547e-04 2.46865010e-04] [ 9.83131428e-04 -5.68079990e-04 2.65954328e-04] [ 7.85889847e-06 1.05125501e-03 -1.79496809e-04] [-8.93901678e-04 -5.29867816e-04 -1.74521211e-04] [ 8.76797030e-04 -5.10896840e-04 -1.62036094e-04] [-1.62349480e-06 -1.59025248e-03 -2.58762266e-05] [ 1.29116820e-03 6.83688402e-04 5.16254847e-05] [-1.28793961e-03 6.79940733e-04 5.74511535e-05] [-1.39146275e-06 -1.39516812e-03 1.05831698e-04] [ 1.29249110e-03 8.12752368e-04 2.42555353e-05] [-1.28968478e-03 8.09517427e-04 2.66032499e-05] [-1.55133334e-06 1.09794927e-04 -2.72746688e-05] [ 9.95983615e-07 -2.21438238e-04 -6.13540854e-05] [-1.41206302e-06 -1.08665889e-04 7.98142028e-05] [ 1.13649497e-06 2.20882093e-04 2.30610580e-05] [-5.67565346e-08 -1.43282912e-04 -3.82557013e-04] [-4.82765891e-07 -1.67559008e-04 -4.30571656e-04] [ 3.55896869e-08 1.42619372e-04 4.33864230e-04] [-4.43604313e-07 1.65870257e-04 3.95077730e-04]] Final stress: [ 1.27901250e-04 1.71940256e-04 2.93968315e-04 1.14526167e-04 -9.14761439e-09 -8.88653503e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-0.00535302 0.00716664 0.01533767] [ 0.01045378 -0.03439333 -0.02842356] [-0.00742278 -0.00314265 0.02199863] [ 0.00869384 -0.04401899 -0.02623296] [ 0.00200302 0.01105141 -0.05326129] [-0.05007879 0.00277546 0.00979096] [ 0.03834208 0.02044066 -0.00418044] [-0.01298869 -0.05271337 0.01895505] [ 0.02169359 -0.01036436 0.01546406] [-0.00657821 -0.01708096 0.01020903] [-0.00242166 0.04097675 -0.04370199] [-0.03424391 0.01451095 0.03449506] [ 0.03782647 0.01287304 0.01590911] [-0.01063732 0.03295248 -0.011677 ] [-0.03401358 0.00032975 0.01798179] [ 0.04419434 0.02331851 0.00403433] [ 0.00127071 0.00327167 0.0081073 ] [-0.00150233 -0.01418598 -0.00591704] [ 0.00151357 -0.00342168 -0.00548987] [-0.00122247 -0.0018393 0.00605086] [ 0.00056201 0.01036722 0.00655114] [-0.0006372 0.00043367 0.00123817] [ 0.00106977 0.00565743 -0.0076413 ] [-0.00052324 -0.00496503 0.00040229]] Final stress: [-4.04878255e-04 -1.69927946e-04 -5.45361358e-04 4.00589933e-04 1.51441277e-05 3.55481352e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-3.32558008e-05 1.60890549e-03 -3.97215431e-04] [-3.27917015e-05 9.79578357e-04 4.16824665e-05] [-6.05637881e-04 1.34689986e-03 -2.21631934e-04] [-4.54259113e-04 3.07544425e-04 7.04238364e-05] [ 5.32401903e-05 5.95375490e-04 -8.72059283e-04] [ 8.52979609e-04 -8.52017509e-04 9.33449649e-04] [-6.03696296e-04 -5.44475281e-04 1.38818015e-03] [ 2.42369153e-04 -4.73423912e-05 -5.98794735e-04] [ 8.08440982e-04 -2.03069666e-03 -4.17703760e-05] [-8.58944041e-04 -8.98750902e-04 -5.52021215e-04] [-9.82750385e-05 4.05003511e-04 -1.30142773e-03] [ 1.02516646e-03 -4.69666448e-04 9.12263650e-04] [-6.12191495e-04 -2.47539494e-04 2.33487647e-04] [-7.19706370e-05 4.71856320e-04 2.02613349e-05] [ 8.43103325e-04 -5.50437047e-04 -5.69223336e-05] [-5.50739762e-04 -2.40986776e-04 2.95587849e-04] [ 5.94176887e-05 2.47584204e-05 -2.36488170e-04] [ 7.60759947e-05 -6.61680450e-05 2.69320733e-04] [ 1.56351582e-05 -1.67709735e-04 1.50458625e-04] [ 3.86392931e-05 -2.51913214e-04 -1.74861548e-04] [-2.89545902e-06 1.35965617e-04 -5.61857322e-05] [-5.37830395e-06 4.24222165e-05 -4.30199272e-06] [-3.91383778e-05 3.18815507e-04 2.16164979e-04] [-4.58939452e-05 1.30578282e-04 -1.76004382e-05]] Final stress: [-4.58617347e-04 -2.29096674e-04 -4.73017329e-04 1.69124026e-04 2.50943908e-06 2.46914352e-08] Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-7.16496377e-05 8.34761933e-05 -3.86960956e-03] [-6.61446015e-05 -8.47306334e-05 3.84013289e-03] [ 4.98350554e-05 -1.03647777e-04 3.44889297e-03] [ 7.40363331e-05 9.26126768e-05 -3.27579317e-03] [ 1.37716310e-06 3.55009894e-04 -2.02045724e-05] [-3.25007331e-04 -1.83998706e-04 -7.86023874e-06] [ 3.18570343e-04 -1.78705391e-04 -1.55745564e-05] [-1.35604874e-05 2.14370186e-04 2.00537282e-06] [-1.32176044e-04 -8.14780302e-05 3.57986659e-05] [ 1.65090405e-04 -1.16065950e-04 9.17461275e-06] [-3.01223316e-06 -3.44918714e-04 -1.31987455e-03] [ 4.76075529e-04 4.44685297e-04 -1.19134627e-03] [-4.62189864e-04 4.33253885e-04 -1.42636330e-03] [ 1.19540349e-06 -6.32340596e-04 1.27148214e-03] [ 3.90895020e-04 4.95665531e-05 1.16354382e-03] [-3.99336854e-04 5.57866002e-05 1.38140468e-03] [-1.27945225e-04 1.56499558e-04 -6.58332336e-05] [-1.28659825e-04 -1.55293665e-04 9.23459916e-05] [ 1.28594202e-04 -1.55313927e-04 6.94577719e-05] [ 1.25177252e-04 1.51447288e-04 -1.05140511e-04] [-2.95825716e-04 2.14451609e-06 -1.03496051e-03] [-2.93985688e-04 -8.55444672e-08 -9.38993452e-04] [ 2.94698980e-04 -3.00236538e-06 1.05307925e-03] [ 2.93947821e-04 7.28651825e-07 9.04235760e-04]] Final stress: [ 1.68331019e-04 1.05953363e-04 2.99582434e-04 1.36130373e-07 1.23795866e-04 -1.13713912e-08] Minimization converged after 17 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-5.98966253e-04 -1.16385763e-05 -3.28064860e-04] [ 5.61790383e-04 2.42217610e-05 -3.78288675e-05] [ 5.44810221e-04 3.60560774e-05 2.47156071e-04] [-5.97843056e-04 -2.77728942e-05 -8.67535684e-05] [-5.59254599e-05 -4.75851504e-04 -9.30391176e-05] [ 4.83527740e-04 3.06053747e-04 -1.41607894e-04] [-3.66443930e-04 1.73555902e-04 -5.41844987e-05] [-8.04597027e-05 -4.66963640e-04 1.37076543e-04] [ 4.41352992e-04 3.16772625e-04 1.70377313e-04] [-2.74677705e-04 1.26916003e-04 5.15957785e-05] [-6.94755508e-03 1.88789100e-03 -3.46277495e-05] [ 1.00616408e-03 -2.30364953e-03 -3.34068252e-05] [ 2.26443651e-03 3.87524508e-03 -4.22971949e-05] [ 7.01240191e-03 -4.20965936e-04 8.00277963e-05] [-2.35485971e-03 1.49841546e-03 6.95535564e-05] [-1.01692639e-03 -4.54696004e-03 7.74239619e-05] [ 5.56089888e-04 -7.22095130e-04 9.51887241e-05] [-5.73863775e-04 7.22750295e-04 1.29989430e-04] [-5.71225156e-04 7.19968417e-04 -1.18598809e-04] [ 5.53032883e-04 -7.19354348e-04 -9.86025347e-05] [-4.56058825e-04 9.02370074e-04 4.96290163e-04] [ 4.63536968e-04 -8.98356446e-04 5.17324440e-04] [ 4.62368376e-04 -8.97940964e-04 -5.07290582e-04] [-4.54706919e-04 9.01332551e-04 -4.95701275e-04]] Final stress: [-8.79610074e-06 -2.07315091e-04 4.19169338e-05 8.98122817e-09 2.22260924e-08 -2.10617353e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 2.14300735e-05 -2.00270519e-05 6.44439707e-06] [-2.14299549e-05 2.00271593e-05 6.41484066e-06] [-2.14299440e-05 2.00271221e-05 -6.24307462e-06] [ 2.14301182e-05 -2.00271161e-05 -6.38764602e-06] [ 1.91092946e-10 5.92869885e-08 1.18142806e-08] [-5.16130847e-08 -2.98755673e-08 1.19601460e-08] [ 5.12529935e-08 -2.94449868e-08 1.17494408e-08] [ 4.28886478e-10 2.84917016e-07 -7.40087531e-08] [-2.47248008e-07 -1.42921171e-07 -7.41577540e-08] [ 2.46622545e-07 -1.42066638e-07 -7.40194498e-08] [ 9.20264884e-05 1.21248831e-04 -1.78858307e-08] [ 3.09894467e-06 -8.68314913e-05 -1.78225015e-08] [ 8.52798207e-05 -2.89086049e-05 -1.78533757e-08] [-9.20267604e-05 -1.21474963e-04 2.77359015e-09] [-2.90311863e-06 8.69447652e-05 2.75413805e-09] [-8.54753949e-05 2.90214138e-05 2.69818753e-09] [ 5.07601732e-05 -5.37032555e-06 4.50512677e-05] [-5.07601786e-05 5.37034250e-06 4.50491457e-05] [-5.07601656e-05 5.37033344e-06 -4.50482316e-05] [ 5.07601549e-05 -5.37032536e-06 -4.50529994e-05] [-5.36832268e-05 -3.04724796e-06 -1.07056030e-04] [ 5.36832823e-05 3.04725723e-06 -1.07060564e-04] [ 5.36833011e-05 3.04725587e-06 1.07063687e-04] [-5.36832477e-05 -3.04725015e-06 1.07057205e-04]] Final stress: [ 1.60313523e-04 1.60034730e-04 2.82967666e-04 2.89162344e-13 -1.26825229e-14 -1.21236913e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.58499689e-05 -1.49129768e-04 1.13576041e-05] [-3.58499876e-05 1.49129752e-04 1.14595657e-05] [-3.58500249e-05 1.49129742e-04 -1.14090829e-05] [ 3.58500425e-05 -1.49129800e-04 -1.13358127e-05] [ 9.52794636e-11 -6.24277257e-08 -2.20897386e-08] [ 5.41427288e-08 3.11387948e-08 -2.21296204e-08] [-5.42974009e-08 3.13397269e-08 -2.21720327e-08] [-1.04755671e-10 9.42307232e-09 2.34313358e-09] [-7.99434374e-09 -4.58574678e-09 2.42178533e-09] [ 8.18824797e-09 -4.81767232e-09 2.30786633e-09] [-3.10645648e-05 2.66090688e-05 -4.93560491e-09] [-4.73957654e-05 -8.42518949e-05 -4.92808920e-09] [-4.72816688e-05 -6.89095425e-05 -4.90417149e-09] [ 3.10647066e-05 -2.67428192e-05 2.32817117e-10] [ 4.75116046e-05 8.43186562e-05 2.24972661e-10] [ 4.71656633e-05 6.89765645e-05 2.00899051e-10] [-5.74521820e-05 -9.04590035e-06 -3.67768150e-05] [ 5.74521818e-05 9.04589112e-06 -3.67785491e-05] [ 5.74521950e-05 9.04588531e-06 3.67787534e-05] [-5.74521894e-05 -9.04589829e-06 3.67763583e-05] [ 5.46808369e-05 -5.04141214e-06 1.01766346e-04] [-5.46808428e-05 5.04140927e-06 1.01766541e-04] [-5.46808513e-05 5.04140903e-06 -1.01765597e-04] [ 5.46808476e-05 -5.04141333e-06 -1.01765884e-04]] Final stress: [-1.31593467e-04 -1.31255192e-04 -2.63890258e-04 1.19021482e-13 -1.41878441e-13 1.21377601e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.62090820e-05 -1.24577699e-04 1.28244923e-05] [ 3.62090444e-05 1.24577733e-04 1.29453808e-05] [ 3.62090131e-05 1.24577747e-04 -1.29115483e-05] [-3.62090157e-05 -1.24577724e-04 -1.28187788e-05] [-1.11851356e-10 -9.69250926e-08 -2.97440684e-08] [ 8.39378180e-08 4.85494001e-08 -2.97025803e-08] [-8.38113915e-08 4.83505210e-08 -2.97347464e-08] [-1.23140302e-11 -5.45934096e-08 1.85091139e-08] [ 4.72702804e-08 2.73000466e-08 1.84763378e-08] [-4.72343544e-08 2.72646682e-08 1.84677972e-08] [ 2.46401858e-05 3.27885271e-05 -3.62612150e-09] [ 2.44059848e-05 -5.73356066e-05 -3.61916322e-09] [ 7.93577016e-05 -8.58321338e-05 -3.66439209e-09] [-2.46402246e-05 -3.28447530e-05 1.41765512e-09] [-2.43573000e-05 5.73637443e-05 1.42898603e-09] [-7.94063382e-05 8.58602062e-05 1.35408885e-09] [ 5.26747626e-05 -7.10896196e-06 -4.15077224e-05] [-5.26747567e-05 7.10896512e-06 -4.15082622e-05] [-5.26747554e-05 7.10896539e-06 4.15085610e-05] [ 5.26747620e-05 -7.10896323e-06 4.15073740e-05] [-5.52876595e-05 -3.41684344e-06 9.64079082e-05] [ 5.52876495e-05 3.41684733e-06 9.64097467e-05] [ 5.52876511e-05 3.41684796e-06 -9.64090401e-05] [-5.52876608e-05 -3.41684449e-06 -9.64076741e-05]] Final stress: [-1.31688960e-04 -1.31417089e-04 -2.63635113e-04 3.14278058e-14 -6.68933044e-14 -1.21685086e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 7.10051667e-06 -2.47842227e-03 -3.64977749e-03] [-6.40057855e-06 -1.61707395e-03 -2.31354099e-03] [ 2.74366003e-06 2.45849992e-03 -5.68641511e-03] [-1.09293757e-05 1.58100305e-03 1.27952033e-04] [-3.65857803e-06 1.69506412e-03 6.45580407e-04] [-1.44008531e-03 -8.29587856e-04 6.18972113e-04] [ 1.45469858e-03 -8.42437348e-04 6.35190470e-04] [-6.11021837e-06 -4.65849295e-03 1.75570023e-03] [ 4.08613135e-03 2.33031605e-03 1.81662449e-03] [-4.08062830e-03 2.32015866e-03 1.81890182e-03] [ 1.75935002e-06 -2.08606218e-03 4.47261827e-04] [ 3.01436850e-03 7.88789008e-04 -2.74212938e-03] [-3.01673637e-03 7.92236741e-04 -2.73477102e-03] [ 1.41059498e-06 -2.42768457e-03 8.88095969e-04] [ 9.48194335e-04 1.48697030e-03 4.04434281e-03] [-9.50006828e-04 1.48975343e-03 4.06119186e-03] [-7.08598176e-07 1.43501997e-03 3.06045019e-04] [ 3.59684479e-08 -6.81397778e-04 1.32919631e-03] [-1.07961622e-06 -1.42866251e-03 -1.37172801e-04] [-3.68040610e-07 6.66987606e-04 -1.30181345e-03] [ 3.22534479e-07 -1.19902767e-03 -1.03934283e-03] [ 1.18032194e-07 -1.08343601e-03 -8.75585173e-04] [-3.11097208e-08 1.21019802e-03 1.05832341e-03] [-1.40515508e-07 1.07728821e-03 9.27169475e-04]] Final stress: [-2.10035507e-04 3.93197846e-06 -9.47989726e-05 -3.28818772e-04 2.46989472e-08 3.34259284e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-1.36374841e-03 7.41523069e-03 -1.24538714e-03] [ 1.05981336e-03 -2.64463488e-03 3.61465255e-03] [ 3.12055580e-04 7.00460275e-03 -1.29514961e-03] [ 2.69043695e-03 -2.72617260e-03 3.88002516e-03] [-2.17616669e-03 -4.68103334e-03 -1.48608240e-02] [-5.75496575e-03 4.05288431e-03 5.19358188e-03] [ 5.90826067e-03 2.70744795e-03 2.35609235e-03] [-2.09461316e-04 8.57735064e-04 -3.23885490e-03] [-4.73862039e-03 -3.49144040e-03 3.39282725e-03] [ 3.98683901e-03 -1.90795416e-03 4.69817660e-03] [-1.37621581e-03 8.39871955e-03 2.27475860e-04] [ 5.60294620e-03 -4.58479139e-03 -6.12923014e-04] [-3.89228477e-03 -6.71933384e-03 -1.35821290e-03] [-1.75987998e-03 8.36350717e-03 1.42667227e-03] [ 5.87990210e-03 -4.87859833e-03 8.86077036e-04] [-3.73139456e-03 -6.66011786e-03 -3.34759708e-03] [-1.65189012e-04 4.47319376e-04 -4.60577979e-04] [-1.54442660e-04 1.02964272e-03 2.18141105e-04] [ 1.12264012e-05 5.25592975e-04 3.12658008e-04] [-1.52501232e-05 7.88929216e-04 -4.55212649e-04] [-6.21992672e-05 -5.94201149e-04 -1.91269052e-03] [-1.43027146e-04 -9.90289642e-04 2.44961783e-03] [ 6.34938441e-05 -7.92361927e-04 3.76201777e-03] [ 2.78717488e-05 -9.20682252e-04 -3.63058586e-03]] Final stress: [-3.38113861e-04 -9.62825554e-05 -2.13223288e-04 3.72046252e-04 -8.97465866e-06 1.20293085e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 45 steps. Final forces: [[ 0.01241828 0.01552159 -0.06558955] [-0.00332602 -0.01660131 -0.07254432] [-0.01302572 -0.01512228 -0.0620887 ] [ 0.00154872 0.01690398 -0.05915546] [-0.00301602 0.04794395 0.02844727] [-0.04008282 -0.02085645 0.02725083] [ 0.04589847 -0.02770365 0.03115384] [-0.0008608 0.08194402 0.0010689 ] [-0.06983205 -0.03996226 0.00224724] [ 0.07140557 -0.04188965 0.00073857] [-0.02295938 -0.09207686 0.01012201] [ 0.07294358 0.00513331 0.03869232] [-0.0343115 0.10816204 0.01304473] [ 0.02310786 -0.06256634 0.03973291] [ 0.06025477 0.07145393 0.01026817] [-0.09953312 -0.0304016 0.03627148] [-0.00310894 0.00692155 0.01097447] [ 0.01477515 0.004878 0.0125391 ] [ 0.00206137 -0.00655002 -0.00411241] [-0.01522566 -0.00497896 -0.01028982] [ 0.01433582 0.01303056 0.00719146] [ 0.00401127 0.00174549 0.00365508] [-0.01344189 -0.0130809 0.00084162] [-0.00403693 -0.00184812 -0.00045974]] Final stress: [ 0.00025701 0.00018157 -0.00051975 0.00032693 0.00035801 0.00035885] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 45 steps. Final forces: [[-9.53314851e-04 9.86214620e-03 -1.20641613e-02] [-2.79264438e-04 -1.11719268e-02 -1.19033878e-02] [ 2.76736884e-04 -9.77870767e-03 -1.32724228e-02] [ 3.57555305e-04 1.10678850e-02 -1.17275256e-02] [-8.48650590e-05 -1.63295262e-02 -3.81889899e-04] [ 1.42842913e-02 8.25935516e-03 -4.89262823e-04] [-1.41927482e-02 8.10862967e-03 -3.12939543e-04] [-1.01272158e-03 -1.88439733e-02 7.32053628e-03] [ 1.71509336e-02 1.05367349e-02 7.97039084e-03] [-1.52278601e-02 8.25334184e-03 6.50535590e-03] [ 1.39503567e-02 2.38692884e-02 3.26736100e-03] [-2.53224620e-02 3.25545545e-03 2.23966508e-03] [ 1.39757361e-02 -1.68889339e-02 3.95025368e-03] [-1.39540068e-02 1.93812712e-02 5.22168930e-03] [-1.23160688e-02 -2.49734801e-02 6.15919149e-03] [ 2.34401358e-02 -4.62151079e-03 4.30844614e-03] [ 5.73145708e-04 1.39549256e-04 -1.16607207e-03] [ 1.79808791e-03 -3.05253968e-03 -8.07165034e-05] [-6.24105976e-04 -1.70640864e-04 1.22609041e-03] [-2.10871125e-03 3.02036415e-03 1.60317098e-03] [-1.28681002e-04 8.25911061e-04 2.85238077e-04] [-2.65609751e-04 -1.19167666e-03 1.39161712e-03] [ 1.94672963e-04 -7.61176848e-04 -9.78561530e-05] [ 4.68767661e-04 1.20416068e-03 4.72282540e-05]] Final stress: [-2.80203587e-04 -2.25204796e-04 -1.83294004e-04 -9.12304761e-05 7.41006868e-05 -8.19910969e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[ 2.67933111e-03 1.88863124e-02 -1.03815389e-01] [ 7.99224204e-03 -2.93293461e-02 -1.06067340e-01] [-2.94016422e-03 -1.87577079e-02 -1.01791610e-01] [-6.34363029e-03 2.99114119e-02 -1.12122053e-01] [ 2.74261819e-03 6.12804274e-02 3.75703415e-02] [-5.80959784e-02 -3.41796672e-02 4.05931451e-02] [ 5.35266624e-02 -2.83839659e-02 3.69994108e-02] [-1.39834396e-03 -3.79012631e-02 3.20852897e-02] [ 3.47260639e-02 2.05420735e-02 3.32776630e-02] [-3.25503179e-02 1.76765077e-02 3.16868197e-02] [ 3.14772209e-02 -4.95374932e-03 4.50843083e-02] [-1.34712073e-02 4.11391272e-02 3.66728855e-02] [-1.31400451e-02 -9.73616760e-03 2.40294598e-02] [-3.11389742e-02 -1.01437024e-02 1.93565936e-02] [ 2.58002872e-02 -3.39874676e-02 2.64546122e-02] [-6.12777691e-05 1.76994876e-02 3.92067711e-02] [ 2.48069569e-03 3.40259003e-03 5.46750417e-03] [-4.99136960e-04 -4.72466300e-03 2.19219309e-03] [-1.65434918e-03 -2.99071622e-03 4.11689076e-04] [-2.67175443e-05 4.53581212e-03 3.23239932e-03] [ 2.98016827e-03 -5.80988889e-04 5.38620633e-03] [ 8.30727957e-03 -6.34878914e-03 4.60445246e-03] [-3.07776413e-03 6.50888727e-04 -2.49056067e-04] [-8.31466240e-03 6.29355573e-03 -2.66297790e-04]] Final stress: [-2.91632545e-04 -1.26123206e-04 -3.83028642e-04 -1.01782337e-04 7.62000859e-05 -1.23533802e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 45 steps. Final forces: [[-0.0005521 0.00540852 -0.01051676] [-0.00175632 -0.007739 -0.01592816] [ 0.00210273 -0.00531009 -0.01081078] [ 0.0011558 0.00768811 -0.01627363] [-0.00131655 -0.00076318 0.00498598] [ 0.00192319 0.00188829 0.00418578] [ 0.00068278 -0.00113436 0.00588473] [ 0.00094568 0.03453395 -0.00281352] [-0.03112138 -0.01850274 -0.00347955] [ 0.02881183 -0.01607365 -0.00203241] [-0.01170995 -0.01247656 0.00893214] [ 0.01661126 -0.00305285 0.00430736] [-0.00474429 0.02290144 0.00767314] [ 0.01301578 -0.01518448 0.00453954] [ 0.00633646 0.0153655 0.00880148] [-0.02076301 -0.00753745 0.00589465] [-0.00101757 0.00067208 0.00219011] [ 0.00075511 -0.00090751 0.00120452] [ 0.00063692 -0.00062439 -0.00034342] [-0.00055375 0.00091481 -0.00024662] [-0.00059935 0.00053042 0.00308593] [-0.00091956 -0.00209328 0.00217208] [ 0.00112933 -0.0005368 -0.00055797] [ 0.00094696 0.00203322 -0.0008546 ]] Final stress: [-0.00017708 -0.00014623 -0.00024902 0.00011656 0.00010886 0.00011754] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 116 steps. Final forces: [[-2.06097541e-03 6.59321819e-03 1.28798356e-03] [ 7.30039409e-03 -2.08117174e-03 4.34884909e-03] [-5.79313428e-03 3.15135610e-03 -8.79859549e-05] [ 5.70841792e-03 1.27804329e-03 3.71879442e-03] [-1.64102396e-03 1.11563948e-02 -9.61653353e-04] [-7.61489212e-03 -5.98740146e-03 1.91050230e-03] [ 5.10097566e-03 -4.88589493e-03 -5.63077942e-03] [ 3.47860503e-03 -9.26621456e-03 8.41715344e-03] [ 9.10862895e-03 3.72912720e-04 -9.02218268e-04] [-1.29686027e-02 1.22685485e-02 -9.80194268e-03] [-2.57227936e-02 -9.25156895e-03 -3.17786314e-03] [ 2.20340919e-02 1.24205767e-03 -2.01901754e-03] [ 6.46622215e-03 5.62490514e-03 3.10883032e-03] [-7.49069450e-03 -1.13420597e-02 3.71175556e-03] [-1.39318854e-03 -1.33935943e-02 -7.12294879e-04] [ 3.97252454e-04 1.38160709e-02 -1.03367144e-03] [-2.02407914e-04 -6.51995836e-04 2.73171361e-03] [-4.79016724e-04 -2.35816736e-03 -2.33037738e-03] [ 2.22324687e-03 -1.46245149e-03 -1.62970781e-03] [ 2.01709381e-04 -4.74610294e-04 2.84478246e-03] [ 1.41820313e-03 3.61190133e-03 1.82728762e-03] [ 3.47265357e-03 2.67818458e-03 -8.54030894e-04] [-6.52060414e-04 3.00950394e-04 -3.16952869e-03] [-8.91610952e-04 -9.39413086e-04 -1.59658094e-03]] Final stress: [ 0.03489128 0.03512973 0.14268531 -0.00057717 -0.00037779 0.00043718] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-3.54920856e-05 8.06745443e-05 7.34710622e-05] [-1.94435497e-05 -9.40631971e-05 -1.22806515e-04] [ 3.54921109e-05 -8.06744898e-05 -7.34537691e-05] [ 1.94436955e-05 9.40628451e-05 1.22440917e-04] [ 2.68431878e-10 2.27143260e-07 7.62043937e-08] [-1.96532165e-07 -1.13744520e-07 7.57723283e-08] [ 1.96134540e-07 -1.13210103e-07 7.56850331e-08] [-7.11730837e-11 -4.98399806e-08 9.55635671e-09] [ 4.32965113e-08 2.49812916e-08 9.64303515e-09] [-4.32232019e-08 2.48884692e-08 9.64019204e-09] [ 1.79957776e-04 -1.80038254e-05 2.35709980e-05] [-8.58563524e-05 1.77056286e-04 4.19536332e-05] [-3.19009606e-05 -7.36354653e-05 2.37630861e-05] [-1.79957519e-04 1.82225824e-05 -2.35404688e-05] [ 8.56669766e-05 -1.77165831e-04 -4.19232871e-05] [ 3.20899895e-05 7.35264359e-05 -2.37327380e-05] [-2.60622369e-05 2.46430608e-05 7.88598767e-06] [ 4.48164208e-05 3.49709212e-05 4.98568499e-06] [ 2.60622432e-05 -2.46431719e-05 -7.88774268e-06] [-4.48163948e-05 -3.49708677e-05 -4.98068714e-06] [-7.71903961e-05 -2.90332946e-05 5.45248299e-06] [ 8.47651698e-05 -6.80652617e-05 1.45005824e-06] [ 7.71903803e-05 2.90333432e-05 -5.45274470e-06] [-8.47651401e-05 6.80651667e-05 -1.45245918e-06]] Final stress: [ 1.43555535e-05 1.47863651e-05 1.21266901e-05 -1.06380756e-04 -4.44072928e-07 -1.22315376e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-7.33125625e-05 -1.74582567e-05 7.09035567e-05] [ 1.16273957e-04 5.35626225e-05 -1.87745681e-04] [-8.17898859e-05 1.14898947e-04 3.62018364e-05] [ 5.69762749e-05 -1.40963645e-05 -2.25662511e-04] [-2.51146781e-05 2.00599851e-06 4.75629350e-05] [ 8.99300217e-05 -8.70910344e-05 8.06841623e-05] [-1.09423043e-04 1.29343998e-04 -4.11701486e-05] [ 6.35156650e-05 -3.80761595e-06 -7.44461981e-05] [-3.75795815e-05 -1.23486644e-04 -2.29931082e-05] [-2.82037493e-05 1.14281904e-04 -2.30911393e-05] [-2.95666816e-06 -1.58604041e-04 1.11823206e-04] [ 2.54990325e-05 1.93589529e-05 7.52528122e-05] [ 9.33355601e-05 1.78352100e-04 -8.03585615e-05] [ 3.41915101e-06 -6.65758942e-06 4.28037517e-05] [ 8.18562298e-05 1.80597551e-05 2.98986855e-05] [ 4.17632610e-05 6.64087225e-05 5.43388344e-05] [-5.73260465e-05 -1.00172103e-04 5.66505566e-05] [-2.44005724e-05 -2.50266078e-05 -7.33007197e-05] [-7.63276035e-06 -1.04910149e-04 7.17006444e-05] [-1.24595081e-05 3.14339812e-05 5.00033770e-05] [ 2.88872647e-05 -4.06165773e-05 -2.34161568e-05] [ 1.51382684e-05 -9.17245859e-05 -4.40093352e-06] [ 3.75215846e-07 -4.12279805e-05 1.36844041e-04] [-1.56770846e-04 8.71725686e-05 -1.08083241e-04]] Final stress: [ 3.18812900e-02 3.37438134e-02 1.34816675e-01 -9.21509298e-05 -1.43167581e-06 2.05921209e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-5.59239795e-06 2.64148738e-04 -2.86391599e-04] [-9.63212907e-06 -2.54502542e-04 1.86508196e-04] [ 5.59223360e-06 -2.64148409e-04 2.86015235e-04] [ 9.63209371e-06 2.54502419e-04 -1.86432404e-04] [ 1.24299143e-11 1.10931770e-08 -2.76905959e-09] [-9.58436228e-09 -5.55255274e-09 -2.79894319e-09] [ 9.58230933e-09 -5.53536872e-09 -2.78919868e-09] [-2.50135615e-10 -2.20692584e-07 7.58330063e-08] [ 1.91076515e-07 1.10537807e-07 7.54460984e-08] [-1.90666405e-07 1.09997583e-07 7.53619476e-08] [ 3.28737684e-04 -3.10413144e-05 -7.02743963e-05] [-2.32236580e-04 4.21584351e-04 -1.70817288e-04] [-8.42941157e-05 -1.19260294e-04 2.04648251e-05] [-3.28738011e-04 3.07834337e-05 7.03015870e-05] [ 2.32460002e-04 -4.21455175e-04 1.70844271e-04] [ 8.40711280e-05 1.19388873e-04 -2.04378478e-05] [-1.13065855e-04 -5.52923448e-05 1.67496890e-05] [ 5.84771921e-05 -3.13623740e-05 2.42237681e-05] [ 1.13065820e-04 5.52922659e-05 -1.67441995e-05] [-5.84772036e-05 3.13624856e-05 -2.42262455e-05] [-1.14032128e-04 8.19425424e-05 -3.77387704e-06] [ 9.19952998e-05 1.45070023e-05 5.98119198e-06] [ 1.14032082e-04 -8.19424380e-05 3.77166532e-06] [-9.19952847e-05 -1.45070682e-05 -5.98085503e-06]] Final stress: [ 1.50920160e-05 1.40813942e-05 1.14472233e-05 1.07120567e-04 -1.32259703e-06 -1.20957479e-04] Minimization converged after 44 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.36372870e-05 2.37307281e-04 3.66016881e-05] [ 1.13580080e-04 -2.13053167e-04 2.59610541e-04] [ 4.36372579e-05 -2.37307284e-04 -3.67183079e-05] [-1.13580217e-04 2.13053184e-04 -2.59692033e-04] [-6.84598079e-11 4.87750395e-08 1.69489063e-08] [-4.21837721e-08 -2.42675197e-08 1.68940792e-08] [ 4.23552242e-08 -2.45288755e-08 1.70382169e-08] [ 5.90152905e-11 -1.00261693e-07 3.04862273e-08] [ 8.68015320e-08 5.01086914e-08 3.05846601e-08] [-8.68575600e-08 5.01551940e-08 3.03641193e-08] [ 4.15460509e-04 5.37539947e-05 3.25281411e-04] [-1.53758884e-04 3.63037362e-04 3.06525798e-04] [-3.27500474e-04 -1.51564201e-04 7.34687564e-05] [-4.15460552e-04 -5.37307088e-05 -3.25263168e-04] [ 1.53738805e-04 -3.63048891e-04 -3.06507552e-04] [ 3.27520710e-04 1.51552448e-04 -7.34505129e-05] [ 1.40430039e-04 -3.07937093e-05 5.45384805e-05] [-3.46506554e-05 -2.30571561e-05 -1.06060211e-05] [-1.40430059e-04 3.07937102e-05 -5.45377894e-05] [ 3.46506281e-05 2.30571568e-05 1.06074237e-05] [ 8.55746072e-05 -2.12509730e-05 -3.05096696e-05] [-1.43646091e-04 2.03554233e-07 3.45053336e-05] [-8.55745830e-05 2.12509693e-05 3.05083819e-05] [ 1.43646060e-04 -2.03551200e-07 -3.45050762e-05]] Final stress: [ 1.64760479e-05 1.27414272e-05 1.12291784e-05 -1.22048273e-06 -1.03145432e-04 1.21207353e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 8.25131802e-06 1.43086849e-04 -1.03731897e-05] [ 1.60544202e-05 6.20035288e-07 -9.68374232e-05] [-8.25164352e-06 -1.43086868e-04 1.00997686e-05] [-1.60544406e-05 -6.20041509e-07 9.66132028e-05] [ 1.82847204e-10 2.21943396e-07 6.44604021e-08] [-1.92272726e-07 -1.11135847e-07 6.42680887e-08] [ 1.92086620e-07 -1.10802425e-07 6.46326645e-08] [-2.49398908e-10 -1.71067153e-07 5.73453726e-08] [ 1.48433416e-07 8.58250645e-08 5.75937014e-08] [-1.47989855e-07 8.52682027e-08 5.71536820e-08] [-1.28218082e-04 -4.79179593e-05 -2.45392467e-04] [ 6.70993816e-05 -8.03260884e-05 -2.09701532e-05] [ 1.44223757e-04 1.97159889e-04 -7.05273424e-05] [ 1.28217886e-04 4.77986061e-05 2.45436180e-04] [-6.69957654e-05 8.03860104e-05 2.10139075e-05] [-1.44326910e-04 -1.97100453e-04 7.05710204e-05] [-1.49183227e-05 1.78307116e-05 -9.10420368e-06] [ 6.61446229e-05 1.70002370e-05 2.20789329e-05] [ 1.49183060e-05 -1.78307161e-05 9.10839818e-06] [-6.61446876e-05 -1.70002425e-05 -2.20784230e-05] [-1.41496988e-04 1.50249433e-06 1.80609069e-05] [ 1.80980505e-05 1.19844437e-05 -1.15768961e-05] [ 1.41496905e-04 -1.50249878e-06 -1.80614771e-05] [-1.80979983e-05 -1.19844399e-05 1.15738040e-05]] Final stress: [ 1.57545157e-05 1.33598483e-05 1.22127286e-05 6.22147076e-07 -1.06123810e-04 -1.22114982e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 1.54180511e-05 1.40682125e-04 3.21033194e-05] [-2.98648486e-06 -7.85801256e-05 -8.91711405e-05] [-1.54179352e-05 -1.40682111e-04 -3.21882844e-05] [ 2.98646872e-06 7.85801339e-05 8.92112441e-05] [ 1.09574157e-11 -2.36836867e-08 -7.90633164e-09] [ 2.05065031e-08 1.18368672e-08 -7.92574137e-09] [-2.05114644e-08 1.18392934e-08 -7.87552801e-09] [ 1.00445336e-10 -5.72837811e-08 1.86521125e-08] [ 4.95004906e-08 2.85311365e-08 1.85418734e-08] [-4.96802264e-08 2.87428588e-08 1.87222351e-08] [ 1.37566353e-04 -1.57164495e-05 -1.88243555e-04] [-1.25070973e-04 2.11944143e-04 -6.85503243e-05] [-6.98112049e-05 -8.20276615e-05 -5.87266767e-05] [-1.37566314e-04 1.56736115e-05 1.88247693e-04] [ 1.25108016e-04 -2.11922788e-04 6.85544279e-05] [ 6.97740716e-05 8.20491372e-05 5.87308314e-05] [ 5.16371004e-06 1.53518641e-05 -8.59399388e-06] [-6.49717253e-05 1.33703728e-05 2.14738290e-05] [-5.16372495e-06 -1.53518656e-05 8.59489476e-06] [ 6.49717478e-05 -1.33703714e-05 -2.14742537e-05] [ 1.29337164e-04 5.56658503e-09 1.83510170e-05] [-3.26885802e-05 1.17005529e-05 -1.16398308e-05] [-1.29337139e-04 -5.56639701e-09 -1.83519187e-05] [ 3.26885708e-05 -1.17005514e-05 1.16405125e-05]] Final stress: [1.58551288e-05 1.32759273e-05 1.21584141e-05 1.95350037e-07 1.06444670e-04 1.22355512e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.50682506e-05 3.76086400e-05 -3.91171459e-05] [-4.49265411e-06 -1.16982278e-04 4.48664039e-05] [ 1.50685472e-05 -3.76086871e-05 3.86996799e-05] [ 4.49232971e-06 1.16982272e-04 -4.46254887e-05] [-1.25383233e-10 -9.28464102e-08 -3.76002111e-08] [ 8.05229970e-08 4.65559908e-08 -3.77361037e-08] [-8.02848698e-08 4.62937269e-08 -3.74757615e-08] [-1.00782290e-10 -2.32803476e-07 8.08752978e-08] [ 2.01701428e-07 1.16483279e-07 8.06280003e-08] [-2.01700934e-07 1.16372994e-07 8.12075444e-08] [-1.27993984e-04 -4.88460758e-07 2.05836818e-04] [ 6.29407210e-05 -9.88844258e-05 4.50151652e-05] [ 1.45037422e-04 1.81355382e-04 8.80768584e-05] [ 1.27993615e-04 1.39249390e-07 -2.05821377e-04] [-6.26380701e-05 9.90593456e-05 -4.49998987e-05] [-1.45339690e-04 -1.81181074e-04 -8.80612352e-05] [-6.59357158e-05 -1.40692670e-05 2.10859789e-05] [ 1.43192455e-05 -1.52163851e-05 -1.02054559e-05] [ 6.59355707e-05 1.40692658e-05 -2.10797576e-05] [-1.43191042e-05 1.52163792e-05 1.02008877e-05] [-1.95576676e-05 -1.26796454e-05 -1.09848671e-05] [ 1.39987652e-04 1.34125904e-06 1.86120300e-05] [ 1.95577681e-05 1.26796357e-05 1.09819580e-05] [-1.39987748e-04 -1.34126201e-06 -1.86104526e-05]] Final stress: [ 1.57750885e-05 1.34056752e-05 1.19904927e-05 -2.58581634e-07 1.06188476e-04 -1.22132515e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.90267233e-05 4.72151627e-04 1.38469679e-04] [-1.90267245e-05 -4.72151625e-04 1.38467724e-04] [-1.90267254e-05 -4.72151627e-04 -1.38467584e-04] [ 1.90267255e-05 4.72151627e-04 -1.38468308e-04] [ 7.76391321e-13 -8.55795990e-11 3.03826964e-11] [ 7.39347611e-11 4.18446250e-11 3.22362415e-11] [-7.57924834e-11 4.28337366e-11 3.07856796e-11] [-3.78226010e-12 1.31181088e-09 -4.31485070e-10] [-1.13390097e-09 -6.52624954e-10 -4.29776326e-10] [ 1.13906418e-09 -6.59919230e-10 -4.32212491e-10] [-1.34282161e-04 -2.53515018e-05 5.45795588e-11] [-2.46323118e-04 2.23473839e-04 5.68275291e-11] [ 1.52163110e-04 1.16022043e-04 5.62306433e-11] [ 1.34282157e-04 2.53530489e-05 -1.64592878e-10] [ 2.46321781e-04 -2.23474609e-04 -1.63566268e-10] [-1.52161768e-04 -1.16022820e-04 -1.64742005e-10] [-1.31164035e-04 3.31691932e-05 2.64594655e-09] [ 1.31164035e-04 -3.31691933e-05 2.65585187e-09] [ 1.31164035e-04 -3.31691933e-05 -2.67396788e-09] [-1.31164035e-04 3.31691932e-05 -2.63580299e-09] [ 1.04371181e-04 1.32206389e-05 -9.77613591e-06] [-1.04371181e-04 -1.32206387e-05 -9.77615335e-06] [-1.04371181e-04 -1.32206387e-05 9.77615431e-06] [ 1.04371181e-04 1.32206389e-05 9.77615767e-06]] Final stress: [ 1.41483157e-05 1.35645810e-05 9.94600522e-06 -7.60479576e-17 -2.09645721e-16 2.45363987e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-2.22577225e-05 4.82866571e-04 1.23110515e-04] [ 2.22577243e-05 -4.82866572e-04 1.23108391e-04] [ 2.22577247e-05 -4.82866572e-04 -1.23108541e-04] [-2.22577233e-05 4.82866572e-04 -1.23109311e-04] [ 1.25839226e-13 1.92803051e-10 1.13667742e-10] [-1.67516362e-10 -9.74149997e-11 1.15282978e-10] [ 1.66607950e-10 -9.56255075e-11 1.14459747e-10] [ 2.68851738e-12 1.20189703e-09 -3.99425826e-10] [-1.04291076e-09 -6.03777806e-10 -3.98188704e-10] [ 1.03814646e-09 -5.98344818e-10 -3.97646742e-10] [ 1.35163452e-04 4.04799257e-05 8.46583033e-11] [-1.65064633e-04 9.20239338e-05 8.54412910e-11] [ 2.59326387e-04 2.00418882e-04 8.54241592e-11] [-1.35163449e-04 -4.04783426e-05 -1.58414711e-10] [ 1.65063260e-04 -9.20247289e-05 -1.56272961e-10] [-2.59325018e-04 -2.00419669e-04 -1.56618645e-10] [ 1.32618384e-04 3.33732274e-05 -8.41630923e-07] [-1.32618384e-04 -3.33732275e-05 -8.41622019e-07] [-1.32618384e-04 -3.33732273e-05 8.41604155e-07] [ 1.32618384e-04 3.33732273e-05 8.41644193e-07] [-1.03604892e-04 1.13057757e-05 -9.81838491e-06] [ 1.03604892e-04 -1.13057757e-05 -9.81840547e-06] [ 1.03604892e-04 -1.13057756e-05 9.81840295e-06] [-1.03604892e-04 1.13057757e-05 9.81840518e-06]] Final stress: [ 1.41670307e-05 1.35883056e-05 9.76803158e-06 -5.05616151e-15 -1.00712160e-15 -2.45314609e-04] Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 7.05613723e-09 -1.39380562e-03 2.65001241e-03] [ 1.42324230e-08 1.39378990e-03 2.65150165e-03] [-9.11616293e-09 1.39382048e-03 -2.64986707e-03] [ 2.94091229e-09 -1.39379296e-03 -2.65111902e-03] [-1.15996857e-08 -5.75153712e-08 -7.31692243e-08] [ 6.22853992e-08 4.61420647e-08 -8.77197057e-08] [-4.63689664e-08 2.22075798e-08 -8.48689000e-08] [-1.71862867e-08 -1.92505929e-07 3.30148175e-09] [ 1.89706839e-07 9.81336216e-08 -2.64908993e-08] [-1.71189012e-07 6.71891945e-08 -2.82230809e-08] [ 2.21344631e-08 -9.81548883e-04 -2.74806158e-07] [ 6.55395070e-04 3.10727909e-04 -2.72793215e-07] [-6.55429792e-04 3.10772844e-04 -3.03234348e-07] [ 5.18077342e-09 9.81551040e-04 2.04861203e-07] [-6.55380428e-04 -3.10755284e-04 2.33152525e-07] [ 6.55366096e-04 -3.10740278e-04 2.32193995e-07] [-4.84018658e-11 1.74086741e-04 -1.49243141e-03] [-2.24538543e-09 -1.74092900e-04 -1.49239771e-03] [-1.29187450e-09 -1.74083899e-04 1.49242535e-03] [-3.52202881e-09 1.74084898e-04 1.49239064e-03] [ 4.39846015e-09 2.53615716e-04 -1.51695147e-03] [ 7.08356557e-10 -2.53616077e-04 -1.51692827e-03] [ 1.37924238e-09 -2.53606924e-04 1.51692966e-03] [ 1.59895819e-09 2.53609638e-04 1.51691304e-03]] Final stress: [-2.56751285e-04 -1.98815871e-04 -8.03874028e-05 -2.26363864e-10 7.85663613e-11 1.89838406e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.19955157e-11 1.91752361e-05 3.75108110e-06] [-1.02072936e-11 -1.91752322e-05 3.75093334e-06] [ 2.47945975e-12 -1.91752305e-05 -3.75111912e-06] [ 4.13838408e-12 1.91752304e-05 -3.75094568e-06] [ 3.90472892e-12 -1.64213643e-11 -5.25912647e-13] [ 1.21523902e-11 4.28663355e-12 -2.11303197e-12] [-1.06832321e-11 9.56651425e-12 5.13658560e-12] [ 7.64437846e-12 1.59465774e-11 2.09821049e-12] [-1.89086524e-11 -1.23738797e-11 5.80979709e-12] [ 1.65392144e-11 -2.52847743e-12 -2.26016081e-12] [-9.73110481e-14 7.15081918e-06 3.06017279e-11] [ 7.14242489e-06 2.65815663e-05 1.89108066e-11] [-7.14242217e-06 2.65815642e-05 3.24353678e-11] [-3.13526982e-13 -7.15083531e-06 -9.70964522e-12] [-7.14240692e-06 -2.65815588e-05 -9.04895120e-12] [ 7.14240936e-06 -2.65815582e-05 -2.74533339e-11] [ 1.19071419e-14 2.72917198e-05 1.33018360e-05] [ 2.33479902e-13 -2.72917192e-05 1.33018341e-05] [ 1.40215617e-12 -2.72917204e-05 -1.33018347e-05] [ 1.51856305e-12 2.72917208e-05 -1.33018328e-05] [-1.07880371e-12 -4.46281739e-05 3.57852272e-05] [-9.16625662e-13 4.46281736e-05 3.57852233e-05] [-5.28829205e-13 4.46281728e-05 -3.57852250e-05] [-4.52082816e-13 -4.46281732e-05 -3.57852215e-05]] Final stress: [-6.07674906e-05 9.12404486e-05 9.27052776e-06 9.48338381e-15 -8.90870801e-14 1.18979059e-15] Minimization converged after 8 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-3.78401110e-09 7.15115458e-06 6.68480813e-05] [-3.33803623e-09 -7.15108715e-06 6.66175403e-05] [-3.67212477e-09 -7.14965424e-06 -6.55328265e-05] [-1.71094805e-09 7.15296304e-06 -6.68306158e-05] [-4.44896016e-10 -4.98498844e-08 -7.07640113e-10] [ 4.88191043e-08 2.64963149e-08 -3.35020769e-09] [-4.59830754e-08 2.43236571e-08 1.21691712e-10] [-5.17791838e-09 7.29953802e-07 -2.56116375e-07] [-6.27625128e-07 -3.59009187e-07 -2.53234816e-07] [ 6.39062798e-07 -3.71627731e-07 -2.61675465e-07] [-4.94659291e-09 1.02228732e-04 -1.47990931e-07] [ 7.82924872e-05 -7.49549682e-05 -1.49167632e-07] [-7.82830183e-05 -7.49661749e-05 -1.47999295e-07] [-2.90646240e-09 -1.01297319e-04 4.09370442e-08] [-7.91044984e-05 7.44960062e-05 4.38457135e-08] [ 7.91102608e-05 7.44892968e-05 4.31208211e-08] [-6.35203556e-11 -5.98272839e-05 8.93134482e-06] [-6.12039752e-10 5.98268687e-05 8.95845345e-06] [-6.50490772e-12 5.98268296e-05 -8.95264044e-06] [-5.14792403e-10 -5.98268780e-05 -8.95008901e-06] [-7.21980475e-10 3.10581018e-06 -2.15064649e-04] [-4.74022672e-10 -3.10527934e-06 -2.15059789e-04] [-4.60582730e-10 -3.10525691e-06 2.15070285e-04] [-6.70513811e-10 3.10595415e-06 2.15057122e-04]] Final stress: [ 9.03478002e-05 2.47764179e-05 -6.53161530e-05 -1.11706245e-11 -5.02342692e-12 -8.60069587e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 4.21892976e-08 1.25659578e-03 2.22628225e-03] [ 2.03393354e-09 -1.25657860e-03 2.23098710e-03] [ 8.55876819e-09 -1.25660845e-03 -2.22547232e-03] [-4.60316066e-09 1.25660281e-03 -2.23042750e-03] [ 1.82769642e-08 -2.73286304e-07 -1.53201565e-07] [ 1.13968196e-07 9.86703053e-08 -1.01078578e-07] [-1.45538633e-07 1.37524727e-07 -1.15953474e-07] [ 2.83984866e-08 -5.23560826e-08 -6.16468059e-08] [ 1.86419614e-08 -6.31110197e-09 -7.96997808e-08] [-8.86009334e-08 6.64133746e-08 -2.25492580e-08] [-1.39195369e-08 2.65002185e-03 -9.99445927e-07] [ 1.32043630e-03 2.44017091e-04 -9.87607063e-07] [-1.32041282e-03 2.43987493e-04 -9.87011933e-07] [ 1.45324338e-08 -2.64902025e-03 7.46704764e-07] [-1.32127985e-03 -2.44515088e-04 7.14667433e-07] [ 1.32124822e-03 -2.44479981e-04 7.59683863e-07] [ 2.20320023e-09 2.84651733e-03 1.09965038e-03] [ 4.92222779e-09 -2.84650596e-03 1.09978117e-03] [-1.85602644e-11 -2.84650584e-03 -1.09969196e-03] [ 3.50315044e-09 2.84650596e-03 -1.09978514e-03] [-2.48976950e-11 1.14316376e-03 -2.81592959e-03] [ 1.90621038e-09 -1.14316070e-03 -2.81584851e-03] [ 3.23952365e-09 -1.14316682e-03 2.81590882e-03] [-1.51571039e-09 1.14315896e-03 2.81583244e-03]] Final stress: [-1.14199729e-04 -2.18200267e-04 1.21689943e-05 2.82400957e-10 1.19275466e-10 -7.53318831e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-7.17941984e-10 -1.03140561e-05 -8.90704995e-07] [-9.09810121e-10 1.03130450e-05 -7.07822141e-07] [-8.42793553e-10 1.03121638e-05 6.46111488e-07] [ 1.75351483e-10 -1.03115414e-05 6.36526211e-07] [-1.41471336e-09 1.04849228e-07 2.88899695e-08] [-9.27435230e-08 -5.14172387e-08 2.94096732e-08] [ 9.57076262e-08 -5.47760925e-08 3.14204436e-08] [-1.41548014e-09 -6.07405775e-08 3.52180377e-08] [ 5.93147376e-08 3.33045672e-08 3.92030012e-08] [-5.61358779e-08 2.98424339e-08 3.68173956e-08] [-2.47836418e-10 1.53180755e-05 8.72447932e-10] [-2.49088031e-06 2.16126020e-05 4.58161126e-10] [ 2.49159509e-06 2.16119027e-05 5.16187977e-10] [ 1.51627494e-09 -1.55346482e-05 3.44148611e-08] [ 2.67471013e-06 -2.15059210e-05 3.60442641e-08] [-2.67714152e-06 -2.15027591e-05 3.50594473e-08] [-1.56559460e-10 2.91016939e-05 -1.70897341e-06] [-2.14379736e-10 -2.91018238e-05 -1.70975412e-06] [-1.31212652e-10 -2.91013861e-05 1.71456504e-06] [-1.55616131e-10 2.91013921e-05 1.70934002e-06] [-8.42870218e-11 -1.31971762e-05 3.69689129e-05] [ 1.12104811e-10 1.31972483e-05 3.69682270e-05] [ 1.29671222e-10 1.31971781e-05 -3.69654190e-05] [-6.91314783e-11 -1.31970520e-05 -3.69693329e-05]] Final stress: [-2.50816677e-04 -1.77333411e-04 -2.52484123e-04 -4.54667411e-12 -2.73991844e-12 -8.03192898e-13] Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.28944279e-07 3.62706539e-05 -1.16399935e-05] [-1.20173933e-07 -8.17894421e-05 1.35285722e-05] [-1.90362430e-08 -3.69698754e-05 6.62774770e-05] [-8.53933681e-08 8.17048372e-05 -8.36527174e-06] [-4.19426805e-08 5.14611579e-06 -1.28330117e-07] [-3.89408694e-06 -2.42155304e-06 -3.74684229e-07] [ 4.07568154e-06 -2.57581429e-06 -1.72787283e-07] [-2.32864764e-07 3.39226747e-05 -1.21820544e-05] [-2.85327805e-05 -1.64702027e-05 -1.15154573e-05] [ 2.89895479e-05 -1.70052386e-05 -1.18067677e-05] [ 3.96923569e-08 5.51070588e-05 1.37275182e-04] [ 2.84893346e-07 6.45236926e-05 1.95191411e-04] [-3.25883230e-07 6.45913779e-05 1.95346785e-04] [-6.25624568e-08 -4.27040662e-05 -1.44868816e-04] [-9.92490882e-06 -7.04686632e-05 -2.02403336e-04] [ 1.00690181e-05 -7.06250616e-05 -2.02404744e-04] [-1.13125923e-08 1.10008993e-04 3.59778002e-04] [-2.60656783e-08 -2.70359933e-04 3.08930620e-04] [-3.97862598e-09 -1.10032748e-04 -3.60536163e-04] [-2.07958553e-08 2.70315139e-04 -3.09279228e-04] [-1.88428001e-09 5.39249472e-05 -2.07632742e-04] [-1.51918483e-08 -1.03647614e-04 -1.88991286e-04] [-1.02964518e-08 -5.40358055e-05 2.07773930e-04] [-7.30703720e-10 1.03590527e-04 1.88199682e-04]] Final stress: [ 1.75114843e-04 1.30477014e-04 8.80225943e-05 7.45391256e-05 -4.12739391e-10 4.43638171e-11] Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 4.84257083e-08 3.82288624e-08 9.53098461e-06] [-5.21775625e-08 -1.13304420e-05 1.75807476e-05] [ 3.53826285e-08 -9.72971517e-08 3.03273683e-05] [-4.48613454e-08 1.15180954e-05 3.39306238e-06] [-1.22318816e-07 -3.31063067e-06 -2.71401749e-06] [ 2.47988298e-06 1.69524075e-06 -2.56448141e-06] [-2.22463741e-06 1.40703430e-06 -2.38857973e-06] [ 5.70419474e-08 3.58597409e-05 -1.10973547e-05] [-3.08165126e-05 -1.79435431e-05 -1.09848282e-05] [ 3.06910355e-05 -1.78052159e-05 -1.08927516e-05] [ 2.48305709e-08 -2.25932870e-05 -1.93592107e-05] [ 8.06759027e-06 -3.11223002e-07 -8.71206560e-06] [-8.10585102e-06 -2.60463590e-07 -8.69164133e-06] [ 5.34549238e-08 2.56300883e-06 1.29299347e-05] [ 9.01122174e-06 1.02098711e-05 2.28389094e-06] [-9.10095686e-06 1.03234841e-05 2.31053174e-06] [-1.48695384e-08 -3.49740782e-05 -6.05261055e-05] [ 7.24726684e-09 4.57564185e-06 -5.84916963e-05] [-1.53949213e-08 3.50129451e-05 6.04125035e-05] [ 7.27720420e-09 -4.60716839e-06 5.77497594e-05] [ 3.93771715e-09 -3.74768595e-05 8.52461098e-07] [ 3.26369491e-09 2.70198012e-05 2.09412468e-06] [ 7.04444668e-09 3.74922703e-05 -4.04905158e-07] [-5.64682190e-11 -2.70051542e-05 -2.63773117e-06]] Final stress: [-1.61822429e-04 -8.71768396e-05 -7.72336876e-05 6.63965862e-05 1.65341861e-11 -1.25711255e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-3.97602970e-05 -6.29267116e-05 1.23736284e-04] [-3.97629060e-05 6.30560418e-05 6.81897476e-05] [ 3.99629659e-05 6.27528165e-05 -1.10279639e-04] [ 4.00736239e-05 -6.27068124e-05 -8.10280397e-05] [ 2.91729491e-08 -4.54708011e-06 8.43019475e-07] [ 2.83690544e-06 2.00074584e-06 1.42396255e-06] [-2.98695841e-06 2.12055419e-06 1.24142959e-06] [ 2.58817839e-07 2.32427472e-05 -5.15660616e-06] [-2.00179596e-05 -1.18328632e-05 -5.13655437e-06] [ 1.95444069e-05 -1.12611511e-05 -4.84758763e-06] [ 1.63423627e-07 1.17865077e-04 8.96990381e-06] [ 1.09469833e-04 -1.28326745e-04 -4.33956704e-05] [-1.09744872e-04 -1.27979615e-04 6.15517317e-05] [ 2.55847122e-07 -1.13406022e-04 -6.15683714e-06] [-1.13435302e-04 1.25663725e-04 4.64558489e-05] [ 1.12946120e-04 1.26242088e-04 -5.87281945e-05] [-6.61323605e-05 5.09501039e-05 4.42979728e-05] [-6.61111028e-05 -5.09130843e-05 4.33706462e-05] [ 6.61452342e-05 -5.08573915e-05 -4.39584960e-05] [ 6.61584115e-05 5.08815750e-05 -4.29335907e-05] [-1.01441799e-04 1.04177498e-05 8.00490486e-05] [-1.01427568e-04 -1.04235889e-05 7.91521890e-05] [ 1.01493913e-04 -1.04422605e-05 -7.90967621e-05] [ 1.01482451e-04 1.04301014e-05 -7.85638066e-05]] Final stress: [ 1.87645078e-04 1.20378550e-04 9.84646369e-05 3.53513680e-10 -6.40711108e-05 -6.37039122e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 5.73548227e-05 -7.88791807e-05 1.77032352e-04] [ 5.73442153e-05 7.89467812e-05 7.39987239e-05] [-5.71877323e-05 7.86131859e-05 -1.85424115e-04] [-5.72140416e-05 -7.87530239e-05 -7.63238421e-05] [ 3.21210292e-08 -3.14836198e-06 -3.72276719e-07] [ 2.03657369e-06 1.39324239e-06 -1.87321332e-08] [-2.16892705e-06 1.50664862e-06 -1.62562727e-07] [ 2.46118449e-07 -6.19272921e-06 1.88736338e-06] [ 5.98080660e-06 2.97463956e-06 2.09611885e-06] [-6.49370297e-06 3.55490874e-06 2.45154476e-06] [-1.18587143e-07 1.53224872e-04 1.96445797e-05] [ 1.49424513e-04 -1.73456353e-04 9.22099405e-05] [-1.49307583e-04 -1.73661606e-04 -5.26577445e-05] [ 2.52071825e-08 -1.49982099e-04 -1.81989716e-05] [-1.52175235e-04 1.71920553e-04 -9.06648722e-05] [ 1.52152680e-04 1.71962686e-04 5.40913268e-05] [ 9.49694658e-05 7.27904784e-05 4.97410606e-05] [ 9.49746558e-05 -7.27855607e-05 4.73349451e-05] [-9.49562495e-05 -7.27352783e-05 -4.96572863e-05] [-9.49234428e-05 7.27048347e-05 -4.71789109e-05] [ 1.40043109e-04 6.63298699e-06 1.13751500e-04] [ 1.40051651e-04 -6.62284137e-06 1.12127555e-04] [-1.40039266e-04 -6.64197962e-06 -1.13829401e-04] [-1.40051171e-04 6.63319647e-06 -1.11878295e-04]] Final stress: [ 1.85791618e-04 1.22992202e-04 9.72586042e-05 9.74080218e-10 6.32652044e-05 -8.42044837e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.94444093e-05 -1.92285979e-04 1.84319396e-04] [ 1.70974045e-05 1.91966571e-04 -9.59830645e-05] [-1.43239814e-05 1.91528094e-04 -2.33290423e-04] [-1.60772566e-05 -1.91686698e-04 -3.24210300e-05] [ 8.40987971e-07 -7.60519452e-06 1.50779237e-05] [ 5.96037439e-06 2.76486518e-06 1.58046037e-05] [-7.78484339e-06 4.78381327e-06 1.45355711e-05] [ 3.84827124e-06 8.25417223e-05 -4.33929376e-06] [-7.57352518e-05 -4.59432311e-05 -7.13061180e-06] [ 6.70312355e-05 -3.65018776e-05 -5.61282697e-07] [ 7.31523149e-07 6.95709024e-04 6.34483467e-05] [ 4.03744346e-04 -3.18874595e-04 -1.01886673e-04] [-4.05213562e-04 -3.17187043e-04 2.29418847e-04] [ 1.08747758e-06 -6.66978982e-04 -2.28931172e-05] [-4.29376696e-04 3.02542901e-04 1.42440163e-04] [ 4.26942806e-04 3.05196860e-04 -1.87107516e-04] [ 8.29127728e-06 2.59289598e-04 1.96056168e-04] [ 8.74149064e-06 -2.59455665e-04 1.91186358e-04] [-8.20020670e-06 -2.59307220e-04 -1.92504663e-04] [-7.80573972e-06 2.59417428e-04 -1.86274312e-04] [-1.06212785e-04 -7.14228552e-05 -1.82575042e-03] [-1.06265631e-04 7.13458242e-05 -1.83110202e-03] [ 1.06699601e-04 7.16954867e-05 1.83309849e-03] [ 1.06534748e-04 -7.15328464e-05 1.83585856e-03]] Final stress: [-1.70719541e-04 -1.77610987e-04 -7.07510367e-05 -6.56599076e-09 -8.84546610e-05 -3.21025370e-10] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.11344102e-04 -5.09765360e-04 -1.67872766e-05] [-3.11344228e-04 5.09765360e-04 -1.67662997e-05] [-3.11344266e-04 5.09765255e-04 1.68247529e-05] [ 3.11344227e-04 -5.09765357e-04 1.68265353e-05] [-6.65699050e-13 -5.34781172e-08 -1.66006932e-08] [ 4.61666219e-08 2.67200084e-08 -1.65985065e-08] [-4.61548939e-08 2.66972526e-08 -1.65458803e-08] [-1.01868856e-10 7.85723020e-09 -5.19186505e-09] [-6.28251762e-09 -3.72171238e-09 -4.92764007e-09] [ 6.53045062e-09 -3.97390953e-09 -5.11264789e-09] [ 4.44124987e-05 -9.30304148e-05 -6.92089644e-09] [ 9.67386750e-05 -2.85776329e-04 -6.91117462e-09] [-7.63874079e-05 -2.46160101e-04 -6.90905081e-09] [-4.44125571e-05 9.30622916e-05 -3.39930054e-09] [-9.67661134e-05 2.85760486e-04 -3.43644974e-09] [ 7.64149511e-05 2.46144099e-04 -3.53271236e-09] [-9.03640863e-05 -6.03057244e-05 2.50348715e-05] [ 9.03640604e-05 6.03057142e-05 2.50355974e-05] [ 9.03640718e-05 6.03057255e-05 -2.50360746e-05] [-9.03640876e-05 -6.03057442e-05 -2.50357956e-05] [ 3.50157778e-05 -4.83973622e-06 1.07228376e-04] [-3.50157784e-05 4.83973683e-06 1.07229261e-04] [-3.50157882e-05 4.83972531e-06 -1.07229213e-04] [ 3.50157921e-05 -4.83972745e-06 -1.07228649e-04]] Final stress: [ 1.86469172e-04 1.19795245e-04 9.78333114e-05 2.83964901e-13 -2.98658409e-13 7.06475685e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-6.63373158e-04 -1.85956080e-03 -1.37091035e-04] [ 6.63373069e-04 1.85956075e-03 -1.36922227e-04] [ 6.63373162e-04 1.85956015e-03 1.37085411e-04] [-6.63373276e-04 -1.85956050e-03 1.37053833e-04] [-2.73420963e-10 -7.31198755e-08 -2.61985849e-08] [ 6.22717293e-08 3.66093345e-08 -2.57611902e-08] [-6.16838814e-08 3.59469128e-08 -2.56817650e-08] [ 1.04088266e-11 -6.36916964e-10 -1.94593985e-09] [ 2.81089763e-09 8.90137741e-10 -9.78711667e-10] [-2.79850670e-09 5.74855441e-10 -9.73121628e-10] [-3.12627800e-04 -2.70127860e-05 -2.49058872e-08] [ 6.84934183e-04 -7.01391429e-04 -2.48412311e-08] [-4.99007125e-04 -1.17892886e-03 -2.48281260e-08] [ 3.12627592e-04 2.69315539e-05 1.11090921e-08] [-6.84863432e-04 7.01432350e-04 1.09154916e-08] [ 4.98936674e-04 1.17896936e-03 1.09665549e-08] [ 7.08232800e-04 -4.92120844e-04 5.79809392e-04] [-7.08232810e-04 4.92120795e-04 5.79810292e-04] [-7.08232852e-04 4.92120943e-04 -5.79808978e-04] [ 7.08232768e-04 -4.92120984e-04 -5.79812678e-04] [ 4.02155485e-05 -1.09228424e-04 -4.62613578e-04] [-4.02155831e-05 1.09228426e-04 -4.62611100e-04] [-4.02155755e-05 1.09228400e-04 4.62612341e-04] [ 4.02154793e-05 -1.09228371e-04 4.62611451e-04]] Final stress: [ 1.59730074e-04 1.21255564e-04 7.14011432e-05 -1.99239869e-13 1.78128482e-12 -4.92251738e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[-0.45823622 0.30133339 0.28348621] [ 0.40826312 -0.54418476 2.52095509] [ 0.34929573 -0.33847332 -0.9353056 ] [-0.39760705 0.43534573 -2.65378697] [ 0.02458751 0.11387189 -0.00544788] [-0.09260424 -0.04029643 -0.1039759 ] [ 0.08107131 0.00359867 -0.13756687] [-0.04815957 0.49555516 -0.08338053] [-0.38411135 -0.18844911 -0.00572269] [ 0.45532833 -0.24440085 -0.07592497] [ 1.09588409 0.53314987 0.03677149] [-0.39082643 0.51317408 -0.17158341] [-0.07626054 -0.73074291 -0.13053456] [-1.13416943 -0.66835423 0.56088941] [ 0.56588853 -0.43065373 0.91782083] [-0.00655896 0.82331186 0.3322997 ] [-0.9634649 0.24019902 0.27572685] [ 0.95017488 -0.26142275 0.30632035] [ 0.9360514 -0.2474424 -0.25017413] [-0.91385276 0.23824328 -0.27043474] [-0.08559124 0.15627645 1.12873046] [ 0.05472942 -0.15951832 1.00631181] [ 0.09872256 -0.16001346 -1.34115536] [-0.06855417 0.15989284 -1.20431858]] Final stress: [ 2.59721330e-02 4.66061911e-02 -7.06433699e-03 -7.33553697e-05 -7.03949103e-04 6.25619143e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 7.85538331e-05 -8.49519221e-05 -6.20649813e-05] [-7.85530751e-05 8.49509312e-05 -6.19428432e-05] [-7.85529207e-05 8.49509609e-05 6.21466500e-05] [ 7.85531089e-05 -8.49510378e-05 6.19545137e-05] [-1.74966383e-10 -3.61418792e-08 -9.13032255e-09] [ 3.18929785e-08 1.82629727e-08 -9.29458546e-09] [-3.15762533e-08 1.80089745e-08 -9.24582325e-09] [ 9.16578213e-10 2.55984016e-08 -1.25452938e-08] [-2.10112200e-08 -1.35562890e-08 -1.21305801e-08] [ 1.89960781e-08 -1.11617007e-08 -1.07184400e-08] [-3.01393533e-04 -2.55767785e-04 -3.27151005e-08] [-2.61399930e-04 5.73508776e-05 -3.28342522e-08] [-7.37044025e-05 -7.58477210e-05 -3.31263276e-08] [ 3.01393752e-04 2.55865376e-04 2.28750734e-08] [ 2.61315720e-04 -5.73998102e-05 2.32372374e-08] [ 7.37881476e-05 7.57994203e-05 2.36325838e-08] [-3.46746538e-04 -3.70147579e-04 6.86888753e-04] [ 3.46746770e-04 3.70147484e-04 6.86893866e-04] [ 3.46746569e-04 3.70147585e-04 -6.86890908e-04] [-3.46746529e-04 -3.70147671e-04 -6.86892974e-04] [-1.26412554e-04 -2.89763342e-05 -3.63657905e-04] [ 1.26412618e-04 2.89762778e-05 -3.63654641e-04] [ 1.26412613e-04 2.89762846e-05 3.63657226e-04] [-1.26412693e-04 -2.89763476e-05 3.63655241e-04]] Final stress: [-1.61076279e-04 -1.27406492e-04 -1.30413466e-04 -6.13011170e-13 5.66990621e-12 -4.28762661e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 2.96927874e-09 1.23388342e-04 -8.86679344e-04] [ 3.98325127e-09 -1.23384303e-04 -8.85491955e-04] [ 1.67190797e-09 -1.23378530e-04 8.86245985e-04] [ 2.83183940e-09 1.23380032e-04 8.86536300e-04] [ 1.78015025e-09 -5.17204975e-07 -1.97871329e-07] [ 4.52930494e-07 2.58134105e-07 -1.97998184e-07] [-4.58466256e-07 2.63390124e-07 -2.03408809e-07] [ 3.00337067e-09 -3.25578248e-07 1.01492597e-07] [ 2.59992279e-07 1.54578445e-07 8.67980605e-08] [-2.67849354e-07 1.62540561e-07 9.32358345e-08] [ 3.71177872e-09 -5.62607429e-04 -1.24366371e-07] [-1.22337848e-03 -1.29314877e-04 -1.24308642e-07] [ 1.22337157e-03 -1.29306688e-04 -1.27765404e-07] [ 1.92776584e-09 5.62013970e-04 3.87709522e-08] [ 1.22388582e-03 1.29604321e-04 3.50742125e-08] [-1.22389038e-03 1.29609175e-04 3.42984636e-08] [ 3.31154049e-10 1.05253715e-03 5.87178980e-04] [ 2.73069567e-10 -1.05253639e-03 5.87180751e-04] [ 2.29717023e-10 -1.05253780e-03 -5.87177702e-04] [ 1.57102220e-10 1.05253799e-03 -5.87196781e-04] [ 6.40791364e-10 3.59760731e-05 -4.25859978e-04] [ 3.83737022e-10 -3.59762659e-05 -4.25846131e-04] [ 4.33031596e-10 -3.59761078e-05 4.25848507e-04] [ 5.36551359e-10 3.59754828e-05 4.25847416e-04]] Final stress: [2.22461230e-04 3.39128464e-04 1.59302440e-04 1.59758221e-11 7.11278824e-12 1.56678562e-12] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-3.40682260e-10 -6.23890638e-06 2.23071792e-06] [-9.03055959e-10 6.23848345e-06 2.25041393e-06] [-9.19900539e-10 6.23679472e-06 -2.48934039e-06] [-1.43552864e-09 -6.23672748e-06 -2.32633677e-06] [-4.83144679e-10 6.14795431e-09 7.16634863e-09] [-5.87013264e-09 -2.73567504e-09 7.37198705e-09] [ 7.51013296e-09 -4.25255137e-09 9.05177749e-09] [-1.25200590e-09 -2.54157058e-07 7.19439815e-08] [ 2.28467397e-07 1.29949387e-07 7.59861911e-08] [-2.26042465e-07 1.27122020e-07 7.44751751e-08] [-1.38356704e-09 2.97058078e-05 2.72108522e-08] [ 4.79127607e-06 1.93224443e-05 2.75809626e-08] [-4.78867780e-06 1.93193394e-05 2.77021267e-08] [-1.29971345e-09 -2.96156404e-05 1.23107810e-09] [-4.87269365e-06 -1.93653393e-05 1.46934728e-09] [ 4.87514765e-06 -1.93682502e-05 2.80211312e-09] [-5.51035606e-11 4.09630258e-05 2.15533669e-05] [-8.30642777e-11 -4.09633094e-05 2.15530794e-05] [-1.05177145e-10 -4.09628908e-05 -2.15531643e-05] [-1.31510691e-10 4.09626564e-05 -2.15501512e-05] [-1.67238723e-10 -1.75938839e-05 -4.76887924e-05] [-1.75909483e-10 1.75940923e-05 -4.76862042e-05] [-1.76725912e-10 1.75940075e-05 4.76837040e-05] [-2.04875394e-10 -1.75937778e-05 4.76887151e-05]] Final stress: [ 2.06690867e-04 2.79596121e-04 2.72526186e-04 -1.53165393e-12 3.21351631e-12 -4.96415847e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 3.95854188e-09 1.43376033e-04 3.33001565e-04] [ 1.99087693e-09 -1.43387056e-04 3.34216691e-04] [ 2.29508282e-09 -1.43383456e-04 -3.32920169e-04] [ 1.51056520e-09 1.43376962e-04 -3.33073988e-04] [ 5.06092042e-09 -9.62267725e-07 -3.25906655e-07] [ 8.38278684e-07 4.78533307e-07 -3.27227561e-07] [-8.48200564e-07 4.90047360e-07 -3.33688138e-07] [ 8.17900869e-09 -6.33139034e-07 1.10488768e-07] [ 5.49005356e-07 3.09780316e-07 1.09711447e-07] [-5.66883944e-07 3.29647065e-07 1.22445483e-07] [-2.95890912e-09 -9.45229721e-05 -2.07022971e-07] [-1.30438319e-04 2.50710097e-04 -2.09961626e-07] [ 1.30442801e-04 2.50703992e-04 -2.11775884e-07] [-2.39114234e-09 9.55618882e-05 3.56121727e-08] [ 1.29565283e-04 -2.51219121e-04 3.57109264e-08] [-1.29562315e-04 -2.51223443e-04 3.62411352e-08] [ 6.92117058e-10 5.82304951e-04 3.32424513e-04] [ 9.54520130e-10 -5.82305000e-04 3.32458234e-04] [ 5.83406989e-10 -5.82305132e-04 -3.32457240e-04] [ 8.71270861e-10 5.82305101e-04 -3.32455087e-04] [-1.72417636e-11 7.77411499e-05 -3.49896035e-04] [-1.52297424e-10 -7.77437953e-05 -3.49863165e-04] [ 3.50913869e-11 -7.77440890e-05 3.49860081e-04] [-2.61684507e-10 7.77412892e-05 3.49869973e-04]] Final stress: [ 4.05733863e-05 6.70315226e-05 -8.47891370e-05 -3.18785365e-12 6.22247686e-12 1.04205462e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.73730444e-10 9.59125780e-06 -1.29871426e-07] [ 4.38394500e-10 -9.58943600e-06 -2.43596416e-07] [ 3.18941088e-10 -9.58853561e-06 5.83210488e-07] [ 2.38893239e-10 9.59077548e-06 4.09136850e-07] [ 4.08151255e-10 -2.21053340e-07 -5.99237590e-08] [ 1.86242193e-07 1.09158156e-07 -5.77014722e-08] [-1.87259179e-07 1.10231105e-07 -5.85416171e-08] [ 1.15186763e-09 3.17580930e-07 -9.78518004e-08] [-2.81504441e-07 -1.61241550e-07 -1.01308434e-07] [ 2.79184074e-07 -1.58566987e-07 -9.97809081e-08] [-1.40325529e-11 -1.23674598e-05 -2.93703035e-08] [ 2.01961474e-06 -1.65485985e-05 -2.99547871e-08] [-2.01969589e-06 -1.65485625e-05 -3.03398231e-08] [-1.73470405e-10 1.25947974e-05 -1.88137218e-08] [-2.22003809e-06 1.64343057e-05 -1.91905900e-08] [ 2.22020167e-06 1.64340216e-05 -1.91919404e-08] [ 6.30563102e-11 -2.00364584e-05 4.72349727e-06] [ 1.32448885e-10 2.00368776e-05 4.72796499e-06] [ 4.87218044e-11 2.00367978e-05 -4.72944477e-06] [ 1.16112814e-10 -2.00363395e-05 -4.72636798e-06] [ 2.77472489e-11 1.81438100e-05 -1.26599632e-05] [ 4.52529529e-12 -1.81435936e-05 -1.26600212e-05] [ 4.37175648e-12 -1.81436048e-05 1.26642501e-05] [ 1.54724011e-11 1.81438370e-05 1.26631745e-05]] Final stress: [ 5.20684219e-06 -6.87832056e-05 9.00347916e-05 -1.25048096e-12 9.99541254e-13 1.10912069e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 7.30044358e-11 1.35769798e-05 -2.41034658e-07] [ 4.00697107e-10 -1.35785243e-05 -2.21606160e-07] [ 1.52335507e-10 -1.35773596e-05 2.93318569e-07] [ 2.41750814e-10 1.35769142e-05 2.49583188e-07] [-1.93305864e-11 1.23492950e-08 -5.93629257e-10] [-9.50708497e-09 -5.81525504e-09 -1.43807630e-09] [ 9.22436888e-09 -5.67805908e-09 -1.89210911e-09] [ 1.15617703e-10 5.38801512e-08 -1.60129333e-08] [-4.41961420e-08 -2.67763348e-08 -1.54925881e-08] [ 4.39292847e-08 -2.64860496e-08 -1.52882106e-08] [ 5.65303693e-10 -1.01807710e-05 -9.48336551e-09] [ 7.78632044e-06 -2.27562411e-05 -1.04718439e-08] [-7.78735322e-06 -2.27550035e-05 -1.07140259e-08] [ 1.14643961e-10 1.01442816e-05 1.14516169e-09] [-7.75197514e-06 2.27743207e-05 1.15385208e-09] [ 7.75170130e-06 2.27746178e-05 9.97236393e-10] [ 2.33929542e-12 -2.41583445e-05 2.06082241e-06] [ 6.32299768e-12 2.41581259e-05 2.06106644e-06] [ 2.70011791e-12 2.41582196e-05 -2.06101346e-06] [-7.62556684e-13 -2.41583390e-05 -2.06222309e-06] [ 6.93454738e-11 1.31798180e-05 3.62777524e-05] [ 3.27667791e-11 -1.31800128e-05 3.62770773e-05] [ 1.87822847e-11 -1.31799478e-05 -3.62769577e-05] [ 8.06774092e-11 1.31797922e-05 -3.62786947e-05]] Final stress: [-1.77308887e-04 -2.50678885e-04 -2.52649466e-04 -3.19661264e-12 2.17917125e-13 2.43355987e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 3.22343087e-08 1.16200423e-05 -6.63912556e-05] [-1.30555683e-07 8.97711267e-07 9.60727197e-05] [-2.70290336e-09 -1.17249586e-05 -8.18794435e-05] [-9.73734990e-08 -8.48241324e-07 1.03515030e-04] [-2.60054352e-07 -5.12543838e-05 -2.61638341e-05] [ 4.47662852e-05 2.59541852e-05 -2.63370643e-05] [-4.42261302e-05 2.53419143e-05 -2.59657878e-05] [-9.46825699e-09 -1.37006020e-05 1.39852407e-05] [ 1.18365018e-05 6.85598392e-06 1.39866092e-05] [-1.18305811e-05 6.84153034e-06 1.39940160e-05] [-1.27896912e-08 -1.70007880e-04 8.54892167e-06] [ 1.34770251e-04 7.80163327e-05 -2.67195965e-07] [-1.34728398e-04 7.79773410e-05 -2.33142345e-07] [ 8.54174066e-08 -1.44293535e-04 -1.34300942e-05] [ 1.37707439e-04 7.90863236e-05 -4.55531243e-06] [-1.37841212e-04 7.92626414e-05 -4.51930926e-06] [-3.10129575e-08 1.04459039e-06 5.20872882e-05] [-4.47315407e-10 2.13824674e-05 4.53963271e-05] [-3.20419218e-08 -9.96997028e-07 -4.75306728e-05] [ 3.98105632e-10 -2.14536425e-05 -5.05225081e-05] [-1.67133446e-09 -2.79105588e-05 -7.75442215e-07] [ 3.79250375e-09 3.46079075e-05 -2.30736438e-06] [ 9.35333538e-09 2.78562890e-05 1.76529555e-06] [-7.23337945e-09 -3.45544609e-05 1.52697927e-06]] Final stress: [ 1.15730581e-04 1.90525248e-04 1.00427100e-04 -6.59972457e-05 4.69061188e-12 -4.42081913e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 6.41951811e-07 2.09801446e-05 1.37173114e-03] [ 9.54321637e-08 -1.33403813e-05 -4.09592214e-04] [ 7.25484847e-07 -2.17365949e-05 1.24890142e-03] [ 3.18503844e-07 1.32430042e-05 -2.61489365e-04] [ 3.32587962e-07 3.41572462e-04 1.20843287e-04] [-2.95013133e-04 -1.70982123e-04 1.20667983e-04] [ 2.94313521e-04 -1.70195075e-04 1.20181524e-04] [ 1.10311693e-06 1.85978274e-03 -5.96417327e-04] [-1.61168499e-03 -9.31236371e-04 -5.94935587e-04] [ 1.60927580e-03 -9.28571269e-04 -5.93179942e-04] [ 1.68932014e-07 5.43896039e-04 -8.78864934e-05] [-4.20339492e-04 -2.81058112e-04 -6.36709729e-05] [ 4.19930417e-04 -2.80627755e-04 -6.33196417e-05] [ 3.69734144e-07 4.76299199e-04 -8.60377516e-05] [-4.64117577e-04 -2.29498011e-04 -1.09991346e-04] [ 4.63349133e-04 -2.28627088e-04 -1.09974141e-04] [ 2.39607565e-08 -2.98190567e-05 6.86388550e-05] [ 1.25459426e-07 -3.58182833e-06 8.60354860e-05] [ 3.57172675e-08 2.99143187e-05 -9.38405647e-05] [ 1.40860947e-07 3.12132568e-06 -7.99031151e-05] [ 4.70512867e-08 -6.96689566e-05 2.33724389e-05] [ 5.02227229e-08 3.32015911e-05 -3.14378134e-06] [ 7.46424335e-08 6.99008751e-05 5.20657406e-06] [ 3.26633485e-08 -3.29690725e-05 -1.21964663e-05]] Final stress: [ 1.18809249e-04 1.88496357e-04 9.83437538e-05 6.54995809e-05 -8.82030694e-10 -9.08098226e-11] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.09445089e-05 -3.44035527e-05 -4.34832472e-05] [ 5.99778166e-05 -3.99529542e-05 3.90901668e-05] [ 7.93686817e-05 1.66453216e-06 1.95970686e-05] [-6.85599307e-05 4.26512673e-05 7.80143129e-05] [ 1.44631594e-06 -3.37340264e-05 -9.52495055e-06] [ 6.45006187e-06 -7.72643415e-05 -1.26017976e-04] [-6.41008476e-05 1.98217609e-05 -4.60952515e-05] [ 2.48408382e-05 2.18392765e-05 6.67862687e-05] [ 8.54996086e-05 1.53558468e-05 -3.37573510e-05] [ 1.93878661e-05 3.84385581e-05 1.60266946e-05] [ 2.81138198e-06 -5.01959637e-06 -5.46443427e-05] [ 1.43463422e-05 2.13708620e-05 1.59502589e-05] [-3.83298723e-05 4.11492389e-05 -1.16246319e-05] [ 2.45973314e-05 6.02327108e-06 5.66455784e-05] [-2.39662974e-05 -6.48085259e-05 4.80243275e-05] [-3.51028834e-05 4.86862367e-05 -1.24389106e-05] [ 5.53987712e-05 -1.77063152e-05 5.60807402e-06] [-4.02218530e-05 1.37127864e-05 6.68607893e-06] [-8.95698037e-05 -3.25657458e-05 3.50594288e-05] [-1.91313845e-05 -1.71866866e-05 1.94877797e-05] [-2.67475541e-05 3.25845806e-05 4.70528052e-07] [ 1.46226947e-06 1.60821003e-05 -2.19340496e-05] [ 3.47735955e-05 -5.59748432e-06 -3.65349357e-05] [ 6.31405500e-06 8.85891138e-06 -1.13909188e-05]] Final stress: [ 0.11108819 0.13930929 0.1243497 0.00611873 0.00114979 -0.00047493] Minimization converged after 58 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.25635720e-05 2.76744982e-05 1.16242993e-05] [-1.25381797e-05 -2.77312609e-05 -3.89972834e-06] [ 1.25289843e-05 -2.76887555e-05 -1.41267610e-05] [ 1.25424394e-05 2.76212573e-05 4.19726055e-06] [ 2.31205430e-08 -4.05075073e-09 1.56910546e-07] [ 2.34821507e-07 3.29187178e-08 3.70234012e-08] [-2.76648391e-07 8.35609573e-08 1.35747325e-08] [-5.42420467e-08 1.11879197e-06 4.19207918e-08] [-8.55877454e-07 -4.86375013e-07 1.00691506e-07] [ 9.58682496e-07 -6.08254421e-07 3.75420200e-08] [-1.41043224e-08 -2.24500773e-05 3.29918538e-06] [-2.37296080e-07 -5.19624997e-06 1.17376572e-05] [ 2.52306408e-07 -5.22122994e-06 -5.16945291e-06] [ 1.20395011e-09 1.78571131e-05 -2.75798743e-06] [ 4.24968654e-06 7.51780145e-06 -1.12387742e-05] [-4.24072737e-06 7.51411390e-06 5.67893717e-06] [-3.73258820e-05 -1.16285242e-05 8.94467461e-05] [-3.73354852e-05 1.16148295e-05 8.89835790e-05] [ 3.73299832e-05 1.16061599e-05 -8.93195041e-05] [ 3.73245128e-05 -1.16188505e-05 -8.90034116e-05] [-2.12440270e-05 -4.84345091e-05 -3.32817409e-05] [-2.12435917e-05 4.84303969e-05 -3.35980504e-05] [ 2.12423320e-05 4.84331325e-05 3.33925412e-05] [ 2.12415600e-05 -4.84364369e-05 3.36475421e-05]] Final stress: [ 1.16925304e-04 1.90207183e-04 9.91519096e-05 -8.89351025e-12 6.86227805e-05 2.08623241e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 3.10008242e-06 4.39512513e-06 1.54575156e-05] [ 3.04019337e-06 -4.38298486e-06 -2.77764361e-06] [-3.11265973e-06 -4.45598929e-06 -2.18628169e-05] [-3.11299508e-06 4.36491030e-06 -2.70217178e-06] [-5.29940677e-08 -3.77735360e-06 2.09035422e-07] [ 3.20999114e-06 1.93726444e-06 1.97550455e-07] [-3.08890625e-06 1.80637535e-06 2.88552790e-07] [-1.28230101e-08 4.75925840e-06 1.72313013e-07] [-4.03371617e-06 -2.34411695e-06 2.27347635e-07] [ 4.05867026e-06 -2.37382568e-06 2.13578445e-07] [-3.12033913e-08 -3.27656948e-06 4.81830517e-06] [-1.54608971e-05 1.54287396e-05 -2.52585437e-06] [ 1.55385124e-05 1.53476821e-05 1.22505543e-05] [ 2.19824099e-08 2.44979111e-06 -1.81319650e-06] [ 1.64713309e-05 -1.49532788e-05 5.50514342e-06] [-1.65110196e-05 -1.49048662e-05 -9.24459423e-06] [ 1.21504486e-05 1.77625618e-05 -4.67144802e-05] [ 1.21574790e-05 -1.77526834e-05 -4.71488284e-05] [-1.21643909e-05 -1.77506168e-05 4.70349430e-05] [-1.21606564e-05 1.77496470e-05 4.74606599e-05] [ 7.78017965e-06 3.21602721e-05 -9.15227725e-06] [ 7.78605757e-06 -3.21725738e-05 -9.50806853e-06] [-7.78212010e-06 -3.21776811e-05 9.66983951e-06] [-7.79054577e-06 3.21609129e-05 9.94459315e-06]] Final stress: [-8.68578018e-05 -1.61810269e-04 -7.76309665e-05 3.29131329e-10 -6.62361175e-05 -3.43607249e-11] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.75185006e-04 -4.62456822e-04 2.77955855e-05] [ 1.75184824e-04 4.62456675e-04 2.78602358e-05] [ 1.75185149e-04 4.62456686e-04 -2.76226824e-05] [-1.75185224e-04 -4.62456944e-04 -2.78479191e-05] [-2.20812177e-10 -4.53660037e-08 -1.25051505e-08] [ 4.03303184e-08 2.31235349e-08 -1.30959936e-08] [-3.97551566e-08 2.25470603e-08 -1.25621506e-08] [ 1.67555026e-10 5.46007695e-08 -2.65072526e-08] [-4.73110968e-08 -2.74471038e-08 -2.64959141e-08] [ 4.70048934e-08 -2.70728586e-08 -2.62300269e-08] [-2.07937545e-04 4.29962840e-05 -3.65683587e-08] [ 4.01781288e-05 -1.11303127e-04 -3.66019091e-08] [-2.06787612e-04 -2.55123317e-04 -3.63909772e-08] [ 2.07937354e-04 -4.28210315e-05 1.54168041e-08] [-4.03295882e-05 1.11215760e-04 1.53573800e-08] [ 2.06939359e-04 2.55035563e-04 1.53963585e-08] [-1.41959996e-04 5.71198271e-05 -1.37294234e-05] [ 1.41959956e-04 -5.71198423e-05 -1.37233574e-05] [ 1.41959908e-04 -5.71198754e-05 1.37251607e-05] [-1.41959908e-04 5.71198344e-05 1.37245505e-05] [ 1.74838550e-05 -3.85785380e-05 1.65189732e-04] [-1.74838749e-05 3.85785174e-05 1.65192945e-04] [-1.74838639e-05 3.85785192e-05 -1.65191185e-04] [ 1.74838691e-05 -3.85785540e-05 -1.65192855e-04]] Final stress: [ 1.16598971e-04 1.89114708e-04 9.82127253e-05 5.90187898e-13 -1.01428366e-12 6.90234385e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.74011209e-04 -4.62862209e-04 2.65180970e-05] [-1.74010973e-04 4.62862492e-04 2.65283099e-05] [-1.74011156e-04 4.62862351e-04 -2.64979608e-05] [ 1.74011344e-04 -4.62861963e-04 -2.65958711e-05] [ 4.43094960e-10 4.82668482e-08 1.37391855e-08] [-4.40445104e-08 -2.49817952e-08 1.47803809e-08] [ 4.31469913e-08 -2.39877632e-08 1.42378609e-08] [-7.44372008e-11 -3.15904387e-08 3.49011686e-09] [ 2.76945308e-08 1.58838107e-08 3.45396400e-09] [-2.75946470e-08 1.57243375e-08 3.47112831e-09] [ 2.04165284e-04 3.85521403e-05 -9.93919927e-09] [ 1.99701653e-04 -2.53551955e-04 -1.00469257e-08] [-3.47197903e-05 -1.13139295e-04 -1.00721222e-08] [-2.04165171e-04 -3.84791404e-05 9.36710088e-09] [-1.99765310e-04 2.53515236e-04 9.31913910e-09] [ 3.47832161e-05 1.13102846e-04 9.36477021e-09] [ 1.42795257e-04 5.76464002e-05 -1.50458959e-05] [-1.42795205e-04 -5.76463403e-05 -1.50435625e-05] [-1.42795166e-04 -5.76462546e-05 1.50443910e-05] [ 1.42795203e-04 5.76463176e-05 1.50442324e-05] [-1.79315489e-05 -3.82259140e-05 1.64947099e-04] [ 1.79315703e-05 3.82259428e-05 1.64948260e-04] [ 1.79315386e-05 3.82259245e-05 -1.64948802e-04] [-1.79315267e-05 -3.82258958e-05 -1.64949462e-04]] Final stress: [ 1.16526990e-04 1.89161413e-04 9.82822775e-05 -1.91432786e-13 3.79265149e-13 -6.91552027e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 1.45036131e-03 -1.72962661e-03 5.32561150e-03] [-1.52649477e-03 1.69236194e-03 -6.99851534e-03] [-1.45160068e-03 1.71639287e-03 -7.74626133e-03] [ 1.49061688e-03 -1.70030174e-03 5.20553757e-03] [-3.23739148e-05 -6.33421033e-04 1.39810802e-04] [ 5.66120366e-04 3.52269585e-04 1.16615399e-04] [-5.01844551e-04 2.77621938e-04 1.63924117e-04] [-1.94349026e-05 1.56647965e-04 3.15851092e-04] [-5.02797163e-05 -4.56785348e-05 3.52217724e-04] [ 8.30224103e-05 -8.66995084e-05 3.33718472e-04] [-4.12611951e-03 3.56746771e-03 2.69973820e-03] [ 2.87784429e-03 -6.76778230e-03 2.64581779e-03] [-6.65133526e-04 4.29548345e-03 2.70914866e-03] [ 4.12306714e-03 -3.19761315e-03 -1.87965587e-03] [-3.17629934e-03 6.58972351e-03 -1.84834470e-03] [ 9.69775527e-04 -4.48097330e-03 -1.89108893e-03] [-8.86031716e-05 -6.49350694e-04 -3.84853038e-04] [ 9.72617079e-05 6.55682084e-04 -6.74360056e-04] [ 8.19958450e-05 6.51324962e-04 4.53914097e-04] [-1.03282653e-04 -6.62734064e-04 7.64535755e-04] [-1.49647535e-04 -8.30083622e-07 6.89369171e-04] [ 1.65180486e-04 8.24991560e-06 4.99758064e-04] [ 1.43654966e-04 -3.60924766e-06 -5.91743688e-04] [-1.57786664e-04 -4.60566145e-06 -4.00745460e-04]] Final stress: [-3.50057400e-04 -4.36144942e-04 -2.70085372e-04 2.89358700e-07 4.10384740e-07 -3.21065891e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-2.80284917e-05 2.38332097e-05 1.70320699e-03] [ 1.06323790e-05 -4.12266654e-05 -3.08039811e-03] [ 3.97174833e-05 -5.63213199e-05 -3.01772228e-03] [-8.59676038e-05 6.38122899e-05 1.88699568e-03] [-5.92166635e-05 2.68764750e-05 1.44126936e-04] [-1.96727196e-05 4.59786058e-05 1.25291107e-04] [ 1.49906847e-04 -9.77389660e-05 2.24674386e-04] [ 1.52431951e-05 1.06019445e-04 1.49387810e-04] [-1.64627239e-05 -5.25224785e-05 1.79696861e-04] [-1.51463493e-05 -1.69609435e-05 2.03696835e-04] [ 1.98008998e-03 1.48990719e-03 1.09322094e-03] [ 3.23415661e-04 2.16006047e-03 1.08789143e-03] [-1.34274018e-03 -2.60919926e-03 1.09248325e-03] [-1.99970958e-03 -1.45261619e-03 -6.65520589e-04] [-3.22402113e-04 -2.15274582e-03 -6.63582786e-04] [ 1.38559583e-03 2.56836243e-03 -6.37223866e-04] [-1.26920639e-05 -2.00030812e-04 -1.01268925e-04] [ 1.49218867e-06 2.01851840e-04 -2.13128406e-04] [-2.41564311e-06 2.06168829e-04 1.40128814e-04] [ 4.17153781e-06 -2.10741700e-04 2.57786854e-04] [ 5.01091488e-05 2.97023167e-05 7.20700222e-05] [-5.90157491e-05 -2.78394422e-05 -7.56967281e-06] [-4.98379694e-05 -3.26507478e-05 -2.06557329e-05] [ 5.29335963e-05 2.80212394e-05 4.64124675e-05]] Final stress: [-3.71091872e-04 -4.10756000e-04 -2.70061508e-04 8.36060691e-08 -2.14023977e-07 1.25634843e-05] Minimization converged after 8 steps. Minimization converged after 6 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.48891578e-06 -8.65964230e-05 -2.98572585e-05] [ 6.48885951e-06 8.65965871e-05 -3.02973511e-05] [ 6.48856296e-06 8.65966055e-05 3.14501196e-05] [-6.48869338e-06 -8.65966009e-05 3.10068119e-05] [ 4.03025023e-10 -5.60989676e-07 -1.73596375e-07] [ 4.85516493e-07 2.80088041e-07 -1.73580434e-07] [-4.86120068e-07 2.80906641e-07 -1.73623880e-07] [-8.82601358e-10 1.29027785e-06 -3.94286101e-07] [-1.11718258e-06 -6.44343577e-07 -3.94455731e-07] [ 1.11849515e-06 -6.46112897e-07 -3.94517966e-07] [-2.30612777e-05 -6.17988967e-05 -9.96961074e-08] [ 5.27170851e-05 -8.10728808e-06 -9.96473166e-08] [-1.15094478e-04 2.17572813e-07 -9.96762915e-08] [ 2.30612894e-05 6.19070409e-05 -9.90193207e-08] [-5.28108471e-05 8.05318746e-06 -9.91606422e-08] [ 1.15188250e-04 -2.71666587e-07 -9.91090738e-08] [-5.24654939e-05 -5.54953655e-06 3.88614027e-05] [ 5.24655157e-05 5.54956280e-06 3.88631562e-05] [ 5.24654526e-05 5.54953512e-06 -3.88734712e-05] [-5.24654373e-05 -5.54952273e-06 -3.88717918e-05] [ 3.76301899e-05 -3.75921221e-06 -6.66403393e-05] [-3.76302396e-05 3.75922320e-06 -6.66488877e-05] [-3.76303791e-05 3.75922533e-06 6.66582906e-05] [ 3.76303266e-05 -3.75921988e-06 6.66496880e-05]] Final stress: [1.05596778e-04 1.05819958e-04 1.81308583e-04 4.52666932e-13 2.15075978e-13 7.55828380e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.41662412e-06 -8.82686636e-05 -3.60920792e-05] [ 1.41652367e-06 8.82686339e-05 -3.58531838e-05] [ 1.41679205e-06 8.82684396e-05 3.67337112e-05] [-1.41688359e-06 -8.82685694e-05 3.70366874e-05] [-7.87445358e-10 -8.84033705e-07 -2.76719529e-07] [ 7.65991399e-07 4.42784548e-07 -2.76731762e-07] [-7.64747163e-07 4.41159177e-07 -2.76486878e-07] [ 5.03801844e-10 6.01981304e-07 -1.76379483e-07] [-5.21124667e-07 -3.01381699e-07 -1.76151932e-07] [ 5.20360386e-07 -3.00360785e-07 -1.76039379e-07] [ 1.98584895e-05 -7.11555409e-05 -7.20831307e-08] [ 8.41679047e-05 1.21718970e-06 -7.19963263e-08] [-2.67695050e-05 -7.91465078e-06 -7.20191268e-08] [-1.98586834e-05 7.08846782e-05 -8.34966367e-08] [-8.39330672e-05 -1.08154110e-06 -8.34936497e-08] [ 2.65349237e-05 8.04992426e-06 -8.35381587e-08] [ 5.10146117e-05 -5.67490061e-06 3.63187508e-05] [-5.10146328e-05 5.67488956e-06 3.63138178e-05] [-5.10146101e-05 5.67492278e-06 -3.63224951e-05] [ 5.10145938e-05 -5.67494252e-06 -3.63259538e-05] [-3.80630560e-05 -1.90173281e-06 -6.56014326e-05] [ 3.80630403e-05 1.90172569e-06 -6.55998557e-05] [ 3.80631545e-05 1.90171908e-06 6.56072543e-05] [-3.80631679e-05 -1.90172970e-06 6.56099146e-05]] Final stress: [ 1.05592863e-04 1.05761465e-04 1.81331613e-04 2.88301027e-13 -8.99037232e-14 -7.56052910e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 2.35500518e-05 -6.32669509e-05 -6.21966296e-06] [-2.35500801e-05 6.32670127e-05 -6.21281232e-06] [-2.35500274e-05 6.32668998e-05 6.23391869e-06] [ 2.35501051e-05 -6.32669211e-05 6.22379045e-06] [ 6.51165471e-11 -6.98818314e-09 -2.56580446e-09] [ 5.96864844e-09 3.40368420e-09 -2.47517595e-09] [-6.08638961e-09 3.53973012e-09 -2.53813848e-09] [-2.40066059e-11 7.32797356e-09 -2.86241109e-09] [-6.35831732e-09 -3.63693775e-09 -2.84886714e-09] [ 6.38540182e-09 -3.68234793e-09 -2.84218056e-09] [-2.33959954e-05 3.37276055e-05 -3.01169567e-09] [ 8.07234206e-06 -4.24910854e-05 -2.95672417e-09] [-7.70456500e-05 -3.08161488e-05 -2.86951342e-09] [ 2.33960021e-05 -3.37243081e-05 8.03265882e-11] [-8.07523558e-06 4.24894284e-05 1.15864826e-10] [ 7.70485244e-05 3.08144959e-05 8.48689056e-11] [-3.42654359e-05 -4.83553229e-06 -1.37041729e-05] [ 3.42654350e-05 4.83553694e-06 -1.37039260e-05] [ 3.42654463e-05 4.83553559e-06 1.37039178e-05] [-3.42654370e-05 -4.83553839e-06 1.37037744e-05] [ 3.43649640e-05 -5.03429708e-06 6.93321029e-05] [-3.43649639e-05 5.03430169e-06 6.93322584e-05] [-3.43649627e-05 5.03429694e-06 -6.93321843e-05] [ 3.43649669e-05 -5.03429520e-06 -6.93323147e-05]] Final stress: [-7.64278303e-05 -7.62614266e-05 -1.61178574e-04 2.42777963e-13 -3.17283428e-13 7.52909596e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-2.61412824e-05 -9.65258898e-05 -1.10062374e-05] [ 2.61412242e-05 9.65259023e-05 -1.10077699e-05] [ 2.61412448e-05 9.65259158e-05 1.10064641e-05] [-2.61412683e-05 -9.65259298e-05 1.10061845e-05] [-1.67141395e-11 -3.43351569e-10 3.65622532e-11] [ 3.51843193e-10 2.11291831e-10 -1.49627533e-11] [-3.00023006e-10 1.54821100e-10 3.06194514e-11] [-4.33450861e-11 -3.20561999e-09 5.80442694e-10] [ 2.72479583e-09 1.63880987e-09 5.85647308e-10] [-2.63686134e-09 1.53510799e-09 5.23872026e-10] [ 3.16600251e-05 8.06451752e-05 6.78647916e-11] [ 1.29214497e-04 -6.37375335e-05 6.03790758e-11] [-4.84814886e-05 -7.24839773e-05 8.68254492e-11] [-3.16600303e-05 -8.06394457e-05 -1.37940308e-10] [-1.29219478e-04 6.37346853e-05 -1.51192151e-10] [ 4.84864986e-05 7.24810967e-05 -1.62785023e-10] [ 3.35953920e-05 -6.03353993e-06 -9.51879846e-06] [-3.35953999e-05 6.03354526e-06 -9.51872926e-06] [-3.35953964e-05 6.03353835e-06 9.51869564e-06] [ 3.35953916e-05 -6.03353528e-06 9.51879319e-06] [-3.22689620e-05 -1.05504066e-05 8.17604363e-05] [ 3.22689569e-05 1.05504077e-05 8.17605120e-05] [ 3.22689577e-05 1.05504084e-05 -8.17605765e-05] [-3.22689615e-05 -1.05504081e-05 -8.17604795e-05]] Final stress: [-7.63445063e-05 -7.58715296e-05 -1.61647552e-04 7.39052117e-14 -1.01220867e-13 -7.47182305e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-1.52330911e-03 -1.64835789e-03 2.23911543e-02] [-4.00381403e-03 -5.04237614e-02 2.98064221e-02] [-7.40339611e-04 4.64496075e-03 3.09982023e-02] [-3.26058162e-03 -4.07682968e-02 3.08891404e-02] [ 5.55374148e-04 8.21475875e-03 -5.73959742e-02] [-2.45696040e-02 4.30590893e-02 -3.30847401e-02] [ 2.35966130e-02 3.82203361e-02 -3.61771410e-02] [ 8.74946239e-03 3.32389848e-02 -5.99591269e-02] [-2.20258162e-02 -6.55242731e-02 -4.04080635e-02] [ 1.03388568e-02 -2.26369221e-02 -4.27031394e-02] [-3.34482657e-03 1.92321368e-02 -6.49176801e-03] [-2.38516822e-02 1.51364845e-02 4.66176968e-02] [ 3.33751584e-02 2.51602362e-03 4.98610780e-02] [-7.16213159e-03 1.95314197e-02 -1.70465483e-02] [-2.15835517e-02 5.24828557e-03 4.23101728e-02] [ 3.44308297e-02 2.25809483e-03 4.45458458e-02] [-7.09542538e-05 9.65141873e-03 6.08423659e-03] [ 1.61875083e-03 -7.05265769e-03 -1.58209792e-04] [-3.14127069e-04 2.07395208e-04 -3.80750872e-03] [ 2.59613905e-03 -1.17598862e-02 7.24925228e-03] [-1.41217710e-03 9.40525953e-03 1.30276811e-02] [-4.85146327e-05 -3.42034010e-03 -1.06604310e-02] [-1.12212666e-03 6.71723975e-03 -2.68149763e-02] [-2.27627784e-04 -1.40473928e-02 1.09267448e-02]] Final stress: [-3.59977402e-04 -9.74687644e-05 -3.21226854e-04 -3.99780326e-04 2.20627086e-06 1.43431727e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-4.17384060e-05 -8.07596210e-04 2.97583097e-05] [-3.99465856e-05 1.75452333e-04 -1.63432260e-05] [-6.49879933e-05 -7.13827435e-04 -6.80541694e-05] [-2.53271594e-05 2.21919911e-04 4.70033114e-05] [ 8.10207537e-05 -1.30263222e-04 2.37868222e-04] [-3.89364053e-04 2.06380749e-05 -6.83176166e-05] [ 5.16955956e-05 6.86594945e-05 -4.92676017e-04] [-2.93130337e-04 4.11351103e-04 3.97801587e-04] [ 1.74689677e-04 8.38961415e-04 -7.00860804e-06] [ 4.88545521e-04 9.21570564e-04 -6.47281703e-04] [ 1.87952405e-04 -3.36109725e-04 6.09120673e-04] [-4.62927962e-04 8.70061576e-05 -3.79436025e-04] [ 3.14847795e-04 -1.69490779e-04 -5.70696908e-05] [-1.80715361e-04 -3.50017966e-04 5.95453627e-04] [-2.86565011e-04 -2.28368880e-04 -1.78268725e-04] [ 4.87987855e-04 1.21648684e-04 1.52209433e-04] [-2.86054419e-05 -2.83505116e-05 -8.22679920e-05] [ 2.55069057e-05 5.87893196e-05 1.08252144e-04] [-1.90355577e-05 -8.29093602e-06 9.63433329e-05] [ 1.71945622e-05 7.12183536e-05 -9.33131639e-05] [-3.09032516e-05 -1.18368352e-04 -4.05415163e-04] [ 3.11839256e-05 1.78692355e-05 3.10604221e-04] [-3.99976759e-05 -1.41533720e-04 2.21892827e-04] [ 4.26197987e-05 1.71330892e-05 -3.10855588e-04]] Final stress: [-3.38228426e-04 -9.60136080e-05 -2.18240661e-04 1.96484266e-04 1.77858685e-08 1.32551651e-06] Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-0.00128034 0.02882643 -0.02480131] [-0.02018758 -0.00129491 -0.00105051] [ 0.00086437 0.02280274 0.00835218] [-0.01412033 -0.02776691 0.02115582] [ 0.00904783 -0.00756044 0.01782195] [ 0.00105093 0.00764211 -0.00171444] [-0.02943567 0.00699734 0.02691907] [ 0.00138739 -0.02622563 -0.00075435] [-0.01714089 -0.01923781 0.01055831] [ 0.0287223 -0.05439566 0.02000161] [ 0.00355453 0.01232926 -0.01079458] [-0.00045828 -0.01004889 -0.01208996] [-0.00560846 0.01616059 0.01968499] [ 0.00479498 0.0189152 0.00222988] [-0.00742898 -0.00930791 -0.01344108] [-0.00722915 0.04361181 0.03153364] [ 0.00246882 -0.00091394 -0.01248719] [ 0.01168377 -0.01491528 -0.0055319 ] [ 0.00349946 0.00111023 -0.03299817] [ 0.02487188 0.00639248 -0.0064789 ] [ 0.01205971 0.01743804 -0.00810538] [-0.00473055 -0.01039824 -0.00639337] [ 0.01276393 0.00890502 -0.02204327] [-0.00914967 -0.00906564 0.00042698]] Final stress: [ 0.11359312 0.11804898 0.116271 -0.00336263 -0.00433563 0.00317719] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.07394088e-02 3.73436281e-03 -5.17718933e-02] [ 6.62736010e-03 -4.69518898e-03 1.57828990e-02] [-1.19605334e-02 1.01355473e-02 -4.83164929e-02] [-3.54174771e-04 9.32210083e-03 -7.60728512e-03] [-2.25015380e-02 -4.10550433e-02 1.33553517e-03] [-4.97176827e-02 2.27712349e-02 -1.57674427e-02] [ 3.50219130e-02 2.98037404e-02 -6.24807821e-03] [ 5.23924406e-02 1.76682261e-01 6.57728334e-02] [-2.26087720e-02 2.29502170e-04 7.13812345e-02] [ 6.52918642e-03 -3.03772727e-02 1.51583411e-02] [-1.48549180e-02 -8.67575523e-03 -6.10765991e-03] [ 6.02315716e-03 3.24509233e-02 -5.05093832e-02] [ 6.30889996e-03 1.48037686e-02 2.14650816e-02] [ 1.76434451e-02 -4.15181789e-02 -2.88223378e-02] [-1.22835637e-02 3.03234489e-02 -3.73845614e-02] [ 1.22319740e-02 3.88130773e-03 6.40061031e-03] [ 1.03895853e-03 -6.63719940e-02 -8.64360241e-06] [ 4.15008350e-03 -2.07682283e-02 -8.47572058e-03] [-1.92830183e-02 -5.49341003e-02 -8.26921647e-03] [ 5.92254688e-03 -1.08427303e-02 -3.74671669e-02] [ 1.12055380e-02 -2.36089831e-02 3.36454210e-02] [-2.97191593e-03 -1.48752152e-02 9.76240883e-04] [-1.74698887e-02 -2.10617387e-02 6.56608259e-02] [-1.18289067e-02 4.64623130e-03 9.17685927e-03]] Final stress: [ 0.14042341 0.09927095 0.0956056 0.000474 -0.0002805 -0.00079545] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-3.53205664e-04 -2.21623797e-04 2.23789299e-05] [-9.78631216e-06 1.37918472e-04 -8.68910135e-05] [ 3.53206650e-04 2.21624612e-04 -2.34798272e-05] [ 9.78591476e-06 -1.37918414e-04 8.69261116e-05] [-2.94381846e-10 1.49301584e-07 3.26630908e-08] [-1.29384686e-07 -7.44903606e-08 3.28602007e-08] [ 1.30124685e-07 -7.50673225e-08 3.30759679e-08] [ 5.99001435e-10 -6.21267517e-07 2.18631655e-07] [ 5.36206526e-07 3.09614732e-07 2.17272981e-07] [-5.38322959e-07 3.11172455e-07 2.17967116e-07] [-5.82543725e-04 2.39676088e-05 -2.12838230e-05] [ 6.98526029e-04 -6.65584090e-04 2.62731461e-04] [ 6.22306218e-04 8.08064540e-04 -1.07954533e-04] [ 5.82544832e-04 -2.46840304e-05 2.13857228e-05] [-6.97906942e-04 6.65941288e-04 -2.62630197e-04] [-6.22926685e-04 -8.07705770e-04 1.08056227e-04] [ 6.75375102e-04 -4.95352215e-04 3.77528263e-04] [-4.46118818e-04 1.59085633e-04 3.73890680e-04] [-6.75374842e-04 4.95352108e-04 -3.77511123e-04] [ 4.46118884e-04 -1.59085378e-04 -3.73895659e-04] [ 3.23948396e-04 7.50825042e-05 -4.80863584e-04] [-2.14484466e-04 -1.15467395e-04 -4.73472634e-04] [-3.23947707e-04 -7.50822383e-05 4.80859578e-04] [ 2.14484207e-04 1.15467298e-04 4.73472950e-04]] Final stress: [ 1.21688157e-05 1.19097105e-06 -2.66241488e-06 7.63218643e-05 8.16488934e-06 6.18250289e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 0.00027394 -0.00163567 0.00572465] [-0.00240909 -0.00450076 0.01629097] [ 0.00139417 -0.00224921 0.00537247] [ 0.00218854 -0.00502832 0.00168207] [ 0.01779215 -0.00061887 -0.00172806] [-0.0128222 0.0044048 0.00534649] [ 0.00089988 -0.01185924 -0.01264395] [-0.01110693 0.01544059 -0.00124568] [ 0.00862002 -0.00184004 0.00431413] [-0.00762474 -0.00116218 -0.0030676 ] [ 0.00762588 0.01619733 -0.01227396] [-0.00885578 -0.01112639 -0.00497548] [ 0.00419461 0.00068989 -0.0123765 ] [-0.00149951 0.01528329 -0.0004122 ] [-0.00853218 -0.01168231 0.00023155] [-0.00167059 0.00669518 -0.00740421] [ 0.01000499 -0.00853164 0.0091262 ] [ 0.00409107 0.00107062 -0.01108177] [ 0.00357182 -0.00398458 -0.00049117] [-0.00057886 0.00803767 0.00153307] [-0.00346745 0.00412515 0.00352366] [ 0.00201496 -0.00860846 0.00800089] [ 0.00264897 -0.00248837 0.00415541] [-0.00675366 0.00337154 0.00239902]] Final stress: [ 1.44187888e-01 9.84412093e-02 9.85429164e-02 5.97637722e-03 -3.42536282e-05 1.04088124e-03] Minimization converged after 47 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 129 steps. Final forces: [[ 9.70826081e-04 -1.29412575e-03 2.39180735e-04] [-7.53748954e-04 3.14737226e-04 -3.92443307e-04] [ 1.10210201e-03 -1.72145858e-03 2.95810501e-04] [-1.10915671e-03 2.88314796e-05 1.13015562e-04] [-1.23149662e-03 4.61532078e-04 -9.75417027e-04] [ 1.08802127e-03 9.03070596e-04 -1.06242180e-03] [ 7.13723916e-04 -6.67500151e-04 1.21819621e-03] [ 5.50537391e-04 1.32812999e-03 -1.30938418e-03] [-9.54099706e-04 -1.26351174e-03 5.36441395e-04] [-2.54880734e-03 5.88255023e-04 -4.69195664e-04] [-1.22695034e-04 -2.04013904e-04 1.07007487e-03] [ 5.03961468e-04 4.70024299e-04 5.98538260e-04] [-6.33479884e-04 1.61763691e-03 3.17669301e-04] [-3.09208108e-04 -2.07191409e-04 6.93806941e-04] [ 9.61092319e-04 5.94657247e-04 4.93023772e-04] [-1.28623174e-06 1.11075437e-03 1.88875790e-04] [-5.19366085e-04 -4.04602225e-05 -1.42460629e-03] [ 9.04275041e-04 -7.75642713e-04 8.47956049e-04] [-4.19663516e-04 -3.26347538e-05 1.17917926e-03] [ 8.45588048e-04 1.70262198e-04 -8.11509820e-04] [ 3.42137882e-04 1.52302037e-04 -7.85605146e-04] [ 1.06581121e-04 -2.46913130e-04 -3.27477893e-04] [ 3.74187261e-04 -5.93486300e-04 -8.52597558e-05] [ 1.39974376e-04 -6.93254799e-04 -1.48447763e-04]] Final stress: [0.03489922 0.03514249 0.1427436 0.00065904 0.00043064 0.00033968] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-7.08360721e-04 -5.98691501e-04 -2.42323071e-04] [-3.04446153e-04 3.48475957e-04 -1.74653192e-04] [ 1.61540986e-04 -7.26248389e-04 -4.47373493e-05] [-2.79563061e-04 8.59525785e-04 6.33442377e-05] [-1.85786300e-04 -5.17232175e-05 -7.14315673e-04] [ 4.88788205e-05 -5.05501545e-04 9.57074097e-05] [ 4.01745725e-04 -2.83291485e-04 -3.46447258e-04] [ 6.99557764e-04 -5.91389567e-04 8.88541162e-05] [ 7.36220793e-04 2.87063526e-04 -3.16708687e-04] [ 8.85212754e-04 -2.89927600e-04 -3.43554444e-04] [-1.12975499e-03 6.99074517e-04 5.60481005e-04] [-2.37125476e-05 -5.17673757e-04 5.65799811e-04] [-2.37633845e-04 8.67366768e-04 5.35076036e-04] [ 3.93773957e-04 -6.06056228e-04 5.33208947e-05] [ 3.88214780e-05 6.71086352e-04 4.54404860e-04] [-3.22021127e-04 2.07991275e-04 4.31014584e-04] [-3.76394850e-04 -4.34450878e-05 -1.77809549e-05] [-2.81543694e-04 7.03754363e-05 3.38538117e-04] [-4.53234985e-05 -4.97486931e-05 -2.11605918e-04] [-1.27865539e-04 -5.75607842e-05 7.25195923e-04] [ 4.31205645e-04 6.78371241e-04 2.37434355e-04] [-2.38029040e-04 -4.66780941e-04 -1.38214381e-04] [ 5.12293665e-04 8.24751733e-04 -9.59547125e-04] [-4.88162239e-05 -7.26043794e-04 -6.39283297e-04]] Final stress: [ 3.35853782e-02 3.24741937e-02 1.35162049e-01 -2.35032511e-06 1.05638044e-03 -1.29256936e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 126 steps. Final forces: [[ 3.27067707e-03 1.03240796e-02 9.63656199e-04] [-1.22056247e-02 4.71511926e-04 -3.17227316e-03] [ 8.81926354e-03 9.38416966e-04 4.91489144e-03] [-1.21641030e-02 4.94872323e-03 -8.22984701e-03] [-7.96198358e-03 -6.49988968e-03 6.32584110e-03] [ 8.96021475e-03 7.11840844e-03 3.04902473e-03] [ 2.16347737e-02 -5.79224290e-03 -1.07334531e-02] [-1.53929220e-02 -1.24207060e-02 -7.98360809e-03] [-1.44938899e-03 1.20968900e-02 1.78444526e-03] [ 1.21678502e-02 -9.57656691e-03 -3.62393717e-03] [ 8.68097233e-03 1.43959512e-02 8.32073057e-05] [ 1.10794855e-02 -1.59360549e-02 6.39348840e-03] [-1.38119955e-02 -1.75338084e-02 3.35854233e-03] [ 1.85734223e-03 1.84287446e-02 -3.09955107e-03] [ 1.25865023e-02 2.10407309e-03 3.60652065e-03] [-9.26684292e-03 -1.10207810e-02 8.98686877e-03] [ 1.80601897e-03 -3.59921436e-03 4.12584488e-05] [-1.14505135e-02 -9.29031803e-03 1.08831474e-02] [-1.50268729e-03 -1.25756380e-02 3.56091535e-03] [-5.93389302e-03 2.01208821e-02 -1.01389062e-02] [ 6.60630229e-03 3.03516341e-03 -1.19989343e-03] [-2.94041348e-03 1.02620080e-02 -1.53217532e-03] [ 4.74039611e-03 -2.19184192e-03 -4.79702260e-03] [-8.12943103e-03 2.19220953e-03 5.58859698e-04]] Final stress: [ 0.03481987 0.03526156 0.14255718 -0.00074065 -0.00044489 0.00034704] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 124 steps. Final forces: [[ 7.96122730e-04 -5.16944907e-04 -1.65985898e-03] [-8.46819796e-04 -2.31670170e-04 -1.93940819e-03] [ 4.70651320e-05 1.03678804e-03 -8.27779937e-04] [-2.14056702e-03 -2.84560555e-04 5.37269269e-04] [ 7.69629162e-04 -3.18701187e-03 -1.44049386e-04] [ 3.39860175e-03 1.67785672e-03 -2.97057089e-04] [-3.20570301e-03 1.86699028e-03 1.86365813e-03] [-7.52532355e-04 2.83061103e-03 8.62634923e-04] [-2.89750344e-03 -1.12063188e-03 1.47527943e-03] [ 1.64266256e-03 -9.05949319e-04 -9.55143534e-04] [ 6.10764511e-04 1.64230074e-04 3.22755049e-04] [-2.79854205e-04 -6.92198715e-04 1.59936162e-04] [ 9.88805402e-04 -2.48726004e-03 -3.56376923e-04] [-3.94769694e-03 4.15448140e-04 -9.40109488e-05] [ 4.05801608e-03 1.59570804e-04 1.38854751e-04] [ 2.65106299e-03 2.53733090e-03 -1.19475018e-03] [-2.54002821e-04 7.01634145e-04 5.02805686e-04] [-8.02037065e-05 -2.27460425e-03 1.61002562e-04] [-4.51568345e-04 9.85359509e-04 -2.81658852e-04] [ 3.76033487e-05 -2.16540507e-04 9.39864050e-05] [ 1.03500768e-03 -1.16649232e-05 -3.20568446e-04] [-3.90898381e-04 -3.97284391e-04 3.16518829e-04] [-3.65322701e-04 5.85566436e-04 1.12576232e-03] [-4.22668625e-04 -6.35064539e-04 5.10198955e-04]] Final stress: [ 3.52688497e-02 3.47787698e-02 1.42737378e-01 -2.15504015e-05 -8.13345398e-04 -1.22020299e-04] Minimization converged after 171 steps. Minimization converged after 194 steps. Minimization converged after 29 steps. Minimization converged after 26 steps. Minimization converged after 9 steps. Minimization converged after 27 steps. Minimization converged after 28 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-4.47704568e-10 1.01270409e-05 5.08584804e-07] [-1.67158256e-10 -1.01266403e-05 4.42269450e-07] [-3.43604066e-10 -1.01258489e-05 -4.16187367e-07] [ 1.48243129e-09 1.01269609e-05 -4.63229152e-07] [ 1.53815356e-09 1.68102625e-08 4.93650187e-09] [-1.56888276e-08 -1.02606597e-08 6.23561655e-09] [ 1.26857295e-08 -6.75989703e-09 4.29228741e-09] [ 7.65038004e-11 5.24673918e-08 -1.88081480e-08] [-5.14693856e-08 -2.73617365e-08 -2.11299707e-08] [ 5.16147498e-08 -2.73355564e-08 -2.14999345e-08] [-1.53060536e-09 -1.41760490e-05 -2.17280776e-09] [ 2.23315251e-06 -1.97796502e-05 -2.35482755e-09] [-2.23048561e-06 -1.97829503e-05 -2.01370084e-09] [ 7.98669519e-10 1.41986664e-05 -6.20319515e-09] [-2.24924247e-06 1.97694296e-05 -4.76245231e-09] [ 2.24779247e-06 1.97711489e-05 -6.32906352e-09] [ 1.79999488e-10 -2.66784977e-05 3.32118310e-06] [-6.29808428e-11 2.66787148e-05 3.32111305e-06] [ 2.35818864e-10 2.66784586e-05 -3.32191922e-06] [ 3.56635277e-11 -2.66781797e-05 -3.32151311e-06] [-1.92656446e-10 9.05963094e-06 -4.91096135e-05] [ 8.40217102e-11 -9.05972479e-06 -4.91102531e-05] [ 9.77381817e-11 -9.05971076e-06 4.91098534e-05] [-1.43454748e-10 9.05964070e-06 4.91095213e-05]] Final stress: [ 1.78896350e-04 1.35021287e-04 1.75291156e-04 -2.02256750e-12 -5.03974277e-12 -1.07321864e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.65854552e-10 3.99832057e-05 2.07190014e-05] [-2.08822473e-10 -3.99845458e-05 1.94275350e-05] [ 1.14333760e-10 -3.99851187e-05 -1.99982155e-05] [-4.73737105e-10 3.99843629e-05 -2.14340326e-05] [-5.77997980e-10 1.64091070e-06 5.04563374e-07] [-1.42139994e-06 -8.19988467e-07 5.05017588e-07] [ 1.42259892e-06 -8.21363145e-07 5.05834276e-07] [-5.47854309e-10 7.60378015e-07 -2.09208718e-07] [-6.54578918e-07 -3.78898732e-07 -2.07491004e-07] [ 6.55125998e-07 -3.79846491e-07 -2.07431212e-07] [-7.51334550e-11 1.09940037e-04 5.05316709e-08] [ 2.47134048e-05 -3.61032129e-05 5.03173562e-08] [-2.47133504e-05 -3.61033396e-05 5.04154224e-08] [-6.57693955e-10 -1.09785907e-04 7.60319214e-08] [-2.48415973e-05 3.60277546e-05 7.63833215e-08] [ 2.48427755e-05 3.60263249e-05 7.64647942e-08] [-7.27560234e-11 -2.51197173e-05 2.76621448e-06] [-6.17623730e-11 2.51196743e-05 2.77025398e-06] [-6.54437615e-11 2.51199275e-05 -2.76062165e-06] [-6.77110035e-11 -2.51199145e-05 -2.75991027e-06] [ 2.56454857e-11 7.49096131e-06 1.03060525e-05] [-8.50711471e-11 -7.49133447e-06 1.02778006e-05] [-3.99093212e-11 -7.49134558e-06 -1.02774126e-05] [-1.89309679e-11 7.49099540e-06 -1.03080942e-05]] Final stress: [ 6.63200216e-05 2.09385714e-05 -3.96540438e-05 -1.76591333e-12 -4.34953111e-14 1.72553033e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.71967857e-10 -4.30050968e-06 -1.90797062e-07] [ 3.70738135e-12 4.29999318e-06 -2.07632613e-07] [ 1.61452284e-10 4.30078492e-06 1.95572450e-07] [ 2.91663554e-10 -4.30116678e-06 1.14625543e-07] [ 7.89535314e-10 6.37391137e-08 2.37395903e-08] [-5.25789962e-08 -3.20658593e-08 2.26017143e-08] [ 5.10659240e-08 -3.03012303e-08 2.17117104e-08] [-6.73100635e-10 3.13878954e-08 -5.92122507e-09] [-2.82097272e-08 -1.52585474e-08 -6.24208085e-09] [ 2.96581613e-08 -1.68550279e-08 -7.19846484e-09] [ 3.94185184e-10 1.11012057e-05 2.24422095e-10] [-3.14201115e-07 1.21279960e-05 -2.33180626e-10] [ 3.13533720e-07 1.21288346e-05 6.64236433e-10] [ 3.13128190e-10 -1.11253244e-05 1.16280413e-08] [ 3.36024929e-07 -1.21164270e-05 1.16316519e-08] [-3.36556099e-07 -1.21157399e-05 1.18532664e-08] [ 4.79857265e-11 2.29150309e-05 2.62511365e-06] [-6.26381169e-11 -2.29151094e-05 2.62529934e-06] [ 7.58999530e-11 -2.29153149e-05 -2.62357710e-06] [-3.60749486e-11 2.29152462e-05 -2.62486646e-06] [ 5.49954526e-12 -1.09172957e-05 -6.72513475e-06] [ 4.86174249e-11 1.09172210e-05 -6.72554033e-06] [ 7.74874742e-12 1.09172732e-05 6.72698267e-06] [ 6.75612344e-11 -1.09173443e-05 6.72549498e-06]] Final stress: [-3.68854437e-05 8.12591700e-06 6.02905672e-05 -3.44667763e-13 -1.78312277e-12 3.72999731e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-2.23339469e-09 6.79669569e-06 2.00851656e-05] [ 2.04097015e-09 -6.80010729e-06 2.03727830e-05] [-1.29356383e-09 -6.80094328e-06 -2.01308168e-05] [ 1.03251765e-09 6.79291053e-06 -2.06802045e-05] [-3.23630843e-09 1.68569654e-07 6.23822601e-08] [-1.31406492e-07 -7.79256841e-08 5.39632524e-08] [ 1.36262062e-07 -8.44125891e-08 5.53971890e-08] [ 2.61765677e-09 -7.51901394e-08 1.70009471e-08] [ 7.17714647e-08 3.76585657e-08 2.27794364e-08] [-7.47502696e-08 4.23940914e-08 2.25704338e-08] [ 1.61861274e-09 5.09499769e-05 -5.65703013e-08] [ 1.48330614e-05 4.31268960e-05 -5.28140482e-08] [-1.48360168e-05 4.31304650e-05 -5.83296615e-08] [-1.65124636e-10 -5.07484059e-05 9.65428339e-08] [-1.50061385e-05 -4.32278770e-05 9.58858994e-08] [ 1.50067878e-05 -4.32283668e-05 9.04392067e-08] [-1.41306106e-10 9.63260353e-05 5.30136681e-05] [ 7.33168526e-11 -9.63264574e-05 5.30263789e-05] [-1.20941757e-10 -9.63270366e-05 -5.30142260e-05] [ 4.82933971e-11 9.63261372e-05 -5.30208262e-05] [ 1.48018986e-10 2.37843380e-06 -7.43512643e-05] [-5.29973765e-11 -2.37882402e-06 -7.43442099e-05] [-5.68150674e-11 -2.37903692e-06 7.43506582e-05] [ 1.50368329e-10 2.37841083e-06 7.43436463e-05]] Final stress: [-1.45537703e-04 -1.12671736e-04 -1.54796762e-04 1.49961924e-11 1.32817366e-13 3.48705460e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-2.47318352e-07 -9.98636406e-06 4.56236919e-05] [-1.88231662e-07 1.26433320e-05 1.42246360e-04] [-2.46385773e-07 1.00897388e-05 2.11363561e-05] [-5.04196651e-08 -1.25138626e-05 1.57698882e-04] [-2.32424585e-07 -1.15692219e-04 -4.73319264e-05] [ 1.00800184e-04 5.81663013e-05 -4.75737895e-05] [-1.00325291e-04 5.76233345e-05 -4.72550372e-05] [-3.15466046e-07 1.72468693e-04 -4.21027099e-05] [-1.49074439e-04 -8.58638834e-05 -4.19906633e-05] [ 1.49808908e-04 -8.66523809e-05 -4.25632901e-05] [-2.24293549e-07 -1.20174738e-04 -1.46031321e-05] [ 1.34721954e-04 7.60239157e-05 -1.65529083e-05] [-1.34277286e-04 7.55076464e-05 -1.65620820e-05] [-2.65551779e-08 -2.21111158e-04 -1.77951972e-05] [ 1.59888980e-04 9.47365070e-05 -1.56775389e-05] [-1.59797623e-04 9.46532971e-05 -1.58374752e-05] [-2.48142619e-08 2.93244843e-05 6.51591844e-05] [-4.30404690e-08 -4.76227045e-07 6.07703334e-05] [-2.06362109e-08 -2.93132924e-05 -6.16171282e-05] [-3.50571797e-08 4.66960120e-07 -6.78132457e-05] [-3.78124700e-08 3.11689378e-05 -7.79146787e-06] [-1.00977256e-08 -2.99544172e-05 -9.93761885e-06] [-1.31126941e-08 -3.11855387e-05 1.15466952e-05] [-2.97210797e-08 3.00509332e-05 8.82370804e-06]] Final stress: [ 1.24040238e-04 7.96404619e-05 6.49707759e-05 -4.20958523e-05 -3.98033331e-10 -8.93534561e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-5.66935394e-05 2.69139139e-04 1.26627818e-04] [-3.71991693e-05 -1.07397162e-03 -6.36120289e-05] [ 3.67375456e-05 3.00509889e-04 1.73812951e-04] [ 9.69464434e-05 -9.62873724e-04 -5.31602948e-05] [ 5.85867791e-05 -1.15798330e-05 -1.43537548e-03] [-1.47510716e-04 -2.28141971e-04 2.02186377e-04] [ 1.45013962e-04 -1.08180264e-04 2.77135481e-04] [-1.16983978e-05 -1.17473372e-03 -4.07653882e-04] [-3.66860492e-05 -8.84561664e-04 1.83039248e-04] [ 5.13176309e-05 -9.84730059e-04 2.12883562e-04] [-6.23317341e-05 7.42556738e-04 -4.34457458e-04] [-2.57039929e-04 9.16383636e-04 4.23905365e-04] [ 3.12701999e-04 7.58981466e-04 4.54607227e-04] [ 6.38813705e-05 6.98384773e-04 -4.23061523e-04] [-3.66095602e-04 7.53662229e-04 4.45357933e-04] [ 2.12500359e-04 9.53384160e-04 2.29421895e-04] [ 8.86083607e-06 -6.40558878e-05 1.85697000e-04] [-1.38623366e-05 -1.79518020e-04 -1.12619938e-04] [ 1.97079052e-05 -2.08901091e-04 -2.03730194e-04] [-3.17434080e-06 -2.05152840e-04 1.68032195e-04] [-7.55474520e-06 3.36054184e-04 1.03481515e-04] [-8.33679759e-06 1.85887723e-04 -1.25941347e-05] [ 1.84520152e-05 1.87322246e-04 -1.57025400e-04] [-1.65234890e-05 -1.58654892e-05 1.17101769e-04]] Final stress: [-2.37258248e-04 -3.97344196e-05 -1.75245503e-04 6.30028735e-05 -6.71864769e-07 -1.92443342e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-1.14985592e-07 5.57319070e-05 -1.70963195e-05] [-2.46498403e-07 -6.35746662e-06 1.15189726e-04] [-5.39466169e-07 -5.58850436e-05 -9.84284969e-05] [ 7.35394094e-07 6.27122186e-06 1.66575979e-04] [ 5.66441002e-07 -3.00849090e-04 -8.57892154e-05] [ 2.60018745e-04 1.49817293e-04 -8.50818173e-05] [-2.61229917e-04 1.51167538e-04 -8.59403173e-05] [-4.23090421e-07 -1.84572583e-04 4.69423628e-05] [ 1.60849127e-04 9.29294679e-05 4.74863586e-05] [-1.59900112e-04 9.18949271e-05 4.67725522e-05] [-1.25955077e-06 2.27049663e-05 -5.46200035e-05] [-3.79204706e-05 -4.85052382e-05 -9.48678290e-05] [ 4.01527804e-05 -5.12492942e-05 -9.47644778e-05] [ 7.69005172e-07 1.23122660e-04 3.83295050e-05] [-8.80890241e-05 -2.38466654e-05 7.87455782e-05] [ 8.66964872e-05 -2.21548478e-05 7.82422191e-05] [ 7.17266201e-08 -2.94321986e-06 -1.05308166e-04] [-7.76080822e-08 4.91707991e-05 -8.50701686e-05] [ 7.64418198e-08 2.99008868e-06 1.02063963e-04] [-3.34537822e-08 -4.91467586e-05 8.62895324e-05] [-1.55913672e-07 -4.25329426e-05 -1.26260764e-04] [ 9.57704477e-08 8.65620148e-05 -1.32980295e-04] [ 8.04998625e-08 4.24253532e-05 1.19552222e-04] [-1.22327181e-07 -8.67450872e-05 1.40017871e-04]] Final stress: [-9.33511731e-05 -6.06402003e-05 -3.97768226e-05 -4.29656334e-05 -1.61014977e-09 -9.04270063e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.12726918e-06 -4.78744134e-05 7.13198724e-04] [-4.83661025e-07 7.20129710e-04 9.85942069e-04] [-6.47785389e-07 4.85178178e-05 5.43212409e-04] [-4.14553126e-07 -7.19728544e-04 -9.67750375e-04] [-9.28606578e-07 -1.90030398e-04 -4.60901212e-05] [ 1.64719972e-04 9.59718048e-05 -4.62992114e-05] [-1.62851419e-04 9.38183072e-05 -4.50700741e-05] [-1.07620224e-06 7.33001081e-04 -2.54648185e-04] [-6.32605703e-04 -3.65384097e-04 -2.52774956e-04] [ 6.35137950e-04 -3.68087755e-04 -2.54757464e-04] [-1.89785911e-07 1.07280627e-03 -3.66713792e-04] [ 1.22045366e-04 -3.55633065e-04 -8.29539003e-05] [-1.21552116e-04 -3.56138410e-04 -8.29890713e-05] [-7.89387717e-07 -3.33258428e-04 2.45499474e-04] [-7.65382757e-04 -1.34538995e-05 -3.85428249e-05] [ 7.66943342e-04 -1.52633057e-05 -3.91756437e-05] [-1.06519323e-07 -2.66431975e-04 4.43492360e-05] [-1.44251716e-07 -4.60469279e-05 6.22766760e-05] [-7.64452317e-08 2.66726701e-04 -6.30766789e-05] [-1.25985344e-07 4.57276683e-05 -5.81163376e-05] [-6.69036455e-08 -7.89124686e-05 -3.02158373e-04] [-1.13652901e-07 2.14236306e-05 -2.82374879e-04] [-1.25385930e-07 7.94510401e-05 3.07271627e-04] [-3.82388038e-08 -2.13303385e-05 2.81741673e-04]] Final stress: [-8.33362078e-05 -6.96814138e-05 -4.54320258e-05 3.98435545e-05 -1.58221907e-09 2.68874309e-10] Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 5.49742139e-04 -1.30209362e-04 9.33889131e-05] [-2.10798183e-04 7.32743414e-04 -6.86971893e-04] [-1.71477808e-04 -5.21435199e-04 1.05574729e-03] [ 6.03154904e-05 1.45551520e-03 -1.77588095e-03] [ 4.57444132e-05 1.38310497e-03 2.24745265e-03] [-1.00325843e-03 -1.65849878e-03 7.22646328e-04] [ 7.01660905e-04 -1.29364292e-03 6.75435052e-04] [ 1.76869776e-04 4.16742991e-04 1.19626682e-03] [-5.64699007e-04 -6.55750254e-05 -7.62226201e-04] [-2.59011169e-04 1.09539866e-03 -1.13073811e-04] [-4.04093296e-04 -7.57226692e-04 1.66039364e-03] [-5.55020350e-05 5.82821366e-04 2.89617498e-04] [ 1.13431841e-03 -5.40888096e-04 2.76664373e-04] [ 1.04390720e-05 -6.66744728e-04 -9.96810223e-04] [-5.39657468e-04 -2.23160664e-04 -2.05110291e-03] [ 4.46201179e-04 -5.61264596e-05 -1.70323730e-03] [-1.72106587e-05 -5.29191983e-05 7.78438751e-05] [ 1.09504527e-05 1.21897165e-04 -2.20356497e-04] [ 2.63765323e-05 -1.04218542e-04 -1.57946451e-04] [ 7.02373353e-05 4.82692018e-05 1.46881043e-04] [-1.00690784e-04 -9.09916880e-06 -1.18974401e-04] [-5.88377798e-05 2.17907732e-04 1.74150948e-04] [ 1.00215282e-04 -1.24817480e-04 9.87390159e-05] [ 5.21656328e-05 1.50161610e-04 -1.28646798e-04]] Final stress: [-2.36303549e-04 -4.01737964e-05 -1.70323735e-04 -1.49809863e-07 3.87365403e-05 2.71146851e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.74094597e-04 7.50458146e-04 -3.95370882e-04] [ 1.73903373e-04 -7.49016886e-04 -7.23972445e-04] [-1.72709525e-04 -7.48339391e-04 3.93180611e-04] [-1.71958192e-04 7.49690356e-04 7.04027459e-04] [ 1.75523483e-06 -3.48895207e-06 2.76014162e-07] [-1.94119354e-06 -9.49488082e-07 2.96440863e-06] [-1.93266194e-06 3.30300348e-06 1.50363687e-07] [ 9.00693286e-07 -1.14339391e-05 4.11798030e-06] [ 3.36382558e-06 3.41587589e-06 5.18444001e-07] [-5.59982510e-06 5.74028367e-06 2.32508954e-06] [-3.67091838e-07 -1.11702676e-03 5.92771421e-05] [-3.22684934e-04 3.56984585e-04 1.31497690e-04] [ 3.23179312e-04 3.56273648e-04 -1.36634727e-05] [ 6.56508414e-07 1.15512356e-03 -5.52161826e-05] [ 2.89549769e-04 -3.76592838e-04 -1.28130577e-04] [-2.91107011e-04 -3.74938390e-04 1.70245688e-05] [ 2.50162907e-05 3.49725082e-04 1.14687504e-04] [ 2.49365209e-05 -3.49474511e-04 1.07967729e-04] [-2.46203024e-05 -3.49478869e-04 -1.15022646e-04] [-2.47304517e-05 3.49981217e-04 -1.07019835e-04] [ 2.36336672e-04 -6.12935682e-05 -1.13104890e-03] [ 2.36469545e-04 6.12031986e-05 -1.13622170e-03] [-2.36192958e-04 6.13312664e-05 1.13101601e-03] [-2.36318196e-04 -6.11966327e-05 1.13663563e-03]] Final stress: [-1.03925505e-04 -1.01864429e-04 -3.66208927e-05 -6.44444583e-09 -4.86581919e-05 -7.29190383e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-4.67460015e-06 5.58670628e-06 -2.07411029e-07] [-4.61049535e-06 -5.50259481e-06 -5.70231310e-06] [ 4.64446281e-06 -5.55408734e-06 -3.48722676e-06] [ 4.70939046e-06 5.53842322e-06 5.33917942e-07] [ 1.91310543e-08 -9.02241429e-07 5.30572082e-07] [ 7.18930333e-07 4.12097713e-07 5.86531476e-07] [-7.96686767e-07 4.78608422e-07 5.01609797e-07] [-2.19492974e-08 1.14329253e-06 3.37305098e-07] [-8.47916822e-07 -5.27758984e-07 3.91373026e-07] [ 9.04994908e-07 -5.86160374e-07 3.41895403e-07] [ 3.17435013e-08 -9.97153486e-06 1.72609579e-06] [-1.54515800e-07 -8.23116027e-06 7.64296281e-06] [ 9.20443781e-08 -8.15894955e-06 -4.12846128e-06] [ 3.88022759e-08 1.08386680e-05 8.47985283e-08] [-1.00335100e-06 7.66479738e-06 -5.82305840e-06] [ 9.32049071e-07 7.75092430e-06 5.86835126e-06] [-1.62064423e-05 -2.39426438e-05 -6.52475345e-05] [-1.62147883e-05 2.39411417e-05 -6.53435024e-05] [ 1.62138970e-05 2.39422335e-05 6.54093785e-05] [ 1.62064008e-05 -2.39520590e-05 6.55321530e-05] [-4.98101732e-06 -3.29749882e-05 1.08090161e-05] [-4.97685136e-06 3.29927956e-05 1.07383159e-05] [ 4.98691381e-06 3.29913554e-05 -1.05923284e-05] [ 4.98985403e-06 -3.29768655e-05 -1.05024408e-05]] Final stress: [-9.50783260e-05 -5.07806508e-05 -4.33248870e-05 2.76746865e-10 4.26955036e-05 -1.98694835e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 1.75970751e-04 6.75650534e-05 9.11080016e-05] [-1.63102490e-04 -7.06067426e-05 7.13267222e-05] [-1.56603061e-04 -7.43606010e-05 -2.11888491e-04] [ 1.64873025e-04 7.55861824e-05 -2.11835629e-04] [ 1.02578557e-05 3.65196618e-05 2.71638034e-05] [-2.68645438e-05 -2.89767717e-05 3.27202566e-05] [ 9.72622807e-06 -7.36529260e-06 2.40459453e-05] [ 3.65791536e-06 2.72554064e-05 2.57898634e-06] [-2.27625562e-05 -1.83174255e-05 -1.70216227e-06] [ 6.90852567e-06 -4.98870922e-06 1.61395094e-05] [-8.64394344e-04 -4.54852633e-04 2.31377239e-05] [ 1.21212763e-04 -7.43038400e-04 2.32481751e-05] [ 5.03710897e-04 5.63831699e-04 2.97466395e-05] [ 8.71552194e-04 3.00409385e-04 1.71839866e-05] [ 6.36323776e-06 8.11838879e-04 1.88712782e-05] [-6.46079400e-04 -4.78132826e-04 3.04476515e-05] [-1.56713203e-04 1.94656193e-04 -1.48550743e-04] [ 1.58596023e-04 -1.96037173e-04 -1.52268569e-04] [ 1.58560983e-04 -1.95685955e-04 1.56572942e-04] [-1.57114903e-04 1.94710593e-04 1.53238395e-04] [-7.47572118e-05 2.71017230e-06 -8.94589790e-06] [ 7.59295737e-05 -2.65423020e-06 -8.66113988e-06] [ 7.62625524e-05 -3.54068736e-06 1.28447447e-05] [-7.51908112e-05 3.47422199e-06 1.34778709e-05]] Final stress: [-1.93877805e-04 -1.60696302e-04 -1.32693260e-04 -1.28768008e-08 1.40723123e-08 -3.73868210e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-4.58548574e-05 -1.28098701e-04 -2.52284012e-04] [ 4.70808317e-05 1.23487688e-04 -4.76035150e-04] [ 3.62245112e-05 1.22140012e-04 1.37297426e-04] [-3.96845685e-05 -1.18551590e-04 1.77278812e-04] [-3.70348388e-06 -7.89984179e-05 1.52913857e-05] [ 6.19478847e-05 4.00625324e-05 2.20824061e-05] [-5.96898443e-05 3.46060599e-05 1.87681165e-05] [ 1.82963428e-06 -1.77046357e-04 4.51267960e-05] [ 1.65392416e-04 9.07093141e-05 5.41099637e-05] [-1.62926721e-04 9.12909593e-05 4.91160184e-05] [ 1.53893158e-03 4.21380554e-04 5.59715200e-05] [-1.04713747e-03 4.30671497e-04 6.02484747e-05] [ 1.21429892e-04 -6.37924490e-04 4.92266177e-05] [-1.53655059e-03 1.83472980e-07 3.76116351e-06] [ 6.85556451e-04 -6.42963055e-04 1.32815504e-05] [ 2.38398130e-04 4.29292449e-04 6.91030818e-06] [-9.67943314e-06 7.42903140e-05 -4.18888257e-05] [ 1.01985945e-05 -7.51494291e-05 -3.92039095e-05] [ 1.00756925e-05 -7.38061565e-05 4.17514410e-05] [-9.52752369e-06 7.34591763e-05 5.06256975e-05] [ 9.71913445e-05 1.33041183e-04 1.24786272e-04] [-9.82567614e-05 -1.32602208e-04 1.29837195e-04] [-9.88201608e-05 -1.33124833e-04 -1.27608745e-04] [ 9.75744485e-05 1.33650026e-04 -1.18450522e-04]] Final stress: [-1.76787754e-04 -1.68916074e-04 -1.40344682e-04 -1.93157980e-08 4.02832663e-09 4.18660248e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-3.24003946e-04 6.59141198e-04 3.38463328e-03] [ 3.99409543e-04 -6.63319553e-04 -4.53721085e-03] [ 4.53934217e-04 -5.95122545e-04 -4.11010687e-03] [-3.98956111e-04 7.31003871e-04 3.97174028e-03] [ 2.88260305e-05 -2.85770173e-04 -2.87867801e-05] [-3.69576498e-05 6.69551098e-05 8.93759863e-05] [-8.49012468e-06 1.23836299e-04 6.88658865e-05] [ 4.76547404e-05 2.05453709e-04 8.07971269e-05] [-2.35586984e-04 -1.81927141e-04 -2.02047674e-05] [ 8.81406125e-05 -4.32076497e-05 1.20991628e-04] [-2.32704287e-03 -1.02739826e-03 1.64571510e-03] [ 1.81612384e-03 -2.70939923e-03 1.53828764e-03] [ 1.02890009e-03 1.93845159e-03 1.57396425e-03] [ 2.35371317e-03 9.36057819e-04 -1.32245001e-03] [-1.87772376e-03 2.69645757e-03 -1.31437966e-03] [-1.03664055e-03 -1.88290922e-03 -1.25684722e-03] [-2.30843394e-04 3.06072242e-04 3.02856148e-04] [ 2.47326727e-04 -3.06312447e-04 1.15758188e-04] [ 2.33063444e-04 -2.86171478e-04 -2.76748447e-04] [-2.33506596e-04 3.04271448e-04 -8.56993763e-05] [-2.59670176e-04 1.11306683e-04 -1.43734968e-03] [ 2.71445061e-04 -1.11306372e-04 -1.56421766e-03] [ 2.67352725e-04 -1.05687759e-04 1.47276556e-03] [-2.66468051e-04 1.19524288e-04 1.58825024e-03]] Final stress: [-2.76989492e-04 -3.28952641e-04 -2.36981246e-04 -6.46532665e-07 5.70558687e-07 -4.90555264e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 3.46146315e-04 4.57036710e-05 5.12974640e-03] [-3.74603143e-04 1.36499965e-04 -6.18618544e-03] [-4.12835543e-04 1.25305642e-04 -5.69148556e-03] [ 3.51303531e-04 -1.53447884e-04 5.95414023e-03] [-3.47550067e-05 -2.28166442e-04 -7.83822379e-05] [-7.54288340e-05 1.03443806e-04 5.28207613e-06] [ 1.04810623e-04 4.57801100e-05 -2.14651288e-06] [-1.58916746e-04 1.23125415e-04 9.77685157e-05] [ 2.15451290e-05 6.68740213e-05 5.06901479e-05] [ 2.28654931e-04 -2.60635024e-04 -5.99925964e-05] [ 4.37048271e-03 -2.01168426e-04 2.19376089e-03] [-1.41661753e-03 2.31329472e-03 2.19025755e-03] [-1.04184095e-03 -1.27772750e-03 2.18413410e-03] [-4.46030908e-03 1.99534686e-04 -1.80984459e-03] [ 1.44229775e-03 -2.23758553e-03 -2.03738369e-03] [ 1.16168446e-03 1.16627453e-03 -1.99878191e-03] [-4.23435280e-04 -4.61116968e-04 7.73508933e-05] [ 3.91365632e-04 4.75131886e-04 -1.89764952e-04] [ 4.12796902e-04 4.77552881e-04 -5.99839383e-05] [-4.26241726e-04 -4.73822348e-04 2.15098558e-04] [ 8.71262665e-05 1.68868365e-04 3.02263450e-04] [-1.06128119e-04 -1.61048898e-04 1.25207578e-04] [-8.71014831e-05 -1.59904311e-04 -2.89553317e-04] [ 9.99992063e-05 1.67233640e-04 -1.22195637e-04]] Final stress: [-2.27857323e-04 -3.52969944e-04 -2.58317181e-04 2.58823579e-07 -5.85489919e-07 6.58691620e-05] Minimization converged after 28 steps. Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.91264754e-10 -9.62570863e-06 3.94004908e-06] [ 1.01223195e-09 9.62605774e-06 4.16803993e-06] [ 2.18710441e-10 9.62546645e-06 -4.19933753e-06] [ 9.13763454e-10 -9.62355443e-06 -4.09615020e-06] [ 1.55938770e-09 -2.47231744e-08 -1.01138461e-08] [ 1.16986744e-08 8.90716517e-09 -5.28133040e-09] [-1.51180471e-08 1.26821348e-08 -7.78384793e-09] [-3.41761998e-10 -1.58335554e-07 5.19484646e-08] [ 1.39087239e-07 7.98626548e-08 5.27723785e-08] [-1.38502935e-07 7.91292714e-08 5.24738748e-08] [ 4.26360003e-10 9.11102570e-06 -1.93808574e-09] [-9.74425502e-07 2.62111545e-05 -2.62786977e-09] [ 9.73390206e-07 2.62122107e-05 -2.71516743e-09] [ 2.99677783e-10 -9.29823116e-06 1.93637061e-08] [ 1.13499667e-06 -2.61186492e-05 2.03085755e-08] [-1.13555635e-06 -2.61179881e-05 1.98843727e-08] [ 1.79269960e-10 3.20115386e-05 -1.33224538e-06] [-5.52455859e-11 -3.20113241e-05 -1.33395212e-06] [ 1.97149241e-10 -3.20108448e-05 1.33639053e-06] [-4.62065108e-11 3.20111924e-05 1.33182700e-06] [ 5.12807019e-11 -8.41636132e-06 -5.43045510e-05] [ 7.25552425e-11 8.41640060e-06 -5.43017090e-05] [ 3.91957778e-11 8.41634790e-06 5.43023120e-05] [ 9.49358370e-11 -8.41625539e-06 5.43030354e-05]] Final stress: [ 1.35262891e-04 1.78223623e-04 1.75633814e-04 -4.39434630e-12 -8.72354222e-13 -2.01911414e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 4.90589985e-10 -7.22449455e-06 2.27565304e-08] [ 2.57611217e-10 7.22444069e-06 1.15589530e-07] [ 1.03367668e-10 7.22485181e-06 -5.19548177e-08] [ 9.17747545e-11 -7.22467155e-06 -1.24833448e-07] [-6.40099256e-11 1.27845523e-08 4.36459718e-09] [-1.13403488e-08 -6.39811767e-09 4.48699963e-09] [ 1.12369431e-08 -6.40370651e-09 4.21597349e-09] [ 1.08403869e-09 -5.43426770e-09 4.28833469e-09] [ 2.87360657e-09 1.32174116e-09 3.21526006e-09] [-5.03930564e-09 3.80513254e-09 4.62124947e-09] [-2.77210865e-10 9.13029193e-07 -1.25909135e-08] [-9.75700403e-06 1.63560823e-05 -1.26336149e-08] [ 9.75742371e-06 1.63555142e-05 -1.32155433e-08] [-5.81278914e-11 -9.46742594e-07 1.69012379e-08] [ 9.78694621e-06 -1.63388419e-05 1.67709203e-08] [-9.78696090e-06 -1.63388925e-05 1.67914665e-08] [ 1.89320781e-11 2.29043844e-05 1.64387003e-06] [ 1.21965604e-10 -2.29043462e-05 1.64523389e-06] [-8.34582403e-12 -2.29043806e-05 -1.64303025e-06] [ 1.00093905e-10 2.29044349e-05 -1.64547122e-06] [-8.24396107e-13 -9.90433355e-06 4.98167816e-06] [ 1.22153932e-11 9.90430939e-06 4.98282218e-06] [ 1.51064193e-11 9.90431432e-06 -4.98111096e-06] [-2.30547803e-11 -9.90433309e-06 -4.98276559e-06]] Final stress: [ 2.10331148e-05 6.59250981e-05 -3.92244322e-05 -5.92411399e-13 1.59622160e-12 -6.21699618e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.41894496e-10 3.11407183e-06 -7.82427360e-09] [-1.58907232e-09 -3.11286363e-06 1.76630776e-07] [ 4.23885576e-10 -3.11226898e-06 -1.51496640e-07] [-2.43253639e-10 3.11419776e-06 -4.85961532e-08] [-6.78007820e-10 -1.37221138e-08 -1.37148872e-08] [ 9.73987954e-09 7.19954300e-09 -1.31837769e-08] [-7.87057347e-09 5.33512651e-09 -1.14966418e-08] [ 2.73260940e-10 -6.22247112e-08 2.48774066e-08] [ 5.05301921e-08 2.98667266e-08 2.24924812e-08] [-5.12952010e-08 3.06271173e-08 2.32054608e-08] [-1.23671645e-09 -1.42183636e-05 -6.94152716e-09] [-4.70896775e-06 -6.25403934e-06 -8.11713981e-09] [ 4.71124993e-06 -6.25679060e-06 -6.44052225e-09] [ 1.41945178e-10 1.39712670e-05 7.31512066e-09] [ 4.92169082e-06 6.37828354e-06 7.70777770e-09] [-4.92193873e-06 6.37859922e-06 7.61541608e-09] [-1.36202966e-10 -2.39652842e-05 4.89946529e-06] [ 2.43592368e-11 2.39654807e-05 4.89657682e-06] [-7.88500376e-11 2.39655663e-05 -4.89580588e-06] [ 1.09514148e-10 -2.39653037e-05 -4.90059545e-06] [-1.43898782e-10 1.27023876e-05 -1.28639660e-06] [-3.07221211e-11 -1.27022180e-05 -1.28600397e-06] [ 4.08597690e-11 -1.27021352e-05 1.28584832e-06] [-1.57557745e-10 1.27023316e-05 1.28487859e-06]] Final stress: [ 8.38964724e-06 -3.68944118e-05 6.00625542e-05 -2.13031862e-12 -4.66091248e-12 -5.57282389e-13] Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.40479896e-07 -8.00379481e-07 -2.10988397e-07] [ 6.34995887e-08 5.42558940e-06 9.77697530e-06] [ 1.55759126e-07 9.37872241e-07 -7.38129446e-07] [-5.67392840e-08 -5.53726587e-06 1.15355386e-05] [-1.19710211e-07 -2.23177504e-05 -6.40926092e-06] [ 1.97760816e-05 1.13602476e-05 -6.61627543e-06] [-1.95391252e-05 1.10854131e-05 -6.46347873e-06] [ 7.62379361e-08 -9.13207096e-06 2.02004193e-06] [ 7.28311952e-06 4.36043366e-06 1.69762166e-06] [-7.50343075e-06 4.57578358e-06 1.90261489e-06] [ 3.40971904e-07 6.01250868e-06 1.17746511e-05] [-5.52667200e-06 -8.30500123e-06 4.55157538e-06] [ 4.92211876e-06 -7.56240644e-06 4.56174908e-06] [ 1.46267151e-07 8.03080945e-06 -1.38462543e-05] [-6.93470069e-06 7.71420093e-07 -6.70701996e-06] [ 6.67838837e-06 1.08860183e-06 -6.58269281e-06] [-1.63101433e-08 -2.28761750e-06 5.00931509e-05] [ 1.35417861e-08 2.62643236e-05 4.79187494e-05] [-1.90400568e-08 2.25912972e-06 -5.04472396e-05] [ 7.04913225e-09 -2.62142221e-05 -4.78321025e-05] [ 4.28974284e-08 -2.52819741e-05 -1.41534823e-07] [ 1.50453678e-08 2.30521964e-05 7.61752421e-07] [ 1.92540265e-08 2.52813828e-05 -3.04070828e-07] [ 3.50168116e-08 -2.30670240e-05 -2.95372959e-07]] Final stress: [ 7.90994650e-05 1.24151370e-04 6.56767250e-05 -4.14835138e-05 3.01878397e-10 8.70414064e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.92079648e-06 1.59978381e-04 1.90350930e-04] [ 1.05881349e-07 -2.13172832e-04 3.85448438e-04] [ 8.84238753e-07 -1.63026180e-04 9.68540823e-04] [ 1.59975916e-06 2.16316124e-04 -3.02352933e-04] [ 5.33650610e-07 -9.71511073e-05 -3.32589122e-05] [ 7.57158001e-05 4.62494153e-05 -2.87597906e-05] [-7.73069207e-05 4.77813539e-05 -3.02555849e-05] [ 2.97874943e-06 7.85669471e-04 -2.62166685e-04] [-6.75166302e-04 -3.94903244e-04 -2.58899260e-04] [ 6.69090416e-04 -3.87960509e-04 -2.54837084e-04] [-1.07271653e-06 1.13647676e-04 4.77454794e-05] [-1.94649755e-04 -4.25046261e-05 1.04541364e-04] [ 1.96303188e-04 -4.46972819e-05 1.04551301e-04] [ 2.56484227e-06 2.49779737e-04 -1.69396679e-04] [-1.23634652e-04 -1.41172758e-04 -2.24341917e-04] [ 1.18783169e-04 -1.35417310e-04 -2.24832277e-04] [ 7.58990258e-08 -4.93916393e-05 3.57798557e-04] [ 3.02522557e-07 -1.52576561e-04 3.12531790e-04] [ 6.07433702e-08 5.02654760e-05 -3.70752230e-04] [ 3.58930054e-07 1.51522879e-04 -3.14383964e-04] [-6.05100263e-08 -8.31263980e-05 -1.70693630e-04] [ 3.30727574e-07 8.94025838e-05 -1.21537514e-04] [ 3.53136757e-07 8.37210640e-05 1.78549329e-04] [-7.15953659e-08 -8.92337129e-05 1.16410451e-04]] Final stress: [ 9.23807327e-05 1.09497133e-04 5.15502061e-05 4.52167848e-05 -1.31378852e-09 -1.59946935e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 8.16795798e-05 3.70302935e-04 -7.42079227e-04] [ 3.34140253e-05 1.33562333e-03 -1.69905177e-04] [-2.33058729e-05 4.20759900e-04 -7.73764168e-04] [-2.07705118e-04 1.29538692e-03 -6.80121879e-05] [ 2.64085079e-04 -1.75863430e-04 1.94943869e-03] [-5.83363393e-04 -8.67679989e-04 -4.78054856e-04] [ 3.17566585e-04 -5.63679562e-04 -4.68426004e-04] [-2.28256492e-05 -6.74655091e-04 2.02639118e-04] [ 1.10306645e-03 1.17946418e-03 5.37995362e-04] [-8.37463203e-04 4.27586317e-04 2.93928200e-04] [ 3.23137336e-04 -7.03038794e-04 8.72763210e-04] [ 6.90037911e-05 -5.87286649e-04 -5.76626923e-04] [-5.30787365e-04 -3.51808057e-04 -4.89731645e-04] [ 1.17378794e-04 -7.63575381e-04 6.43537638e-04] [ 2.09053157e-04 -5.61120434e-04 -5.44056851e-04] [-3.49811583e-04 -3.67302102e-04 -8.50427532e-05] [ 1.84467445e-05 1.20444380e-04 -2.72304000e-04] [-5.30455865e-06 2.35981095e-04 1.80229746e-04] [ 6.84490552e-06 1.55729660e-04 3.16825033e-04] [-2.54969094e-05 2.30932215e-04 -2.36928049e-04] [ 1.82617239e-05 -1.66017328e-04 -2.34239167e-04] [ 1.92964172e-05 -3.68935615e-05 2.02157419e-04] [-1.09365137e-05 -7.03920895e-05 3.92459648e-04] [ 1.57655736e-05 1.17101542e-04 -4.52803055e-04]] Final stress: [-3.92299333e-04 -2.04904379e-04 -2.69135672e-04 -6.36740071e-05 9.89805676e-07 4.10257404e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-1.97443055e-07 -5.39085375e-06 3.52947296e-05] [ 7.05903995e-08 -1.13893585e-05 -2.54075948e-06] [-1.59142514e-07 5.42041775e-06 3.27603645e-05] [ 2.72504633e-08 1.14250614e-05 1.58981155e-05] [ 1.45298787e-07 2.53109997e-06 -7.98289996e-07] [-2.41191857e-06 -1.44650672e-06 -6.73651948e-07] [ 2.11011208e-06 -1.10394031e-06 -8.82138108e-07] [-2.19357789e-07 5.98331906e-05 -1.81876833e-05] [-5.13815489e-05 -2.96150945e-05 -1.79231759e-05] [ 5.18928290e-05 -3.01636976e-05 -1.83216325e-05] [-5.76681876e-08 1.57655463e-05 9.85558303e-06] [ 2.84751063e-06 1.23675353e-05 1.20439828e-05] [-2.73670408e-06 1.22369688e-05 1.19545835e-05] [-1.75739103e-07 -3.11836507e-05 -1.77632786e-05] [ 1.02868553e-05 -4.45857380e-06 -1.99163311e-05] [-9.96516526e-06 -4.84715536e-06 -2.00002218e-05] [ 2.03094487e-08 1.71067126e-05 -6.45077476e-05] [-2.72369779e-08 -3.96256662e-05 -6.83691931e-05] [ 2.11925554e-08 -1.71056506e-05 6.42548625e-05] [-2.85837750e-08 3.96168178e-05 6.76425705e-05] [-1.33661125e-08 2.45548320e-05 1.37985166e-05] [-1.72862842e-08 -4.09117496e-05 1.26294631e-05] [-2.66491503e-08 -2.45437683e-05 -1.28594980e-05] [-4.13893275e-09 4.09274834e-05 -1.33891702e-05]] Final stress: [-5.08231537e-05 -9.49971341e-05 -4.33973295e-05 4.24250966e-05 1.41996444e-11 5.31651342e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.08598403e-06 5.93169867e-06 1.29255150e-04] [ 2.59856598e-06 -6.23454470e-06 -1.90282253e-04] [-2.77076446e-06 -6.14377266e-06 -7.02828912e-05] [-3.24826212e-06 5.78648698e-06 3.63685584e-05] [-4.31353471e-07 7.04110095e-05 2.73585593e-05] [-5.96065294e-05 -3.44903935e-05 2.65219555e-05] [ 6.05625279e-05 -3.55399088e-05 2.72684710e-05] [ 4.26302780e-07 1.91379949e-05 -7.32941575e-06] [-1.69948305e-05 -1.00442012e-05 -7.55854254e-06] [ 1.61053700e-05 -9.03858554e-06 -6.93654039e-06] [-1.28482097e-07 6.71687275e-05 4.37060363e-05] [-8.80895983e-05 -5.02232305e-05 3.54303036e-05] [ 8.84032465e-05 -5.05526833e-05 5.20061950e-05] [-3.46507760e-07 7.25991803e-05 -3.26069661e-05] [-3.14458832e-05 -1.89343302e-05 -2.44793491e-05] [ 3.19915671e-05 -1.96490522e-05 -4.07615232e-05] [ 8.72374727e-06 -1.07861874e-05 6.25008998e-05] [ 8.86710875e-06 1.07478387e-05 5.97964267e-05] [-8.84989789e-06 1.07131310e-05 -6.38898799e-05] [-8.74124366e-06 -1.07384161e-05 -5.67841460e-05] [ 5.92643836e-06 -3.04298652e-05 -5.61388500e-06] [ 5.87448542e-06 3.03647038e-05 -9.69511222e-06] [-5.94595055e-06 3.03718813e-05 6.44926850e-06] [-5.96604072e-06 -3.04274814e-05 9.55868002e-06]] Final stress: [ 7.93586404e-05 1.24234739e-04 6.51556826e-05 -2.19355359e-10 -4.22667572e-05 1.77160426e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-9.21706950e-05 4.60673188e-04 2.69986701e-03] [-8.87597180e-05 -4.61835874e-04 -2.90813362e-04] [ 8.93601233e-05 -4.51390178e-04 3.50880439e-03] [ 8.64445283e-05 4.48641782e-04 9.87258965e-04] [ 3.80226876e-07 -1.59840048e-03 -3.20868358e-04] [ 1.41785223e-03 8.07034730e-04 -3.34937055e-04] [-1.41791779e-03 8.07507985e-04 -3.34041276e-04] [ 4.51000548e-07 5.91007705e-03 -1.65235672e-03] [-5.14585964e-03 -2.96505496e-03 -1.65408533e-03] [ 5.14568833e-03 -2.96443603e-03 -1.65615387e-03] [ 5.52896446e-07 1.00408160e-03 -1.44564081e-04] [-4.98109404e-04 -3.94769277e-04 -9.89586464e-05] [ 4.97108644e-04 -3.93554488e-04 -1.92083939e-04] [-8.38522897e-06 5.93024265e-06 -2.27423486e-04] [-3.58676481e-04 -1.00196473e-04 -2.76211219e-04] [ 3.73779247e-04 -1.18541803e-04 -1.83387013e-04] [ 1.12564703e-04 2.02289298e-04 7.93396413e-04] [ 1.12600698e-04 -2.03275534e-04 8.04108567e-04] [-1.12328548e-04 -2.03987379e-04 -8.10979541e-04] [-1.12432727e-04 2.03040717e-04 -7.89574945e-04] [-1.32086537e-04 -9.28376279e-05 -5.77553757e-04] [-1.32938668e-04 9.58783423e-05 -6.30867801e-04] [ 1.30857069e-04 1.03343584e-04 7.13453569e-04] [ 1.32025747e-04 -1.00218411e-04 6.67971475e-04]] Final stress: [ 9.70616421e-05 9.24937045e-05 3.23908598e-05 -1.80393545e-11 4.65775991e-05 4.08034005e-09] Minimization converged after 18 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[-8.89971282e-04 -1.10871596e-03 8.52454268e-04] [ 8.77415045e-04 1.12097389e-03 -2.14544069e-03] [ 9.03588165e-04 1.10681544e-03 -1.67875718e-03] [-8.78024896e-04 -1.11606456e-03 1.39876974e-03] [ 1.07623036e-05 -5.04729504e-05 9.49562496e-05] [ 4.14903870e-05 1.44209752e-05 9.84482205e-05] [-5.83230901e-05 3.65688302e-05 9.18480374e-05] [ 5.52218240e-06 2.54029966e-04 7.36330292e-05] [-2.42099911e-04 -1.35636888e-04 6.50223486e-05] [ 2.28707230e-04 -1.21407117e-04 7.87401128e-05] [ 8.77441005e-03 2.57234010e-03 6.93079456e-04] [-2.54819942e-03 1.03449549e-02 6.92010072e-04] [-2.51939830e-03 -4.54366876e-03 7.23395572e-04] [-8.77149710e-03 -2.75381825e-03 -3.88615056e-04] [ 2.69575675e-03 -1.02586849e-02 -3.86727126e-04] [ 2.36633193e-03 4.63655081e-03 -3.99779510e-04] [-2.39560122e-04 -1.87674485e-03 -4.03996782e-04] [ 2.42687571e-04 1.87673468e-03 -4.77174730e-04] [ 2.41461098e-04 1.87640228e-03 4.36199086e-04] [-2.40353581e-04 -1.87587138e-03 5.06584429e-04] [ 7.05175237e-04 4.23236602e-04 5.81588894e-04] [-7.02660679e-04 -4.24044137e-04 5.29210590e-04] [-7.07946698e-04 -4.21464410e-04 -5.37591278e-04] [ 7.04727125e-04 4.23565713e-04 -4.97857752e-04]] Final stress: [ 1.55859176e-05 -1.84310814e-04 -1.00416549e-04 -1.01915077e-08 6.83181202e-08 -6.24127734e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 6.63903023e-05 -1.41801278e-03 8.17362398e-04] [-6.63906699e-05 1.41801282e-03 8.17441950e-04] [-6.63899217e-05 1.41801215e-03 -8.17305209e-04] [ 6.63903884e-05 -1.41801217e-03 -8.17361751e-04] [-3.34809519e-10 -5.22975069e-08 -1.93788839e-08] [ 4.48862779e-08 2.61693539e-08 -1.89621511e-08] [-4.42085681e-08 2.56318036e-08 -1.86003408e-08] [ 2.66725962e-10 -1.97088212e-09 -6.65188726e-09] [ 1.82168480e-09 8.29380786e-10 -6.44666787e-09] [-2.50296273e-09 1.56523983e-09 -5.84383849e-09] [-3.10862726e-04 -8.25155489e-04 -2.17174043e-08] [ 1.94928529e-04 4.07624996e-04 -2.16759515e-08] [ 1.24828123e-03 -7.83628121e-04 -2.11224612e-08] [ 3.10862775e-04 8.25189113e-04 2.63061117e-09] [-1.94957842e-04 -4.07641908e-04 3.08589964e-09] [-1.24825198e-03 7.83611441e-04 2.75044438e-09] [ 1.02038194e-04 -3.19681772e-05 2.26323057e-04] [-1.02038198e-04 3.19682088e-05 2.26325071e-04] [-1.02038235e-04 3.19682581e-05 -2.26325035e-04] [ 1.02038270e-04 -3.19682468e-05 -2.26326143e-04] [-8.12683919e-06 4.25720786e-05 -1.17817650e-04] [ 8.12681419e-06 -4.25720768e-05 -1.17815546e-04] [ 8.12683559e-06 -4.25721256e-05 1.17815490e-04] [-8.12686562e-06 4.25721047e-05 1.17815302e-04]] Final stress: [ 8.41322283e-05 1.04852953e-04 4.97914965e-05 4.29609338e-13 -1.42734538e-12 -1.72131610e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 5.18642401e-04 -1.71697709e-03 -1.02555274e-04] [-5.18642314e-04 1.71697688e-03 -1.02354491e-04] [-5.18642096e-04 1.71697719e-03 1.02534845e-04] [ 5.18641297e-04 -1.71697712e-03 1.02350564e-04] [-6.65437743e-10 -2.84508794e-09 -2.56096977e-10] [ 4.37579080e-09 2.39228415e-09 -1.40612327e-09] [-2.77152823e-09 8.79379125e-10 -2.47849491e-10] [ 7.34004914e-11 -3.45209550e-08 8.80521167e-09] [ 2.81305694e-08 1.67662387e-08 8.18741941e-09] [-2.84917840e-08 1.73319974e-08 8.38890383e-09] [ 3.70888283e-04 6.74672087e-05 -3.40615476e-08] [ 5.54340152e-04 -1.01543971e-03 -3.40158167e-08] [-5.09460778e-04 -6.02029855e-04 -3.42301851e-08] [-3.70888502e-04 -6.74408943e-05 3.44942359e-08] [-5.54362925e-04 1.01542670e-03 3.44144685e-08] [ 5.09483962e-04 6.02016609e-04 3.51473849e-08] [-4.68401553e-04 -3.81630658e-04 2.79665020e-04] [ 4.68401452e-04 3.81630632e-04 2.79669828e-04] [ 4.68401380e-04 3.81630566e-04 -2.79665493e-04] [-4.68401417e-04 -3.81630499e-04 -2.79669505e-04] [-7.40853561e-06 -7.54057967e-05 -9.65242376e-04] [ 7.40849237e-06 7.54057831e-05 -9.65238513e-04] [ 7.40859550e-06 7.54058259e-05 9.65241410e-04] [-7.40854576e-06 -7.54057766e-05 9.65238766e-04]] Final stress: [-9.18915208e-05 -1.04269990e-04 -5.26971812e-05 -2.85925183e-12 -8.14596343e-13 2.11237460e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-5.19467214e-04 -1.71940421e-03 -1.02425493e-04] [ 5.19466045e-04 1.71940458e-03 -1.02362619e-04] [ 5.19467434e-04 1.71940434e-03 1.02424943e-04] [-5.19466659e-04 -1.71940554e-03 1.02398657e-04] [-2.59311813e-10 -1.64973723e-08 -9.79911069e-09] [ 1.57742074e-08 8.82727322e-09 -1.10432158e-08] [-1.49211457e-08 8.33612274e-09 -1.03356471e-08] [ 2.18071837e-10 -9.99011651e-08 1.72385597e-08] [ 8.74471875e-08 4.96394307e-08 1.75545406e-08] [-8.77625465e-08 5.04414839e-08 1.78890532e-08] [-3.71788922e-04 6.82392072e-05 -1.58028682e-08] [ 5.09925507e-04 -6.02928253e-04 -1.60855207e-08] [-5.55199846e-04 -1.01717899e-03 -1.49022949e-08] [ 3.71789479e-04 -6.81331958e-05 6.37494293e-10] [-5.10017066e-04 6.02874898e-04 -6.18593507e-11] [ 5.55290830e-04 1.01712651e-03 -9.73670380e-10] [ 4.68918298e-04 -3.82040490e-04 2.80066702e-04] [-4.68918288e-04 3.82040442e-04 2.80069305e-04] [-4.68918294e-04 3.82040373e-04 -2.80070164e-04] [ 4.68918447e-04 -3.82040548e-04 -2.80069491e-04] [ 7.50995870e-06 -7.55858194e-05 -9.66377506e-04] [-7.51011977e-06 7.55858633e-05 -9.66374741e-04] [-7.51016716e-06 7.55859262e-05 9.66372450e-04] [ 7.51008087e-06 -7.55859395e-05 9.66373641e-04]] Final stress: [-9.19283610e-05 -1.04284274e-04 -5.27080490e-05 4.10306874e-12 -4.84375793e-12 -2.11174273e-05] Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.20448261e-05 -5.61414326e-05 1.20758187e-07] [-1.20448672e-05 5.61413199e-05 5.37610375e-07] [-1.20448638e-05 5.61411158e-05 -5.08451720e-07] [ 1.20450354e-05 -5.61413649e-05 -2.26667502e-07] [ 1.88449583e-11 1.20476063e-07 1.95716832e-09] [-1.03759566e-07 -6.01948424e-08 1.87580201e-09] [ 1.03615875e-07 -6.01042203e-08 1.67983294e-09] [-1.56795736e-10 5.60845030e-08 1.71132752e-08] [-4.82654343e-08 -2.78092637e-08 1.73712863e-08] [ 4.85086389e-08 -2.81261190e-08 1.72545558e-08] [-2.56200721e-05 -3.91997180e-06 -8.96601373e-09] [-9.29407221e-06 -1.80542051e-05 -8.77777818e-09] [-3.09967747e-05 -2.48126957e-05 -8.69100715e-09] [ 2.56206344e-05 2.90561912e-06 1.52942196e-08] [ 1.01725687e-05 1.85609396e-05 1.54791634e-08] [ 3.01176003e-05 2.53204653e-05 1.53182442e-08] [-3.11435840e-05 -4.09526937e-06 1.41825108e-05] [ 3.11436113e-05 4.09523893e-06 1.41684477e-05] [ 3.11436510e-05 4.09521943e-06 -1.41665682e-05] [-3.11435988e-05 -4.09526170e-06 -1.41837358e-05] [ 2.09157294e-05 -1.67006755e-06 -4.85488272e-05] [-2.09157628e-05 1.67004826e-06 -4.85552596e-05] [-2.09157574e-05 1.67003982e-06 4.85559952e-05] [ 2.09157347e-05 -1.67006354e-06 4.85472791e-05]] Final stress: [ 7.12213274e-05 7.13320017e-05 1.17679035e-04 3.79371105e-13 -7.23800485e-13 4.62908358e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-0.1189152 -0.07586404 0.13210785] [ 0.11844842 0.077447 0.1284311 ] [ 0.11858374 0.07487537 -0.03376333] [-0.11847478 -0.0747101 -0.08902525] [ 0.00055661 -0.0808921 -0.02200293] [ 0.06427972 0.03872994 -0.01380507] [-0.06447572 0.0395026 -0.0173375 ] [-0.00052941 0.08533507 -0.02639771] [-0.07291113 -0.04174005 -0.01928403] [ 0.07339253 -0.04273507 -0.02394769] [ 0.03226627 0.11607442 -0.00861727] [-0.16271547 0.28683982 -0.00828987] [-0.03882876 -0.23059962 -0.00693996] [-0.03215548 -0.05321939 0.00130291] [ 0.10815051 -0.31911667 0.00172532] [ 0.09326057 0.19976907 0.00114494] [ 0.03750879 0.05690921 0.055388 ] [-0.03768368 -0.05679203 0.05665592] [-0.03752915 -0.0566367 -0.05549137] [ 0.03735951 0.05682746 -0.05514866] [ 0.03524234 -0.05048054 -0.02628202] [-0.03503962 0.05047776 -0.02589733] [-0.0344222 0.05016195 0.0278187 ] [ 0.03463158 -0.05016336 0.02765525]] Final stress: [ 4.64181236e-03 1.61721571e-03 -1.49644406e-03 -3.04896500e-06 -3.40862397e-06 6.00453636e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.33711118e-05 -3.97901154e-05 -3.87808328e-06] [-1.33708107e-05 3.97902294e-05 -1.28312942e-06] [-1.33698026e-05 3.97905318e-05 -2.89650341e-06] [ 1.33699321e-05 -3.97904666e-05 -7.02671250e-07] [-2.02022651e-09 3.48670432e-06 8.89914646e-07] [-3.01743123e-06 -1.74110975e-06 8.89280456e-07] [ 3.02073586e-06 -1.74536096e-06 8.89966384e-07] [ 1.73487682e-09 -3.66807521e-06 1.28822884e-06] [ 3.17440887e-06 1.83197530e-06 1.28754104e-06] [-3.17747537e-06 1.83574629e-06 1.28804045e-06] [-2.11531300e-05 3.78203294e-05 3.35792583e-07] [ 2.41111173e-05 -2.58524846e-05 3.35651476e-07] [-6.07526322e-05 -2.95434882e-05 3.35729564e-07] [ 2.11559235e-05 -4.30682478e-05 4.07672893e-07] [-1.95682380e-05 2.84738133e-05 4.07417501e-07] [ 5.62064220e-05 3.21699700e-05 4.07635605e-07] [-3.15165630e-05 -3.75111862e-06 -1.07559814e-05] [ 3.15167419e-05 3.75112653e-06 -1.08324275e-05] [ 3.15168203e-05 3.75106888e-06 1.08750798e-05] [-3.15166386e-05 -3.75106528e-06 1.07894013e-05] [ 2.09421900e-05 -4.52689983e-06 4.00804776e-05] [-2.09422950e-05 4.52691934e-06 4.00585087e-05] [-2.09418367e-05 4.52693223e-06 -4.00944092e-05] [ 2.09417350e-05 -4.52691447e-06 -4.01231334e-05]] Final stress: [-4.23830805e-05 -4.22747274e-05 -9.65262700e-05 1.30070825e-13 1.84958008e-13 4.64923066e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 6.55751804e-06 -8.17430025e-05 -1.52626003e-05] [-6.55763840e-06 8.17429112e-05 -1.51913056e-05] [-6.55757518e-06 8.17428939e-05 1.53639473e-05] [ 6.55772071e-06 -8.17431302e-05 1.53735068e-05] [-2.04031171e-11 -1.17230785e-07 -3.83396740e-08] [ 1.01829387e-07 5.86976569e-08 -3.84865988e-08] [-1.01847704e-07 5.86959591e-08 -3.85911697e-08] [ 5.30738510e-11 1.19272013e-07 -3.28541825e-08] [-1.02907264e-07 -5.96103590e-08 -3.26671550e-08] [ 1.02860797e-07 -5.95149228e-08 -3.27246289e-08] [ 4.13826622e-05 -6.02575715e-05 -1.72663635e-08] [-2.43147961e-06 -2.91473836e-05 -1.72900521e-08] [ 2.95494619e-05 3.48002525e-06 -1.72218249e-08] [-4.13827035e-05 6.01632046e-05 -6.12060295e-09] [ 2.51349482e-06 2.91946598e-05 -6.13963880e-09] [-2.96314366e-05 -3.43281928e-06 -6.35391633e-09] [ 3.02568145e-05 -4.73926319e-06 1.82983706e-06] [-3.02568249e-05 4.73924005e-06 1.82908492e-06] [-3.02567997e-05 4.73923556e-06 -1.82952912e-06] [ 3.02568100e-05 -4.73927165e-06 -1.83170123e-06] [-2.01366259e-05 1.34286161e-06 5.40662148e-05] [ 2.01366258e-05 -1.34287787e-06 5.40662209e-05] [ 2.01366412e-05 -1.34287772e-06 -5.40642929e-05] [-2.01366333e-05 1.34285605e-06 -5.40653268e-05]] Final stress: [-4.19324554e-05 -4.17933556e-05 -9.73552615e-05 4.20634552e-13 -7.20666124e-13 -4.63588367e-05] Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.93822464e-04 4.65998155e-04 1.16248215e-02] [-7.08438080e-04 -1.17576966e-03 -6.38091883e-03] [ 2.49617286e-04 -4.58532774e-04 1.16025406e-02] [ 6.98290058e-04 1.17246028e-03 -6.99975329e-03] [-2.00395633e-06 7.64578443e-03 2.62415607e-03] [-6.60109052e-03 -3.81083609e-03 2.62747905e-03] [ 6.63578450e-03 -3.83321825e-03 2.61331483e-03] [-7.92230571e-06 1.56291608e-02 -5.05041904e-03] [-1.34998054e-02 -7.78697096e-03 -5.06752332e-03] [ 1.35812526e-02 -7.84319567e-03 -5.06291134e-03] [-4.11344659e-03 6.26103903e-03 3.06771653e-05] [-4.47061635e-03 -6.34971154e-03 1.20430925e-03] [ 8.15689867e-03 -2.82500726e-04 -1.52885240e-03] [ 4.09837760e-03 6.75857640e-03 -8.70380223e-04] [-6.78739484e-03 -1.45756015e-04 -2.04162875e-03] [ 3.12654680e-03 -6.23901260e-03 6.79398612e-04] [ 1.62412179e-04 -4.53688847e-04 5.85775757e-04] [ 8.43982550e-04 3.26238201e-04 6.27116275e-04] [-1.64768850e-04 4.49994246e-04 -8.29517678e-04] [-8.42267602e-04 -3.25733655e-04 -4.71757416e-04] [ 2.07121766e-04 -2.55343055e-04 -1.03393700e-03] [ 4.50466562e-04 -2.95003613e-04 -1.21341898e-03] [-2.49203971e-04 2.53558127e-04 1.29869281e-03] [-4.69969621e-04 2.92463748e-04 1.03273634e-03]] Final stress: [-2.00118898e-05 -2.76755732e-05 -2.43258361e-05 -4.17761650e-05 8.10205475e-05 -8.37528244e-06] Minimization converged after 184 steps. Minimization converged after 177 steps. Minimization converged after 195 steps. Minimization converged after 17 steps. Minimization converged after 12 steps. Minimization converged after 179 steps. Minimization converged after 191 steps. Minimization converged after 174 steps. Minimization converged after 182 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.40748496e-05 7.96748582e-04 -2.46386803e-05] [-2.40748556e-05 -7.96748548e-04 -2.47067999e-05] [-2.40749065e-05 -7.96748604e-04 2.47715807e-05] [ 2.40749158e-05 7.96748558e-04 2.47565779e-05] [ 5.47267652e-11 -5.27212745e-08 -1.47129062e-08] [ 4.55992471e-08 2.62858229e-08 -1.47127455e-08] [-4.57624410e-08 2.64384538e-08 -1.47296207e-08] [-1.18122886e-10 1.02584342e-07 -3.15444866e-08] [-8.86914324e-08 -5.11416876e-08 -3.15691837e-08] [ 8.89584821e-08 -5.14283271e-08 -3.15196867e-08] [-4.66213702e-05 -1.11078119e-04 -2.68802010e-09] [-2.80037161e-04 2.87459000e-04 -2.64317159e-09] [ 1.51977711e-04 2.96103294e-04 -2.62875320e-09] [ 4.66213209e-05 1.11111332e-04 -1.21574796e-08] [ 2.80008447e-04 -2.87475566e-04 -1.21853988e-08] [-1.51948946e-04 -2.96119939e-04 -1.21738371e-08] [-1.07240641e-04 -2.09996449e-05 1.91827022e-04] [ 1.07240642e-04 2.09996469e-05 1.91826924e-04] [ 1.07240621e-04 2.09996440e-05 -1.91828235e-04] [-1.07240631e-04 -2.09996501e-05 -1.91827110e-04] [ 6.50910522e-05 1.50896706e-05 -3.26887451e-05] [-6.50910661e-05 -1.50896713e-05 -3.26896389e-05] [-6.50911442e-05 -1.50896751e-05 3.26901849e-05] [ 6.50911210e-05 1.50896710e-05 3.26901848e-05]] Final stress: [ 1.41457516e-05 1.37831621e-05 -1.08987101e-06 2.29457195e-13 2.54061788e-13 8.00231226e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.82910722e-04 -5.05903985e-04 -7.80882494e-04] [-1.82910720e-04 5.05903948e-04 -7.80908133e-04] [-1.82910773e-04 5.05903991e-04 7.80900921e-04] [ 1.82910768e-04 -5.05903855e-04 7.80909902e-04] [-1.89998039e-11 -8.50511883e-11 -7.50840501e-11] [ 9.67364105e-11 2.93766331e-11 -1.51604840e-11] [-8.11387069e-11 8.22508728e-12 -1.47174495e-11] [ 6.60350015e-11 1.99437942e-08 -5.50116608e-09] [-1.73679680e-08 -1.00425409e-08 -5.49942736e-09] [ 1.72803630e-08 -9.93746641e-09 -5.56237646e-09] [ 1.34666748e-03 -3.11216619e-03 2.48455730e-09] [-2.06864308e-03 -3.41610174e-04 2.48105585e-09] [ 1.10371222e-03 1.80985838e-03 2.41805825e-09] [-1.34666749e-03 3.11216064e-03 -3.82883923e-09] [ 2.06864791e-03 3.41612951e-04 -3.67056931e-09] [-1.10371705e-03 -1.80985562e-03 -3.72974081e-09] [ 1.56357747e-05 -2.92130760e-04 5.82107949e-04] [-1.56357815e-05 2.92130749e-04 5.82107468e-04] [-1.56357737e-05 2.92130756e-04 -5.82107897e-04] [ 1.56357786e-05 -2.92130751e-04 -5.82107582e-04] [ 1.32771401e-04 1.74123224e-04 -4.56303409e-04] [-1.32771388e-04 -1.74123223e-04 -4.56303974e-04] [-1.32771370e-04 -1.74123223e-04 4.56303874e-04] [ 1.32771391e-04 1.74123230e-04 4.56303889e-04]] Final stress: [ 6.60199579e-06 4.30384288e-06 -1.43850543e-05 -5.29246405e-13 -2.24703171e-13 -5.69190821e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.22277521e-10 9.79768464e-06 -4.19433607e-07] [ 1.31544717e-10 -9.79796491e-06 -4.19387914e-07] [-6.09252625e-11 -9.79777435e-06 4.27859409e-07] [-2.61253519e-11 9.79765166e-06 4.25604624e-07] [ 2.75492605e-10 1.49145113e-09 -8.80346129e-10] [-1.27441077e-09 -9.90901576e-10 -8.94519792e-10] [ 7.26700755e-10 -3.50231899e-10 -1.24671601e-09] [-2.71340931e-10 1.13516863e-09 -1.50105750e-09] [-1.01440467e-09 -3.19932747e-10 -1.44681889e-09] [ 1.44104817e-09 -8.64610272e-10 -1.64297670e-09] [ 2.45631293e-11 -1.34221216e-05 -1.11923570e-09] [ 2.28744801e-06 -1.65429358e-05 -1.22054683e-09] [-2.28749070e-06 -1.65428774e-05 -1.26555258e-09] [-4.06965017e-10 1.34252638e-05 -7.95124611e-10] [-2.28861869e-06 1.65419716e-05 -8.01443151e-10] [ 2.28929945e-06 1.65411147e-05 -7.42446064e-10] [ 3.24103244e-11 -2.31388353e-05 -4.07453900e-06] [-2.70723444e-11 2.31388346e-05 -4.07444151e-06] [ 3.16888737e-11 2.31388119e-05 4.07428020e-06] [-3.46866147e-11 -2.31387991e-05 4.07432229e-06] [ 8.83881857e-12 1.39938730e-05 1.47849482e-05] [-3.87774772e-11 -1.39939383e-05 1.47849083e-05] [-4.05036360e-11 -1.39939345e-05 -1.47852434e-05] [ 7.12996329e-12 1.39938744e-05 -1.47853209e-05]] Final stress: [ 1.50404855e-04 9.36856331e-05 8.19037670e-05 -4.33980576e-13 2.68170616e-13 2.40395619e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 4.17574864e-10 5.94998740e-08 1.27978885e-05] [-3.70988265e-10 -5.97315924e-08 1.28223951e-05] [ 4.21034150e-10 -5.90263226e-08 -1.27635111e-05] [ 1.40168460e-10 6.04555641e-08 -1.27837207e-05] [-5.39946747e-10 -1.56542517e-08 -7.59242696e-09] [ 1.27880877e-08 8.12371453e-09 -7.17042445e-09] [-1.18904979e-08 6.98608249e-09 -6.73834660e-09] [ 5.16488539e-10 3.82146346e-08 -1.00304636e-08] [-3.46438991e-08 -1.99369870e-08 -1.09251954e-08] [ 3.29666347e-08 -1.83849307e-08 -9.34372747e-09] [-8.28937141e-10 1.70737935e-05 -6.89396531e-09] [-1.56083523e-05 3.54294517e-05 -7.84843236e-09] [ 1.56096295e-05 3.54277719e-05 -7.62006683e-09] [ 1.53015822e-10 -1.70906346e-05 6.32603274e-11] [ 1.56202273e-05 -3.54208970e-05 9.48967977e-10] [-1.56206008e-05 -3.54204972e-05 6.17930658e-10] [-6.58840205e-11 2.43162919e-05 1.62944492e-05] [ 3.44190787e-11 -2.43162776e-05 1.62948960e-05] [-5.12678233e-11 -2.43162064e-05 -1.62947915e-05] [ 6.49511833e-11 2.43163648e-05 -1.62953702e-05] [-3.29378746e-11 -5.36783485e-06 -2.28920313e-05] [ 1.68293292e-11 5.36795226e-06 -2.28923747e-05] [ 8.41033134e-11 5.36795015e-06 2.28929016e-05] [-8.25567947e-11 -5.36777431e-06 2.28918021e-05]] Final stress: [-1.20773151e-04 -6.49862706e-05 -6.10665395e-05 -4.73024627e-12 -1.47367233e-12 -5.42291336e-13] Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.98143960e-09 2.61491047e-05 2.03610988e-07] [-1.05099344e-09 -2.61492941e-05 3.73084613e-07] [-2.64418932e-10 -2.61483149e-05 -2.58874235e-07] [-2.00651415e-09 2.61505417e-05 -3.92530378e-07] [-4.72999475e-10 4.67674289e-08 8.90551938e-09] [-3.68652209e-08 -2.23137684e-08 7.51050783e-09] [ 3.85772156e-08 -2.38955309e-08 9.43122194e-09] [-1.67321661e-11 -7.79636218e-08 1.86460980e-08] [ 6.72014440e-08 3.88070817e-08 1.81608829e-08] [-6.77389717e-08 3.90833427e-08 1.91213610e-08] [-1.63183062e-09 -4.36767061e-05 -2.68759313e-08] [ 3.75603544e-06 -5.60639832e-05 -2.78464030e-08] [-3.75311493e-06 -5.60675667e-05 -2.71992586e-08] [ 2.70109990e-10 4.36735151e-05 2.56735012e-08] [-3.76194245e-06 5.60655155e-05 2.52604193e-08] [ 3.76147780e-06 5.60660930e-05 2.93772856e-08] [-7.90391641e-11 -9.02939928e-05 1.24066238e-04] [ 1.66730130e-10 9.02936867e-05 1.24069765e-04] [-2.36244080e-10 9.02937157e-05 -1.24066898e-04] [ 4.44468629e-11 -9.02937756e-05 -1.24070288e-04] [-1.54707858e-10 1.44500058e-05 2.76365579e-04] [ 4.97689236e-11 -1.44495697e-05 2.76368507e-04] [-3.62509209e-12 -1.44494924e-05 -2.76368081e-04] [-2.25716112e-10 1.44500322e-05 -2.76370279e-04]] Final stress: [ 3.89031152e-05 3.62571585e-07 -2.30949685e-06 -7.81386415e-12 9.09584332e-12 -8.76273947e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.45473059e-10 -2.93983523e-05 -1.81115488e-05] [ 8.27024606e-10 2.93987505e-05 -1.79109022e-05] [ 2.22608091e-10 2.93997580e-05 1.80616432e-05] [ 2.92756291e-10 -2.93984825e-05 1.79459500e-05] [ 4.50256359e-10 2.81566509e-09 -3.69647873e-09] [-5.61770100e-09 -2.66933069e-09 -1.75733011e-09] [ 4.13256263e-09 -1.28022482e-09 -3.16419693e-09] [-6.02977908e-11 -6.38711966e-08 1.54672938e-08] [ 5.65450610e-08 3.19439989e-08 1.50836591e-08] [-5.64575389e-08 3.18215062e-08 1.50997930e-08] [ 8.74295525e-10 6.17160751e-05 -3.01699085e-08] [-4.23619856e-06 5.75145140e-05 -3.16019013e-08] [ 4.23454537e-06 5.75164623e-05 -3.17811789e-08] [ 1.09598108e-10 -6.17514000e-05 2.59131269e-08] [ 4.26469724e-06 -5.74983130e-05 2.49912260e-08] [-4.26499997e-06 -5.74979944e-05 2.54140081e-08] [ 4.61032601e-11 1.17794712e-04 1.40908931e-04] [ 1.42504897e-11 -1.17794730e-04 1.40911923e-04] [ 2.94503311e-11 -1.17794651e-04 -1.40909126e-04] [-1.73485948e-11 1.17794672e-04 -1.40913396e-04] [ 9.73068848e-11 -1.88000843e-05 3.11815743e-04] [ 7.10377765e-11 1.88001924e-05 3.11819179e-04] [ 3.88338997e-12 1.88001318e-05 -3.11818154e-04] [ 1.47142298e-10 -1.88000216e-05 -3.11820040e-04]] Final stress: [ 8.11807342e-07 4.01330212e-05 -3.80914764e-06 -1.61477729e-12 1.54626426e-12 3.50315862e-13] Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.59286822e-09 3.20291505e-06 -3.17424059e-06] [-6.55624779e-10 -3.20525090e-06 -2.97129190e-06] [ 7.00380147e-09 -3.20792344e-06 2.82868071e-06] [ 6.15355350e-10 3.20046292e-06 1.81044360e-06] [ 7.98805463e-10 1.22924507e-06 3.30447138e-07] [-1.05796961e-06 -6.13629974e-07 3.26545677e-07] [ 1.05713171e-06 -6.12223779e-07 3.26787144e-07] [ 4.05003502e-09 -4.04699383e-07 9.96678813e-08] [ 3.52449206e-07 1.98668702e-07 9.91703829e-08] [-3.63664655e-07 2.09836577e-07 1.09340874e-07] [ 5.30747801e-09 -1.08043132e-05 -6.92687926e-08] [ 2.51772067e-06 -1.81520595e-05 -7.01642072e-08] [-2.52758200e-06 -1.81402561e-05 -6.38046270e-08] [ 3.61141717e-09 1.08333489e-05 1.52862390e-07] [-2.53693470e-06 1.81302580e-05 1.49177433e-07] [ 2.53007712e-06 1.81384241e-05 1.51537085e-07] [-2.01745010e-10 -2.10401045e-05 -6.68119332e-07] [ 5.50513801e-10 2.10398182e-05 -6.52893593e-07] [-2.45361509e-11 2.10396541e-05 6.67583855e-07] [ 6.96205066e-10 -2.10403595e-05 6.54640193e-07] [ 7.62556129e-10 4.79837831e-06 -2.39691495e-05] [ 3.85824413e-10 -4.79920759e-06 -2.39706648e-05] [ 6.39971532e-10 -4.79922762e-06 2.39624077e-05] [ 6.39312603e-10 4.79824556e-06 2.39403052e-05]] Final stress: [ 1.16648731e-04 9.05526329e-05 1.13574035e-04 1.39862823e-11 -1.05246516e-11 7.70823027e-13] Minimization converged after 14 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-3.43453677e-09 1.39831062e-06 1.05820638e-06] [ 1.43010624e-09 -1.39751377e-06 1.41208556e-06] [-4.43220863e-09 -1.40030817e-06 -1.66531271e-06] [ 2.46436482e-11 1.40241430e-06 -1.30989983e-06] [-7.43122024e-11 -4.67375456e-08 -1.15583419e-08] [ 3.12889969e-08 2.10681712e-08 -5.91186619e-09] [-3.19134425e-08 2.13461408e-08 -7.01138395e-09] [-5.95685317e-09 -1.94583621e-07 9.56405622e-08] [ 1.85433098e-07 1.06423082e-07 1.04759802e-07] [-1.71916682e-07 9.17573743e-08 9.45042088e-08] [-5.38696865e-12 4.62528683e-06 3.53508234e-08] [-8.29799791e-06 1.37618348e-05 3.71669508e-08] [ 8.29847841e-06 1.37615966e-05 3.36333724e-08] [-5.55074986e-10 -5.12117268e-06 3.46005994e-08] [ 8.72047071e-06 -1.35144123e-05 3.63406214e-08] [-8.71898702e-06 -1.35159109e-05 3.54235067e-08] [ 1.30142341e-10 2.45192167e-05 3.40561631e-06] [-7.15385917e-10 -2.45194378e-05 3.39822895e-06] [ 2.95670155e-11 -2.45185236e-05 -3.39230775e-06] [-8.27010183e-10 2.45184171e-05 -3.39974290e-06] [-1.67054648e-10 -4.48391578e-06 6.82814766e-06] [-2.63033159e-11 4.48435692e-06 6.82819753e-06] [-2.71865716e-10 4.48422051e-06 -6.82314023e-06] [-4.63395988e-12 -4.48373304e-06 -6.82301783e-06]] Final stress: [-8.80712149e-05 -6.13626951e-05 -9.21107473e-05 -3.74474685e-12 6.92612097e-12 2.44068474e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 6.42869240e-08 4.80913274e-06 -1.51833579e-05] [-8.53065974e-08 6.20585895e-06 -1.62256521e-05] [-2.50029013e-08 -4.90776377e-06 -2.70207290e-05] [-6.13198523e-09 -6.24927596e-06 3.69403374e-06] [ 4.72441541e-08 -1.32251202e-05 -1.87450813e-06] [ 1.15172640e-05 6.59643451e-06 -1.93779598e-06] [-1.15711954e-05 6.68207599e-06 -1.93765096e-06] [ 1.17822848e-07 -5.73634199e-05 1.52555371e-05] [ 4.99992197e-05 2.86303103e-05 1.53976946e-05] [-5.02319013e-05 2.89009646e-05 1.55484022e-05] [-2.54782652e-07 1.42504811e-05 7.73812613e-08] [-1.53651270e-05 -1.32431782e-05 6.84239100e-06] [ 1.58103386e-05 -1.37944803e-05 6.87175064e-06] [-1.19251831e-08 4.00991581e-05 4.69803594e-06] [-3.16891128e-05 -1.36696563e-05 -2.12785470e-06] [ 3.17001586e-05 -1.36895433e-05 -2.08746055e-06] [ 6.21159232e-09 3.17875032e-05 2.89394841e-05] [ 1.47747928e-08 3.46189476e-06 2.97854550e-05] [ 3.44811768e-09 -3.18019524e-05 -2.95356155e-05] [ 1.66200768e-08 -3.50080406e-06 -2.86920541e-05] [-2.63711676e-08 2.54208460e-05 1.69259847e-06] [-1.92942275e-09 -8.07118781e-06 2.66367148e-06] [ 6.89909038e-10 -2.54049064e-05 -3.10259423e-06] [-2.92928795e-08 8.07662840e-06 -1.74116242e-06]] Final stress: [ 8.20597558e-05 5.58515363e-05 4.50756191e-05 -2.64754412e-05 2.86795450e-11 -1.09113982e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-5.71463563e-08 -2.57743381e-05 2.59147918e-07] [ 5.49027898e-08 4.03670800e-06 2.58753829e-06] [-1.82708905e-07 2.57470538e-05 2.25815556e-05] [ 1.42605952e-07 -3.95611493e-06 -4.60101508e-05] [ 4.01849204e-08 3.66276533e-05 1.04170595e-05] [-3.17641606e-05 -1.83843402e-05 1.05325778e-05] [ 3.16014677e-05 -1.82437736e-05 1.03549456e-05] [-1.77662225e-07 -2.50426340e-06 -2.26881527e-06] [ 2.64125637e-06 1.52246756e-06 -1.99840600e-06] [-2.23404919e-06 1.08252857e-06 -2.31251266e-06] [-1.18236752e-07 1.16884430e-05 1.13282930e-05] [-8.83419671e-06 -5.61402837e-06 2.21909672e-05] [ 9.05053459e-06 -5.87640599e-06 2.20494912e-05] [ 1.90655477e-07 1.65767088e-05 -1.20693140e-05] [-1.62600991e-05 -8.67908994e-06 -2.27807231e-05] [ 1.59246922e-05 -8.26455826e-06 -2.28810906e-05] [ 1.13486203e-08 -2.16281463e-06 5.53830616e-05] [-2.61509880e-08 -4.01189469e-05 5.03342472e-05] [ 6.77735745e-09 2.16081915e-06 -5.60218264e-05] [-2.48725748e-08 4.00884445e-05 -5.01746556e-05] [-1.80134370e-08 5.83739965e-06 -9.09111609e-06] [ 2.61651190e-08 -3.92628761e-05 -5.65410723e-06] [ 1.59011739e-08 -5.81409304e-06 8.52645206e-06] [-9.19549759e-09 3.92874171e-05 4.71738083e-06]] Final stress: [ 8.18696316e-05 5.68049558e-05 4.40454099e-05 2.73425507e-05 1.09011110e-10 -1.39825237e-10] Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 20 steps. Minimization converged after 18 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 8.11632688e-05 -7.08488982e-05 -3.72900617e-04] [-1.02577081e-04 5.71845851e-05 3.56185250e-05] [-6.56995694e-05 7.38822215e-05 8.25279893e-05] [ 8.50969800e-05 -6.39247217e-05 -1.59032588e-04] [ 1.11161329e-05 3.31969673e-05 4.84111902e-06] [-1.91342612e-05 -2.24925989e-05 -4.85194720e-06] [ 1.05495235e-05 -4.85361948e-06 1.09041632e-06] [-1.33972972e-05 -3.57880252e-04 9.38259461e-05] [ 3.24340710e-04 1.90537919e-04 9.49160555e-05] [-3.11386986e-04 1.67469895e-04 9.46428001e-05] [-6.69372096e-04 8.08557292e-05 -2.71221493e-05] [ 3.07660514e-04 -6.05416592e-04 -6.33672640e-05] [ 5.07568265e-04 6.87290650e-04 -1.99916581e-05] [ 6.67286190e-04 2.62500107e-04 7.59853734e-05] [-6.03874208e-04 4.35155511e-04 8.39080724e-05] [-2.09550892e-04 -8.61077324e-04 8.31427874e-05] [ 2.14308270e-05 1.91593105e-05 2.35110909e-05] [-2.45412222e-05 -2.19245265e-05 3.79542988e-05] [-2.08296024e-05 -2.07812395e-05 -2.73271627e-05] [ 2.22924633e-05 2.06509972e-05 -2.82917408e-05] [-9.60442582e-05 7.44169008e-05 -1.96160574e-05] [ 9.49032982e-05 -7.50018866e-05 -1.10154951e-05] [ 9.87247181e-05 -7.34669545e-05 1.11101348e-05] [-9.57254176e-05 7.53678197e-05 1.04420707e-05]] Final stress: [-2.22947759e-04 -1.92511667e-04 -1.61530994e-04 -7.47218841e-08 -1.31761511e-07 -5.25611332e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 3.60621589e-04 -4.91184956e-05 -5.92770523e-04] [-3.28073580e-04 3.60454134e-05 1.66085187e-04] [-3.42820103e-04 4.14774938e-05 3.76161864e-04] [ 3.38344582e-04 -2.37217711e-05 -4.19202433e-05] [-2.06775269e-05 -4.31361638e-04 -1.07685530e-04] [ 3.45031104e-04 2.28221039e-04 -9.37973232e-05] [-3.17858610e-04 1.88541361e-04 -9.14396466e-05] [ 3.02745974e-05 -4.51166574e-04 9.06485611e-05] [ 3.63195987e-04 1.94142495e-04 7.96545941e-05] [-4.20856083e-04 2.62080598e-04 1.19718522e-04] [ 1.28049185e-03 1.57460630e-04 -8.31254155e-05] [-8.43886480e-04 6.78304936e-04 -7.85709027e-05] [-2.46250918e-04 -5.95864049e-04 -1.11174289e-04] [-1.27308341e-03 3.73315167e-04 1.10439237e-04] [ 3.70050212e-04 -9.53522215e-04 1.24073479e-04] [ 7.04213844e-04 3.38444333e-04 1.31867250e-04] [ 3.10821156e-05 7.26019849e-05 7.09840084e-06] [-2.66220797e-05 -7.28101788e-05 2.88548286e-05] [-3.40509248e-05 -6.88158662e-05 -1.18756039e-05] [ 3.34586602e-05 7.23997781e-05 -1.80668895e-05] [ 5.60242766e-05 1.00727029e-04 -9.88713748e-05] [-5.48168877e-05 -1.00490423e-04 -7.44118281e-05] [-5.80675345e-05 -9.95503685e-05 8.09193653e-05] [ 5.42753153e-05 1.02659323e-04 8.81882803e-05]] Final stress: [-2.16758676e-04 -1.89571697e-04 -1.54498982e-04 -1.04861118e-07 1.36385389e-07 5.25736049e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-4.78496287e-04 -8.08883998e-04 1.34360045e-05] [ 4.78496227e-04 8.08883529e-04 1.45894356e-05] [ 4.78495852e-04 8.08883215e-04 -1.43047508e-05] [-4.78496042e-04 -8.08883911e-04 -1.38620848e-05] [ 2.93069856e-10 -3.44456928e-07 -1.27160728e-07] [ 2.99380177e-07 1.72134745e-07 -1.27487828e-07] [-3.00188110e-07 1.72944548e-07 -1.27568119e-07] [-5.37985547e-10 -4.29680002e-07 1.57869975e-07] [ 3.74282145e-07 2.15800052e-07 1.59136992e-07] [-3.73532163e-07 2.14706575e-07 1.58015225e-07] [-3.75191693e-04 2.04222769e-04 -5.62127062e-08] [ 3.46149578e-04 -2.46173649e-04 -5.58984584e-08] [-3.73510039e-04 -6.59744145e-04 -5.59937068e-08] [ 3.75192075e-04 -2.05069339e-04 7.13026143e-08] [-3.45415816e-04 2.46596838e-04 7.14130889e-08] [ 3.72776051e-04 6.60167809e-04 7.13789598e-08] [-5.24982101e-05 -9.12835681e-06 5.07509880e-05] [ 5.24981596e-05 9.12824727e-06 5.07462511e-05] [ 5.24983188e-05 9.12822862e-06 -5.07370102e-05] [-5.24982758e-05 -9.12841405e-06 -5.07581194e-05] [ 5.44804102e-06 -7.75904109e-05 1.45572548e-05] [-5.44788062e-06 7.75903009e-05 1.45682426e-05] [-5.44782390e-06 7.75902605e-05 -1.45620220e-05] [ 5.44806880e-06 -7.75904230e-05 -1.45629847e-05]] Final stress: [-5.27288313e-05 -2.95824205e-05 -3.03677351e-05 1.76763624e-12 -2.55260053e-12 1.62751627e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 3.40076069e-04 -3.13726442e-04 2.37586607e-03] [-3.25029741e-04 2.03393697e-04 -5.06808184e-03] [-3.40681537e-04 9.21853416e-05 -5.60393188e-03] [ 3.55043225e-04 -2.53502179e-04 3.01679218e-03] [ 9.19441368e-05 -3.14991189e-04 2.26145388e-04] [ 2.44301263e-04 7.13322287e-05 2.35639475e-04] [-4.11131911e-04 2.73633479e-04 1.40979408e-04] [-1.21145167e-04 1.35643878e-03 1.37406969e-04] [-5.32416464e-04 -4.39808639e-04 4.45329522e-04] [ 7.22150990e-04 -6.90077195e-04 3.63630755e-04] [ 1.68047952e-03 -4.57468848e-04 1.96244433e-03] [-7.47359705e-04 1.70464674e-03 1.98386045e-03] [-5.91433217e-04 -1.04452024e-03 2.02608232e-03] [-1.65078598e-03 2.52776221e-04 -8.99507357e-04] [ 1.07367824e-03 -1.59330460e-03 -9.33811548e-04] [ 2.06696583e-04 1.22298856e-03 -8.84189227e-04] [ 6.65283640e-05 -1.76321625e-04 1.29744163e-04] [-7.96203136e-05 1.50851293e-04 -4.95765593e-05] [-5.10222968e-05 1.74928380e-04 -3.35803589e-05] [ 5.29648834e-05 -1.98917398e-04 1.67039948e-04] [-1.99351775e-05 1.39508707e-04 1.57823186e-04] [ 1.87977151e-05 -1.51966200e-04 -1.33241837e-06] [ 3.88461457e-05 -1.45189328e-04 1.25751159e-05] [-2.09456303e-05 1.37110460e-04 9.26519098e-05]] Final stress: [-2.11184072e-04 -3.29992250e-04 -2.53770564e-04 -1.00291712e-07 -4.96216739e-07 6.92102462e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.12415621e-10 -6.50761107e-06 -7.42538787e-09] [ 6.20060629e-11 6.50722767e-06 1.49874788e-09] [-1.14305875e-10 6.50727940e-06 9.97432047e-09] [-1.90659238e-10 -6.50747073e-06 2.70752368e-09] [-5.27744371e-11 1.52553264e-09 -3.50031948e-10] [-1.36773487e-09 -7.21282957e-10 -3.63365060e-10] [ 1.52360041e-09 -8.75548523e-10 -2.05672257e-10] [-1.93116848e-10 -1.94638661e-09 -1.72900694e-10] [ 1.89485672e-09 1.17825560e-09 -8.87769858e-11] [-1.72137404e-09 8.58553506e-10 -3.25019699e-11] [ 4.14797641e-11 1.15740287e-05 -2.15353516e-09] [-4.62068267e-06 1.78365883e-05 -2.15939244e-09] [ 4.62064068e-06 1.78366572e-05 -2.37566731e-09] [ 1.54161683e-10 -1.15735592e-05 6.06028880e-10] [ 4.62246294e-06 -1.78366602e-05 4.10493870e-10] [-4.62276512e-06 -1.78362960e-05 9.33038681e-10] [ 2.78124745e-12 2.49489211e-05 -2.28966531e-06] [-3.81389365e-12 -2.49489251e-05 -2.28949061e-06] [-2.90192315e-11 -2.49489141e-05 2.28951113e-06] [-3.18502447e-11 2.49489264e-05 2.28931799e-06] [ 1.96505590e-11 -1.37670893e-05 1.54788340e-05] [ 2.07415889e-11 1.37669802e-05 1.54789729e-05] [ 2.19862076e-11 1.37669727e-05 -1.54790729e-05] [-4.86533036e-12 -1.37670753e-05 -1.54792101e-05]] Final stress: [ 9.37054076e-05 1.50491000e-04 8.17977684e-05 -5.39481432e-13 1.94750355e-12 1.38539747e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.12710563e-10 1.07527751e-05 1.22248253e-05] [ 1.13159840e-09 -1.07528451e-05 1.22369688e-05] [-5.68364036e-10 -1.07532556e-05 -1.22075778e-05] [ 6.66117550e-10 1.07528160e-05 -1.22259141e-05] [ 6.26862421e-10 -6.78862577e-09 -3.51797419e-09] [ 6.89311282e-09 2.80564520e-09 -3.32364078e-09] [-8.79275525e-09 4.62811778e-09 -5.12495010e-09] [ 5.00118333e-12 -4.61550109e-09 -3.04498649e-10] [ 4.52177573e-09 2.54962573e-09 3.37849082e-10] [-4.32278541e-09 2.44127868e-09 1.31787359e-11] [ 2.22953322e-10 -6.67769745e-06 -5.55052288e-09] [ 5.03066882e-06 -2.51298268e-05 -4.30461947e-09] [-5.03111203e-06 -2.51293299e-05 -5.71266563e-09] [ 3.41877915e-10 6.71932700e-06 1.76352782e-10] [-5.06902497e-06 2.51081394e-05 4.50484805e-10] [ 5.06828677e-06 2.51089706e-05 2.89206338e-10] [ 1.26941790e-10 -2.24499004e-05 9.32305350e-06] [-9.74481607e-12 2.24498124e-05 9.32423390e-06] [ 7.43907158e-11 2.24497447e-05 -9.32431883e-06] [-5.78869175e-11 -2.24498648e-05 -9.32384776e-06] [ 3.14419601e-11 9.20806500e-06 -1.63359839e-05] [ 9.39009617e-11 -9.20800155e-06 -1.63356777e-05] [ 2.61628822e-11 -9.20801652e-06 1.63355068e-05] [ 5.80996362e-11 9.20806742e-06 1.63353037e-05]] Final stress: [-6.47908133e-05 -1.21122949e-04 -6.08763783e-05 1.06715791e-12 3.29217479e-12 1.95576994e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-9.40871464e-09 -3.90556960e-05 -1.84762913e-04] [-1.62124284e-08 3.90667690e-05 -1.93943704e-04] [-1.36805350e-08 3.90824872e-05 1.98771045e-04] [-2.09752178e-08 -3.90800979e-05 1.85903605e-04] [-2.72536113e-08 4.80937688e-06 1.61718924e-06] [-4.08958744e-06 -2.36224622e-06 1.56974096e-06] [ 4.15248945e-06 -2.42992967e-06 1.61802978e-06] [-2.84910016e-08 9.05416898e-06 -2.99209070e-06] [-7.87697902e-06 -4.50841993e-06 -2.99972167e-06] [ 7.93384084e-06 -4.57412151e-06 -3.03690690e-06] [-2.77236062e-09 -5.42165236e-05 -6.12836066e-07] [ 1.00145427e-04 7.21325158e-05 -6.13557039e-07] [-1.00136056e-04 7.21239041e-05 -6.12752028e-07] [-3.45943163e-09 6.20643813e-05 5.32636678e-08] [-1.06964483e-04 -7.60522259e-05 3.93615794e-08] [ 1.06975071e-04 -7.60621589e-05 4.99988680e-08] [-3.14187346e-09 5.76030774e-05 -1.99314109e-05] [-2.84597246e-09 -5.76020949e-05 -1.97685329e-05] [-3.53312357e-09 -5.76073308e-05 1.97771920e-05] [-3.25040331e-09 5.76073085e-05 1.98551036e-05] [-8.38650149e-10 -5.67144149e-06 -5.40188360e-05] [-1.36227515e-09 5.67513409e-06 -5.41175751e-05] [-1.05899688e-09 5.67626893e-06 5.41586224e-05] [-1.43898710e-09 -5.67310541e-06 5.39976850e-05]] Final stress: [9.32315000e-05 1.10960150e-04 1.15878018e-04 3.08907723e-11 2.59318621e-11 2.50204890e-13] Minimization converged after 18 steps. Minimization converged after 13 steps. Minimization converged after 30 steps. Minimization converged after 20 steps. Minimization converged after 19 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.51969264e-08 -1.14704890e-06 -5.31195732e-06] [ 1.06355369e-08 1.11221383e-05 1.02903866e-05] [-9.52962224e-09 1.00761534e-06 2.70441771e-05] [ 1.03556771e-07 -1.09956658e-05 1.97878591e-06] [ 1.29155688e-07 -9.37718097e-06 -3.15155610e-06] [ 8.10540027e-06 4.52407778e-06 -3.01237984e-06] [-8.39250796e-06 4.83938608e-06 -3.22489982e-06] [ 3.78441374e-08 1.24444721e-05 -4.55493087e-06] [-1.06953569e-05 -6.22051404e-06 -4.46790059e-06] [ 1.06381738e-05 -6.14241566e-06 -4.44741868e-06] [-1.30280461e-07 2.16822581e-05 1.35248463e-05] [ 3.26021894e-06 9.16555753e-06 3.09656694e-06] [-3.04359606e-06 8.88870285e-06 3.12094425e-06] [-5.06056758e-08 -1.49065788e-05 -1.72199822e-05] [-9.11223965e-06 -1.23876088e-05 -6.51757428e-06] [ 9.18490729e-06 -1.24857417e-05 -6.63293031e-06] [ 1.45870210e-08 4.52907285e-05 -5.77697202e-05] [-2.89127666e-10 -1.59609093e-05 -5.98929423e-05] [ 1.94391273e-08 -4.53005266e-05 5.74321194e-05] [ 6.14134071e-09 1.59458007e-05 5.97611662e-05] [-1.50570144e-08 3.48591270e-05 5.99840973e-07] [-2.51263161e-09 -2.11847402e-05 3.75020154e-06] [-3.67165214e-09 -3.48593982e-05 -6.27787909e-07] [-9.21628995e-09 2.11984646e-05 -3.76705475e-06]] Final stress: [-2.81589075e-05 -5.32068625e-05 -2.22380217e-05 -2.70430303e-05 -3.68627976e-10 -3.55724314e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-1.72316064e-07 -1.55770285e-05 -6.75901149e-05] [ 1.43882521e-07 -2.37558129e-05 1.25787911e-04] [-1.35535996e-07 1.55679626e-05 3.89189074e-05] [ 2.19377971e-07 2.31496382e-05 -9.85502789e-05] [-1.47222005e-08 -1.19808413e-05 -4.34059139e-06] [ 1.07744134e-05 6.12354924e-06 -4.65365863e-06] [-1.09171276e-05 6.18643261e-06 -4.89593866e-06] [-2.59456704e-07 -7.18805238e-06 3.93270948e-06] [ 7.10114508e-06 3.97473248e-06 4.27714884e-06] [-6.53213809e-06 3.34770055e-06 3.85360234e-06] [ 1.07025736e-07 -4.98018525e-05 -8.45797878e-05] [-1.53294551e-05 7.24143006e-05 -6.59057408e-05] [ 1.51419186e-05 7.26455029e-05 -6.60660125e-05] [ 1.64845345e-07 1.37417833e-05 8.58387322e-05] [ 4.71720666e-05 -5.45155401e-05 6.68716051e-05] [-4.74622392e-05 -5.41576925e-05 6.65894732e-05] [ 3.81327245e-09 6.97100890e-05 -1.05418709e-04] [-4.25634967e-08 -1.37819524e-04 -9.17200918e-05] [ 8.22209467e-09 -6.97568473e-05 1.06065645e-04] [-3.71254062e-08 1.37787338e-04 9.12843741e-05] [ 5.97250216e-09 3.10747720e-05 -8.05561045e-05] [ 2.48485614e-08 -9.09896562e-05 -8.59928277e-05] [ 1.46193494e-08 -3.11057857e-05 8.06978771e-05] [ 2.05287405e-08 9.09248317e-05 8.61518707e-05]] Final stress: [-3.76959361e-05 -5.06007103e-05 -1.94417914e-05 2.89768143e-05 -3.20854098e-10 -2.69722726e-11] Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 22 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-5.15805379e-04 -3.52848971e-04 4.88158985e-04] [ 5.16353543e-04 3.52057323e-04 -6.78931209e-04] [ 5.15377802e-04 3.55428721e-04 -4.87679897e-04] [-5.17107771e-04 -3.52163720e-04 7.02210047e-04] [ 2.22344888e-06 -2.12649742e-05 1.11372069e-06] [ 2.18787246e-05 9.08410865e-06 2.40790732e-07] [-2.56950490e-05 1.38706146e-05 -1.11313013e-06] [-1.82310228e-06 1.90809778e-04 -3.28659003e-05] [-1.73062281e-04 -9.51797041e-05 -3.60923755e-05] [ 1.76847486e-04 -9.94846760e-05 -3.52817737e-05] [-2.42400146e-03 6.22118917e-04 2.23977156e-04] [ 2.40489136e-03 -1.70932156e-03 2.22529999e-04] [ 1.85704985e-03 3.57306844e-03 2.23425078e-04] [ 2.42437661e-03 -8.65447775e-04 -2.03716696e-04] [-2.19434381e-03 1.83055555e-03 -2.02563030e-04] [-2.06630230e-03 -3.45214831e-03 -2.00130531e-04] [-2.24193363e-04 -7.23965346e-04 -1.68063159e-04] [ 2.25711452e-04 7.23328467e-04 -2.00059075e-04] [ 2.24628226e-04 7.23508646e-04 1.74855984e-04] [-2.25644021e-04 -7.22770422e-04 1.98923886e-04] [-1.53528027e-04 4.81715158e-04 -3.42118491e-04] [ 1.54110202e-04 -4.82030207e-04 -3.62634309e-04] [ 1.52029656e-04 -4.80881172e-04 3.50898861e-04] [-1.53971787e-04 4.81961116e-04 3.64915072e-04]] Final stress: [-9.96229968e-05 -3.17567437e-04 -2.11709194e-04 -4.96757306e-08 8.68213381e-08 -5.08459665e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 6.64981278e-04 -1.70617190e-03 2.26826080e-03] [-6.54087950e-04 1.72467063e-03 -1.48601379e-03] [-6.55091705e-04 1.70685210e-03 -2.36323000e-03] [ 6.38722887e-04 -1.69301028e-03 1.48917158e-03] [-1.41700415e-05 -4.17235348e-04 -8.70923690e-05] [ 3.04672317e-04 2.10684727e-04 -5.80581654e-05] [-2.73334870e-04 1.76483664e-04 -3.94509372e-05] [ 1.11972470e-05 -2.30239337e-04 5.86272299e-05] [ 1.86728424e-04 1.01986081e-04 4.81701230e-05] [-2.09348178e-04 1.28087704e-04 6.62468530e-05] [ 4.90939845e-03 2.75079483e-03 6.94905122e-04] [-4.59400149e-03 8.41810947e-03 7.09259142e-04] [-4.26030891e-03 -4.11698721e-03 6.95578398e-04] [-4.90785163e-03 -2.29865532e-03 -6.73042507e-04] [ 4.17903742e-03 -8.64974311e-03 -6.80840062e-04] [ 4.67682183e-03 3.88658876e-03 -6.61021437e-04] [ 5.36177582e-04 -1.70460573e-03 -4.97720440e-04] [-5.38171846e-04 1.70656472e-03 -5.81537632e-04] [-5.38791983e-04 1.71128324e-03 4.94721463e-04] [ 5.41385057e-04 -1.70659752e-03 5.91159175e-04] [-9.65613036e-04 6.05877161e-04 6.30735018e-04] [ 9.60049470e-04 -6.07547836e-04 5.86320181e-04] [ 9.64718224e-04 -6.05158822e-04 -6.37068428e-04] [-9.63118546e-04 6.07969325e-04 -5.68079320e-04]] Final stress: [ 3.83042227e-05 -3.29739940e-04 -1.55317793e-04 -8.04623154e-08 -1.59261527e-07 -2.06139082e-05] Minimization converged after 158 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-8.13084932e-04 -2.89717022e-03 -1.21649285e-04] [ 8.13081847e-04 2.89717050e-03 -1.21160951e-04] [ 8.13082420e-04 2.89717093e-03 1.21938632e-04] [-8.13085164e-04 -2.89717082e-03 1.21407532e-04] [-2.27474219e-09 -3.65993352e-07 -1.03058653e-07] [ 3.22278134e-07 1.85964143e-07 -1.05200256e-07] [-3.17010240e-07 1.80105260e-07 -1.02915798e-07] [-1.46701826e-09 -1.08853209e-07 -4.35661540e-09] [ 9.51113390e-08 5.60042800e-08 -3.31706929e-09] [-9.14906623e-08 5.25864041e-08 -6.01593023e-09] [-6.90623786e-04 -3.33259229e-05 -1.23468318e-07] [ 7.95753010e-04 -9.07675896e-04 -1.24409196e-07] [-9.67822047e-04 -1.63373247e-03 -1.23826812e-07] [ 6.90624341e-04 3.39787324e-05 5.90444920e-08] [-7.96315845e-04 9.07349706e-04 5.84551720e-08] [ 9.68386872e-04 1.63340566e-03 5.86731638e-08] [ 6.41228827e-04 -5.57229355e-04 5.25396595e-04] [-6.41228683e-04 5.57228936e-04 5.25418501e-04] [-6.41228986e-04 5.57228706e-04 -5.25411712e-04] [ 6.41228666e-04 -5.57228912e-04 -5.25413291e-04] [ 6.16579161e-05 -1.36566591e-04 -1.48974304e-03] [-6.16585444e-05 1.36566783e-04 -1.48972541e-03] [-6.16586450e-05 1.36566734e-04 1.48973115e-03] [ 6.16575867e-05 -1.36566318e-04 1.48973167e-03]] Final stress: [-8.90494375e-05 -7.10007629e-05 -3.95530332e-05 -6.76655500e-12 1.07035346e-11 2.79959857e-06] Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 8.74500615e-06 -1.73871495e-05 8.50086536e-07] [-8.74503135e-06 1.73871291e-05 6.26756858e-07] [-8.74479115e-06 1.73873628e-05 -5.67792304e-07] [ 8.74505074e-06 -1.73874258e-05 -7.98917767e-07] [-1.22707290e-10 3.63962760e-08 2.04683853e-08] [-3.10261836e-08 -1.79689092e-08 2.01884541e-08] [ 3.11985557e-08 -1.82106099e-08 2.02242385e-08] [ 1.86992540e-10 1.19066823e-07 -4.64779172e-08] [-1.03515846e-07 -5.98332385e-08 -4.68398443e-08] [ 1.03089927e-07 -5.93801275e-08 -4.64747597e-08] [-1.89564998e-05 -1.36981167e-05 -5.72768706e-09] [-2.19885049e-05 2.57749787e-06 -5.92068857e-09] [-5.41838017e-06 -3.68072438e-06 -5.77299692e-09] [ 1.89564677e-05 1.40272746e-05 -4.30452331e-09] [ 2.17035500e-05 -2.74204213e-06 -4.38219870e-09] [ 5.70328682e-06 3.51615620e-06 -4.54622313e-09] [-2.37250049e-05 -3.09735768e-06 2.85015752e-06] [ 2.37249938e-05 3.09734875e-06 2.85534163e-06] [ 2.37249680e-05 3.09731552e-06 -2.85583866e-06] [-2.37249534e-05 -3.09732829e-06 -2.85083388e-06] [ 1.34264343e-05 1.00337374e-06 -2.19077070e-05] [-1.34264236e-05 -1.00337839e-06 -2.19078893e-05] [-1.34264192e-05 -1.00336664e-06 2.19082580e-05] [ 1.34264402e-05 1.00336069e-06 2.19079441e-05]] Final stress: [ 5.00419580e-05 4.99182899e-05 7.76696008e-05 1.26468407e-13 -8.37949022e-13 2.81915912e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-0.00463152 -0.00519567 -0.02309259] [ 0.0034356 0.00576377 0.02740689] [ 0.0032356 0.00522121 0.03285165] [-0.00408131 -0.00608356 -0.05457045] [-0.00033557 -0.00375067 0.0023508 ] [ 0.00401862 0.00241419 0.00180647] [-0.00324018 0.00157244 0.00238021] [-0.00094557 0.00948756 -0.00182013] [-0.00702302 -0.00355631 -0.00084488] [ 0.00908872 -0.00586342 -0.0024701 ] [ 0.05100858 0.04188799 -0.01043212] [-0.04716294 0.07104773 -0.01005712] [-0.01244651 -0.04548723 -0.0099159 ] [-0.05194088 -0.00592423 0.01514419] [ 0.01725465 -0.08790966 0.01469435] [ 0.04432739 0.02645073 0.014195 ] [ 0.00631475 0.00281144 -0.00479072] [-0.0064248 -0.0028746 -0.0025964 ] [-0.00636575 -0.00283605 0.0047246 ] [ 0.00620786 0.00284637 0.00363993] [ 0.00098659 0.00568785 -0.00745317] [-0.00109801 -0.00570033 -0.00625585] [-0.00110035 -0.00571891 0.00802409] [ 0.00091806 0.00570935 0.00708127]] Final stress: [ 9.89868417e-04 -7.41339331e-04 3.00694851e-04 -1.16805021e-06 8.69704633e-07 6.50360223e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-5.64865628e-06 -5.86653607e-05 3.57733322e-06] [ 5.64853452e-06 5.86654207e-05 3.60320211e-06] [ 5.64856538e-06 5.86653476e-05 -3.56318133e-06] [-5.64855968e-06 -5.86654185e-05 -3.55150976e-06] [-7.86741363e-11 -4.04700726e-08 -1.25476182e-08] [ 3.49082172e-08 2.02853299e-08 -1.25303317e-08] [-3.47784040e-08 2.01240561e-08 -1.24613806e-08] [-3.80719943e-11 1.13009411e-08 -3.49884632e-09] [-9.50802381e-09 -5.56680857e-09 -3.41459361e-09] [ 9.60457991e-09 -5.66290326e-09 -3.49445735e-09] [-2.35994986e-05 1.46626196e-05 -4.23729453e-09] [ 1.45510908e-05 -2.37491853e-05 -4.24192987e-09] [-4.02474298e-05 -3.63160764e-05 -4.21170510e-09] [ 2.35994456e-05 -1.46691809e-05 -1.59946115e-09] [-1.45453054e-05 2.37525195e-05 -1.65908024e-09] [ 4.02417433e-05 3.63193126e-05 -1.77068956e-09] [-2.80267759e-05 -3.53322811e-06 -3.61673204e-06] [ 2.80267553e-05 3.53323308e-06 -3.61666996e-06] [ 2.80267573e-05 3.53324356e-06 3.61650970e-06] [-2.80267657e-05 -3.53325104e-06 3.61624252e-06] [ 1.28526239e-05 -3.60308915e-06 1.73669804e-05] [-1.28526317e-05 3.60308864e-06 1.73674241e-05] [-1.28526337e-05 3.60308553e-06 -1.73670687e-05] [ 1.28526311e-05 -3.60309118e-06 -1.73668629e-05]] Final stress: [-2.11458878e-05 -2.09012565e-05 -5.63019283e-05 4.08636103e-13 -3.99041159e-13 2.83349144e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.23080879e-05 -4.57659307e-05 -1.30027133e-06] [ 1.23080897e-05 4.57659882e-05 -1.29077729e-06] [ 1.23079983e-05 4.57660272e-05 1.32185459e-06] [-1.23081384e-05 -4.57659719e-05 1.31010209e-06] [-3.01547822e-11 -1.98726469e-08 -5.49548318e-09] [ 1.71425721e-08 9.94466214e-09 -5.46460133e-09] [-1.70732527e-08 9.88044435e-09 -5.42121115e-09] [-7.25571574e-11 2.03093125e-08 -5.61480507e-09] [-1.74934006e-08 -1.00793673e-08 -5.60335811e-09] [ 1.76447572e-08 -1.02777975e-08 -5.75676892e-09] [ 1.97491898e-05 -2.16213581e-05 -3.22951676e-09] [ 1.04082953e-05 -1.38758110e-05 -3.22644523e-09] [ 2.01975964e-05 -8.56597909e-06 -3.31984906e-09] [-1.97492023e-05 2.16241662e-05 5.72905764e-10] [-1.04106995e-05 1.38744292e-05 4.94966929e-10] [-2.01951259e-05 8.56452453e-06 5.57116883e-10] [ 2.29603776e-05 -3.47028925e-06 -1.89184456e-06] [-2.29603827e-05 3.47028906e-06 -1.89155008e-06] [-2.29603802e-05 3.47029269e-06 1.89171599e-06] [ 2.29603619e-05 -3.47029347e-06 1.89152289e-06] [-1.20378562e-05 1.60604702e-07 2.00729778e-05] [ 1.20378538e-05 -1.60598688e-07 2.00731506e-05] [ 1.20378539e-05 -1.60596405e-07 -2.00725939e-05] [-1.20378616e-05 1.60602198e-07 -2.00727798e-05]] Final stress: [-2.09762647e-05 -2.09199942e-05 -5.64329094e-05 2.07726024e-14 4.18642142e-13 -2.81545311e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 164 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-2.12346553e-06 7.27573660e-06 -9.54162963e-06] [-4.14540145e-06 4.30183222e-06 -1.15169139e-05] [ 4.88860981e-06 -3.71189175e-06 -1.42528386e-05] [ 6.06849105e-06 -8.31089053e-06 1.62009224e-05] [ 4.08719710e-06 -4.11064188e-06 6.05461907e-06] [ 5.04895809e-06 -4.73528605e-06 8.25134342e-06] [ 1.93332950e-06 1.90050708e-06 -5.62989452e-06] [-4.70671769e-07 2.16815513e-05 1.19394701e-05] [-1.85160509e-05 -8.60394764e-06 -1.21084314e-06] [ 1.74992011e-05 -3.81341549e-06 4.57982635e-07] [-4.50997852e-07 -1.04582624e-05 2.00266655e-06] [ 3.69936833e-06 6.61918015e-06 -1.17646844e-06] [ 8.20556034e-07 5.78503961e-06 4.63804169e-06] [ 4.16318296e-06 -6.64638215e-06 -3.81161703e-06] [ 6.13539766e-06 -3.02257153e-06 -2.73881023e-06] [-6.06977433e-06 -1.81597357e-06 5.12468045e-06] [-3.55348478e-06 2.15121443e-06 2.60474336e-06] [-2.60775939e-06 2.46541120e-06 1.95639009e-06] [-2.87910391e-06 6.76343868e-06 7.04606673e-06] [ 7.60953914e-07 -1.64285487e-06 -2.03268828e-06] [ 4.76404665e-07 -6.26655925e-07 -1.57919134e-06] [-7.62686797e-06 -3.87437308e-07 -4.08168346e-06] [-6.70618637e-06 1.82895222e-06 -5.81252431e-06] [-4.31885925e-07 -2.88665232e-06 -2.89182358e-06]] Final stress: [ 0.03275643 0.03330983 0.13516161 0.00088763 -0.00049968 -0.00052907] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-2.35856573e-06 4.39577523e-07 -1.56524639e-05] [-8.21528115e-06 -5.54166482e-06 3.35637908e-06] [-3.05686240e-06 -5.07274032e-06 -1.78911966e-05] [ 2.05330743e-06 7.03674972e-06 2.13809050e-05] [-3.20335205e-06 -2.10253194e-06 -4.93103248e-06] [ 1.41717656e-05 2.89457984e-06 -1.53054298e-05] [-3.75903898e-06 4.31883453e-06 -1.51640925e-06] [-1.03444096e-05 -3.86393619e-07 1.07035602e-05] [ 2.95879372e-06 -1.18090635e-05 -3.14012002e-06] [ 1.09660733e-06 -1.04560774e-06 3.89737053e-06] [ 2.53326304e-05 1.31087085e-05 -4.91603931e-06] [-2.10006889e-05 2.10228499e-05 1.09702757e-05] [ 3.62933422e-06 -1.64910703e-05 2.22512552e-06] [ 2.66053643e-05 4.81854424e-06 1.90415153e-06] [-2.73767857e-05 1.39229810e-05 -8.50109503e-07] [-9.91016823e-06 -3.66266257e-05 -9.88996552e-07] [-4.42605526e-06 4.53947075e-06 -2.37512409e-06] [-1.15709284e-05 4.33926210e-06 -5.22720287e-06] [ 9.34657578e-06 6.04879340e-06 9.20258847e-06] [ 8.88342850e-06 3.55938275e-06 -4.57988969e-06] [ 2.89972764e-06 -3.58432070e-06 1.24934733e-05] [ 5.80083610e-06 -4.79700011e-06 -9.63851792e-07] [ 1.29330562e-06 1.57415343e-06 4.28557159e-06] [ 1.15045972e-06 -1.66868977e-07 -2.08153497e-06]] Final stress: [ 0.03275645 0.03330973 0.13516144 -0.00088761 -0.00049984 0.00052909] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.34000184e-05 -1.00236717e-04 -1.65355796e-04] [-1.39764249e-04 8.08314658e-05 2.29718839e-04] [-1.18299971e-05 1.00143517e-04 -7.32335196e-05] [ 1.41443244e-04 -8.08716384e-05 1.98908336e-04] [ 1.20254516e-06 -2.50817836e-04 -8.60548408e-05] [ 2.15966220e-04 1.23986192e-04 -8.50468920e-05] [-2.18438622e-04 1.26802502e-04 -8.72200413e-05] [ 1.03003871e-06 -1.15142121e-04 4.15573944e-05] [ 9.88330668e-05 5.63840943e-05 4.07285191e-05] [-1.01079583e-04 5.88707675e-05 4.25945137e-05] [ 1.32271765e-04 -3.10767279e-04 -5.42329354e-05] [-3.27510306e-05 2.84492018e-04 -4.27287504e-05] [-3.57806243e-04 -9.18673974e-05 -1.07702250e-05] [-1.31075319e-04 1.52577374e-06 3.59156472e-05] [ 2.99372066e-04 -1.31287759e-04 2.44461585e-05] [ 8.85724138e-05 2.47968009e-04 -7.55105421e-06] [-2.40346405e-04 -1.76275745e-04 1.80272846e-04] [ 2.45374533e-04 1.49975708e-05 1.83241117e-04] [ 2.40615907e-04 1.76248028e-04 -1.76603698e-04] [-2.45187422e-04 -1.49843827e-05 -1.89132470e-04] [-1.23387869e-04 2.44437147e-05 -1.95835039e-04] [ 1.41240274e-04 -2.84685187e-05 -1.93155576e-04] [ 1.23535593e-04 -2.44278593e-05 1.93151801e-04] [-1.41190946e-04 2.84536011e-05 1.96385667e-04]] Final stress: [ 1.20812276e-05 1.10589083e-05 3.76720681e-06 2.99937164e-05 3.09254867e-06 -1.69470483e-05] Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-2.08014156e-05 4.45010412e-06 -1.40618231e-05] [ 1.94627146e-06 1.18984174e-05 3.36821333e-06] [-2.12610196e-05 2.16834382e-05 4.20612783e-05] [-4.57642072e-06 -2.55069447e-06 -3.94195140e-05] [-1.29296439e-05 5.74740085e-05 1.03763410e-05] [-4.62244464e-05 -2.21569306e-05 -1.71242817e-05] [ 5.42556970e-05 -7.74349727e-05 7.73639983e-06] [-2.35274654e-05 -2.72108339e-05 2.37303385e-05] [ 2.01288135e-05 1.66752181e-05 -5.12710363e-05] [-5.67100966e-05 -5.85123837e-06 2.38740320e-05] [ 2.30913568e-05 -2.27488245e-05 3.98563484e-06] [-1.58106044e-05 9.41314684e-05 -4.11271612e-05] [-4.75139495e-05 6.65434722e-08 3.87015775e-05] [-2.95749293e-05 1.07608518e-05 3.44195538e-05] [-1.08755706e-05 -5.28301212e-05 -1.48494159e-05] [ 5.09901887e-05 6.32507279e-05 4.52047873e-05] [ 1.50341907e-05 5.65382837e-06 2.58988469e-05] [ 3.20075352e-05 1.17712119e-05 -2.15113337e-06] [ 3.16461219e-05 -5.89870682e-06 -5.23564128e-06] [ 3.31651283e-05 -1.79900237e-05 -1.56830427e-05] [ 3.02740458e-05 -3.48399051e-05 -1.85458363e-05] [-2.22645267e-05 3.43881698e-05 -2.02295174e-05] [ 2.55189005e-05 -5.16223126e-05 2.17916058e-05] [-5.98816106e-06 -1.10694241e-05 -4.14502059e-05]] Final stress: [ 3.35834750e-02 3.24736892e-02 1.35152991e-01 1.06826994e-06 -9.78459565e-04 4.86859200e-05] Minimization converged after 199 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 7.91490518e-05 -1.91621758e-04 -5.69850610e-05] [-2.11655550e-05 -2.12493786e-05 -3.06582075e-05] [-3.45822772e-07 -1.64061071e-04 -2.35554085e-04] [ 7.47891280e-06 1.71301067e-05 -1.48187322e-04] [ 7.10510630e-05 1.31751381e-04 1.79620647e-04] [-1.59947020e-04 -3.31252857e-06 -8.26986800e-05] [ 3.37181231e-05 -1.42299086e-04 2.14647549e-04] [ 7.67699795e-05 2.30920993e-05 -8.95557257e-06] [-3.11921135e-04 3.09683119e-04 1.41921855e-04] [-4.93346554e-05 -1.52517840e-04 -2.99844283e-05] [ 5.03202638e-05 -1.02908168e-05 -2.46688304e-06] [ 5.39915738e-05 -1.48963818e-04 1.80598130e-04] [ 7.68382827e-05 5.87425556e-05 8.44698896e-05] [ 1.18487398e-04 1.11700713e-04 7.82389749e-05] [-3.97337629e-05 -1.11872712e-04 -9.74241612e-05] [ 1.28175736e-04 -2.15353539e-04 5.33316873e-05] [ 9.86978497e-05 -5.57463758e-05 -1.22939912e-04] [-8.66213487e-05 -2.75680874e-04 -2.34595791e-05] [ 7.60857175e-05 1.16854147e-04 1.38128150e-04] [-1.02031828e-05 1.43925789e-04 -1.24460372e-04] [-1.03900370e-04 -7.48889693e-05 -1.04182498e-05] [-6.34961651e-05 7.44703490e-05 -4.33617057e-05] [-1.00480263e-04 2.13014302e-04 -8.47497244e-05] [ 7.63853287e-05 3.67494206e-04 3.13470610e-05]] Final stress: [ 3.48742165e-02 3.40746976e-02 1.38208429e-01 -1.83955053e-06 1.24624533e-03 4.99563680e-05] Minimization converged after 193 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.34111298e-04 5.87705375e-04 -1.08623079e-03] [-1.19332490e-04 -5.83057709e-04 1.49150574e-03] [-1.40689685e-04 -5.88326886e-04 1.31345190e-03] [ 1.28954889e-04 5.83980968e-04 -6.17324217e-04] [-3.73709927e-06 1.36666801e-04 -9.79001064e-05] [-1.18486479e-04 -6.60108360e-05 -9.50491020e-05] [ 1.20345846e-04 -7.12961964e-05 -9.96071979e-05] [ 2.68790823e-06 -7.13168091e-04 7.50399764e-05] [ 6.21290283e-04 3.53906434e-04 7.73831289e-05] [-6.26358023e-04 3.59941033e-04 7.11322269e-05] [-6.23509940e-03 -9.53194731e-04 -5.54779453e-04] [ 2.56577528e-03 -4.32065576e-03 -5.41428001e-04] [ 2.55682956e-03 4.53884157e-03 -5.64737673e-04] [ 6.23480896e-03 9.46435260e-04 2.61029286e-04] [-2.55854861e-03 4.32385586e-03 2.55553324e-04] [-2.56526723e-03 -4.53538624e-03 2.59739560e-04] [-3.93118523e-04 5.70561392e-04 9.94109884e-04] [ 3.90871828e-04 -5.71500624e-04 1.04733388e-03] [ 3.92517547e-04 -5.71139055e-04 -1.02543106e-03] [-3.91100444e-04 5.71525917e-04 -1.07791667e-03] [ 6.38811783e-04 4.25798098e-04 1.25369709e-03] [-6.39254297e-04 -4.25814715e-04 1.29464112e-03] [-6.33028277e-04 -4.25186799e-04 -1.30341878e-03] [ 6.37015383e-04 4.25518925e-04 -1.33079405e-03]] Final stress: [-1.15047000e-04 -1.83775041e-04 -2.23369823e-04 1.29049142e-08 -6.56670553e-08 -2.10204041e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 5.81557930e-04 1.04581174e-03 -1.77789757e-03] [-5.92517778e-04 -1.04348730e-03 6.60554577e-04] [-5.82494713e-04 -1.04521256e-03 1.60916008e-03] [ 5.90513069e-04 1.04179719e-03 -2.62415357e-04] [ 4.48871820e-07 3.68459458e-05 -4.77997806e-05] [-2.49681415e-05 -1.70238058e-05 -5.18787466e-05] [ 2.58088321e-05 -1.70409063e-05 -5.00708899e-05] [ 2.49845425e-06 -6.16524028e-04 1.16657069e-04] [ 5.26741653e-04 3.05869247e-04 1.10993636e-04] [-5.25861223e-04 3.08268266e-04 1.14376014e-04] [ 5.53498141e-03 -2.07780764e-03 -4.48535008e-04] [-1.87264815e-03 2.77102730e-03 -4.52103357e-04] [-3.01556322e-03 -1.43124254e-03 -4.42442342e-04] [-5.53212535e-03 2.14221464e-03 3.30562952e-04] [ 1.81746224e-03 -2.80531718e-03 3.33977989e-04] [ 3.06864716e-03 1.40155497e-03 3.25432525e-04] [-4.26459539e-04 1.38558534e-04 3.21103451e-04] [ 4.29806086e-04 -1.39283440e-04 3.73666935e-04] [ 4.26973709e-04 -1.39419142e-04 -3.35934030e-04] [-4.28778568e-04 1.40477245e-04 -3.85516244e-04] [ 5.34708613e-04 4.75426671e-04 3.14002014e-04] [-5.33840721e-04 -4.75877464e-04 3.53332009e-04] [-5.39646257e-04 -4.75386887e-04 -3.42289820e-04] [ 5.34755634e-04 4.75771150e-04 -3.66936104e-04]] Final stress: [-2.25151140e-04 -2.96524127e-04 -2.42530729e-04 1.03451433e-08 1.05304448e-07 5.92914776e-05] Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 3.16339135e-09 -1.50573097e-05 -6.48057294e-06] [ 1.44104928e-09 1.50609857e-05 -6.96064236e-06] [ 2.76387063e-09 1.50596549e-05 6.93516227e-06] [-1.45271767e-10 -1.50577553e-05 5.51080803e-06] [-6.02488697e-10 5.99128872e-07 2.29290984e-07] [-5.21587040e-07 -2.99658690e-07 2.30995986e-07] [ 5.22106756e-07 -3.00647673e-07 2.30755481e-07] [ 4.19134124e-09 -3.91284280e-07 4.23734711e-08] [ 3.36283847e-07 1.90632019e-07 3.90867211e-08] [-3.46011222e-07 2.01103596e-07 4.65405732e-08] [ 2.83075036e-09 5.88857965e-05 -5.29889298e-08] [-8.60286044e-06 -3.27732883e-05 -5.20276967e-08] [ 8.59747809e-06 -3.27669199e-05 -5.26689124e-08] [ 5.03659003e-10 -5.69846396e-05 1.17333213e-07] [ 6.93262790e-06 3.18154411e-05 1.15580942e-07] [-6.93410859e-06 3.18168975e-05 1.17097602e-07] [-6.16034446e-11 -1.81438077e-05 2.62161508e-05] [ 5.36715783e-10 1.81437868e-05 2.62565222e-05] [-1.30139233e-10 1.81440046e-05 -2.62440292e-05] [ 4.30962016e-10 -1.81441493e-05 -2.62254084e-05] [ 4.91055863e-10 1.31268733e-05 7.23604101e-05] [ 1.18807764e-10 -1.31258400e-05 7.23758948e-05] [ 1.99196304e-10 -1.31257913e-05 -7.23776233e-05] [ 3.39396622e-10 1.31267870e-05 -7.23780415e-05]] Final stress: [ 3.30456905e-05 -7.67851390e-07 7.62444316e-06 4.36121368e-12 5.68423407e-12 1.29157534e-12] Minimization converged after 28 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 18 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 2.46864814e-05 -1.89672285e-05 -2.63792761e-03] [ 3.89456884e-05 2.93852486e-05 2.65344474e-03] [ 8.53122334e-05 9.55562902e-05 2.69663667e-03] [-9.54129790e-05 -9.98627489e-05 -2.64042402e-03] [-3.85334290e-05 -4.51249704e-04 -5.50369986e-05] [ 4.68165323e-04 2.95380968e-04 -1.52953215e-04] [-3.72285007e-04 1.95857078e-04 -6.73632191e-05] [ 6.11237545e-05 -3.98871997e-04 1.12661161e-04] [ 2.68087683e-04 1.02631045e-04 2.06169528e-06] [-4.20959396e-04 2.61575026e-04 1.27136871e-04] [-1.17573125e-03 6.31983033e-04 -9.34474778e-04] [ 1.56798923e-05 -9.90659126e-04 -9.80295601e-04] [ 8.19376600e-04 5.24975744e-04 -9.81781590e-04] [ 1.21076584e-03 3.93883984e-04 9.86822886e-04] [-9.71589521e-04 4.30416414e-04 8.98214994e-04] [ 6.49083291e-05 -1.00298083e-03 9.67348767e-04] [-2.62714820e-06 6.07578508e-05 -3.64638212e-06] [-2.22607921e-06 -6.77660867e-05 1.38617111e-04] [-1.01894348e-05 -6.55958667e-05 -1.36992403e-05] [ 1.58448694e-05 6.69867031e-05 -1.23356067e-04] [-6.99504210e-05 8.37877858e-05 3.29001952e-05] [ 7.24978794e-05 -8.34023375e-05 1.31343915e-04] [ 7.87190156e-05 -7.65696030e-05 -4.70274861e-05] [-6.46089235e-05 8.27483577e-05 -1.09202794e-04]] Final stress: [-2.40467139e-04 -2.00223052e-04 -1.73384258e-04 -1.34454953e-07 -1.19669118e-07 -6.64041479e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-4.27385935e-04 2.01980739e-04 -4.00330127e-03] [ 2.65293498e-04 -3.48083826e-05 4.64888272e-03] [ 2.73523308e-04 -1.11072625e-04 8.29987943e-03] [-3.28091410e-04 1.05413745e-04 -8.06712645e-03] [-3.25847014e-05 2.64018801e-03 7.75046428e-04] [-2.42326662e-03 -1.31826995e-03 8.28647297e-04] [ 2.49189897e-03 -1.39415208e-03 9.09994477e-04] [-8.73080518e-05 2.44704712e-03 -7.95292556e-04] [-2.12716439e-03 -1.14695436e-03 -7.91604234e-04] [ 2.32084567e-03 -1.35920264e-03 -9.69921292e-04] [ 2.05916066e-03 1.57346819e-03 -2.42196626e-03] [-1.54962061e-03 1.77811934e-03 -2.37370169e-03] [ 4.42654062e-05 -2.27540544e-03 -2.35186039e-03] [-2.14753787e-03 6.48775090e-04 2.18910484e-03] [-3.81840205e-04 -2.81005905e-03 2.13374940e-03] [ 2.07098817e-03 1.03503334e-03 2.06222364e-03] [-4.90899714e-05 3.30239574e-05 -1.08662481e-04] [ 5.49349321e-05 -2.82302257e-05 2.17949002e-04] [ 4.93627952e-05 -2.35426585e-05 5.48061643e-05] [-7.44715910e-05 3.53275082e-05 -2.11648403e-04] [ 4.72310134e-05 1.34405886e-04 -2.50591377e-05] [-3.55046940e-05 -1.39836352e-04 1.12191254e-04] [-4.71484034e-05 -1.33781342e-04 6.43820828e-05] [ 3.35100276e-05 1.42532167e-04 -1.76712559e-04]] Final stress: [-2.27540822e-04 -2.11445234e-04 -1.71375721e-04 9.11447138e-08 4.74901887e-07 7.19030170e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.78175762e-05 -4.11275844e-05 9.36149089e-05] [ 8.26921842e-05 -2.44409837e-05 2.73759096e-05] [-3.69162851e-05 -2.74488306e-04 5.62380815e-05] [ 3.32917367e-04 -2.46250318e-04 -9.74837896e-05] [-4.32386096e-04 9.39446194e-05 3.36112942e-04] [-3.11612078e-04 1.04941848e-04 -2.23255551e-05] [ 7.28117779e-05 2.61801934e-04 -2.00875289e-04] [-3.37018452e-05 -2.55744668e-04 1.94375656e-04] [ 2.64072926e-04 -2.97525236e-04 1.15816592e-04] [ 1.82483981e-04 -1.97413378e-04 -2.23997965e-04] [ 6.23105887e-05 -1.30418242e-05 4.05611760e-05] [-1.54955758e-04 4.69994218e-05 -2.83110696e-04] [ 2.12560094e-04 1.72312870e-04 2.50559575e-04] [ 1.87861547e-05 1.34117850e-04 9.63804495e-05] [-1.06751081e-04 1.79110213e-04 3.21660442e-05] [ 2.17025373e-04 1.26872892e-04 -1.30093011e-04] [-1.04398854e-05 -1.72748824e-04 2.28823771e-04] [ 2.55289896e-04 2.11163015e-04 -1.05528441e-04] [ 8.37193162e-05 2.11641241e-04 -7.91970909e-05] [-2.54268666e-06 7.33428694e-05 -1.15240459e-04] [-1.47051250e-04 2.25517044e-04 -4.26320535e-04] [-1.87781035e-04 -9.63001919e-05 -6.00125618e-05] [-1.69954700e-04 9.89604297e-05 1.80968907e-05] [-2.38394536e-04 -3.21644933e-04 2.54063397e-04]] Final stress: [ 0.1077833 0.11549396 0.10691203 -0.00652072 0.00096404 -0.00043996] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-4.98850705e-04 -1.90959631e-04 1.48978716e-03] [ 4.46357914e-04 1.67470897e-04 -1.75892540e-03] [ 5.10602509e-04 1.76775760e-04 -7.05355855e-04] [-4.96341069e-04 -1.69614189e-04 -3.22079374e-04] [-6.38215421e-06 -8.96753197e-04 1.19295604e-04] [ 7.31690892e-04 4.58841278e-04 1.12269594e-04] [-6.91467585e-04 4.28024898e-04 1.53084220e-04] [-9.23336180e-05 1.10978486e-03 -2.19409470e-04] [-7.80814625e-04 -4.43425417e-04 -1.41952500e-04] [ 9.16610843e-04 -6.28459012e-04 -2.02767959e-04] [ 6.23000244e-04 1.50477509e-03 5.50324432e-04] [-1.88819329e-03 6.88695889e-04 4.78313026e-04] [ 1.97425876e-04 -2.33949109e-03 5.63607223e-04] [-5.65644081e-04 7.92637219e-04 -1.20896953e-04] [-2.10041971e-04 -1.89869868e-03 -1.27352462e-04] [ 1.82065532e-03 1.24167996e-03 -1.15054962e-04] [ 7.87973714e-05 -1.03821239e-04 1.24392144e-04] [-9.43519328e-05 1.00122635e-04 1.10952499e-04] [-8.20872039e-05 1.10760728e-04 -1.07824301e-04] [ 7.59685613e-05 -1.10314867e-04 -3.59257673e-05] [-1.37419848e-04 6.38586975e-05 1.51429071e-04] [ 1.38334720e-04 -6.31833165e-05 1.43729136e-04] [ 1.53307540e-04 -5.62721253e-05 -9.30020166e-05] [-1.48823714e-04 5.75648588e-05 -4.66370872e-05]] Final stress: [-1.91213353e-04 -3.04937527e-04 -2.51832355e-04 -1.49409649e-07 -3.12649734e-07 7.04131195e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.21955887e-09 -7.74745935e-06 -1.11363825e-05] [ 1.14246875e-08 7.74968455e-06 -1.23632687e-05] [-6.35125449e-09 7.75062547e-06 1.31812565e-05] [ 1.05825759e-08 -7.74147680e-06 1.07315555e-05] [ 1.43839285e-08 1.27677726e-06 3.74344210e-07] [-1.13777013e-06 -6.60857804e-07 3.97182594e-07] [ 1.10341118e-06 -6.24340338e-07 3.69920719e-07] [-1.91027815e-09 1.27794560e-06 -4.32727317e-07] [-1.10715664e-06 -6.37625705e-07 -4.32615852e-07] [ 1.11246230e-06 -6.42844311e-07 -4.37500792e-07] [-2.65473238e-09 8.00463658e-05 -1.44349209e-07] [-4.58147792e-05 -2.70624206e-05 -1.41604782e-07] [ 4.58185268e-05 -2.70676784e-05 -1.52852974e-07] [ 7.43561751e-09 -7.89614268e-05 6.99635153e-08] [ 4.48642216e-05 2.65123536e-05 7.40574167e-08] [-4.48789604e-05 2.65295484e-05 7.30602317e-08] [ 2.13454193e-09 6.94756096e-05 4.00163113e-05] [-3.19199722e-10 -6.94754401e-05 4.00477673e-05] [ 1.61598551e-09 -6.94747177e-05 -4.00406533e-05] [-6.31920294e-10 6.94754249e-05 -4.00372536e-05] [-2.71511535e-10 -1.25971005e-05 -2.35763436e-05] [ 1.48583575e-09 1.25979786e-05 -2.35935619e-05] [ 7.13341823e-10 1.25978380e-05 2.35957984e-05] [ 1.87339255e-10 -1.25967634e-05 2.35578969e-05]] Final stress: [ 6.75884913e-05 9.65746320e-05 5.32445270e-05 -1.80749669e-11 2.71041875e-11 -4.11622223e-12] Minimization converged after 28 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-5.91550479e-04 -1.11391428e-03 1.60067696e-05] [ 5.91548012e-04 1.11391589e-03 1.58978946e-05] [ 5.91541432e-04 1.11392198e-03 -1.02076988e-05] [-5.91545469e-04 -1.11391949e-03 -1.24874422e-05] [-2.80088322e-09 -3.10186598e-06 -9.28079947e-07] [ 2.68847262e-06 1.55384947e-06 -9.30846481e-07] [-2.69253859e-06 1.55333635e-06 -9.21548766e-07] [-1.62599083e-09 4.11278040e-06 -1.31941599e-06] [-3.56636956e-06 -2.05596777e-06 -1.32246390e-06] [ 3.58386328e-06 -2.06728370e-06 -1.31841544e-06] [-7.33750217e-04 1.22384891e-04 -6.00335346e-07] [ 1.34555968e-04 -7.36199928e-05 -6.01891408e-07] [-4.59701140e-04 -7.25497925e-04 -6.04427307e-07] [ 7.33746599e-04 -1.20903055e-04 -2.11311493e-07] [-1.35841221e-04 7.28818877e-05 -2.12630605e-07] [ 4.60991254e-04 7.24753159e-04 -2.13314064e-07] [-5.49390051e-04 1.11757658e-04 3.83622159e-04] [ 5.49389185e-04 -1.11757152e-04 3.83670221e-04] [ 5.49387547e-04 -1.11756796e-04 -3.83689903e-04] [-5.49387786e-04 1.11756983e-04 -3.83692052e-04] [-5.92244088e-05 -8.01147237e-05 -1.21067918e-04] [ 5.92227187e-05 8.01155984e-05 -1.21055265e-04] [ 5.92157206e-05 8.01192501e-05 1.21105594e-04] [-5.92166660e-05 -8.01187367e-05 1.21082322e-04]] Final stress: [ 3.76060771e-05 1.64218688e-05 -6.35529126e-06 8.71814809e-12 -2.02044038e-11 -2.57771466e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 2.69803462e-03 -6.02392481e-03 6.35617820e-02] [-1.61365987e-03 5.90908278e-03 -3.69609079e-02] [-2.72731792e-03 6.46845712e-03 -5.81562422e-02] [ 2.22190009e-03 -6.03976516e-03 6.28136105e-02] [ 6.90927316e-04 -6.51381159e-02 -1.31128797e-02] [ 5.64152326e-02 3.20412730e-02 -1.23085067e-02] [-5.74738861e-02 3.34506445e-02 -1.35055246e-02] [ 5.97700871e-05 3.40391062e-02 -4.95712226e-03] [-3.07582982e-02 -1.74242402e-02 -5.25022805e-03] [ 3.04601810e-02 -1.71778575e-02 -5.33677876e-03] [ 1.98992246e-02 1.95865219e-02 2.31691599e-02] [-3.36925235e-02 4.40600789e-02 2.33787996e-02] [-1.94640922e-02 -2.49883127e-02 2.20984425e-02] [-1.97217996e-02 -6.96979265e-03 -1.73101186e-02] [ 2.22927687e-02 -5.06464885e-02 -1.73942356e-02] [ 3.06233551e-02 1.88252014e-02 -1.67152700e-02] [ 2.02872345e-03 -9.65226201e-03 -5.89283846e-03] [-1.98478278e-03 9.61320748e-03 -8.37089423e-03] [-1.75407690e-03 9.64408779e-03 6.50961006e-03] [ 1.92396483e-03 -9.51543584e-03 9.47877258e-03] [-2.50968887e-03 5.10312096e-03 -9.50241331e-04] [ 2.35011053e-03 -5.25781879e-03 -2.07593521e-03] [ 2.80044299e-03 -4.94101385e-03 2.61743857e-03] [-2.76450988e-03 5.03424601e-03 4.67010807e-03]] Final stress: [ 5.81281297e-04 -1.17433788e-03 6.22299799e-05 -2.44017763e-06 -5.13425077e-06 -4.29402781e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 4.36995541e-03 3.78709934e-03 -4.73767940e-02] [-3.86723297e-03 -3.36232663e-03 3.74369941e-02] [-4.66139996e-03 -3.69073757e-03 2.45449515e-02] [ 4.04144463e-03 3.27548426e-03 -5.23966834e-02] [ 6.91542871e-05 1.59808696e-02 4.18009128e-03] [-1.39526110e-02 -8.04704767e-03 4.24281999e-03] [ 1.38199939e-02 -7.89034086e-03 4.06000318e-03] [-1.75609742e-04 -2.49650483e-02 6.56902758e-03] [ 2.18812180e-02 1.26433246e-02 6.69582186e-03] [-2.15567944e-02 1.22506789e-02 6.35047470e-03] [-8.71646859e-03 1.16839311e-02 -1.36831892e-02] [ 1.66917088e-02 -2.40707664e-02 -1.29899955e-02] [-5.11802288e-03 4.01697814e-02 -1.36974621e-02] [ 8.66625552e-03 -1.04664017e-02 1.59494554e-02] [-1.75914721e-02 2.35304512e-02 1.52398676e-02] [ 6.10561231e-03 -4.08308443e-02 1.56538527e-02] [ 2.02020897e-03 -4.29978197e-03 -9.47287552e-03] [-2.08552224e-03 4.27758352e-03 -7.46768332e-03] [-1.98536146e-03 4.30944311e-03 9.52894804e-03] [ 2.02174762e-03 -4.30001159e-03 7.56858146e-03] [ 2.92529325e-03 2.37604742e-03 -6.75781003e-03] [-2.95866586e-03 -2.38678205e-03 -5.30934443e-03] [-2.83779981e-03 -2.31682929e-03 6.15464521e-03] [ 2.89436822e-03 2.34222378e-03 4.97630295e-03]] Final stress: [-4.74667231e-05 -6.71731549e-04 3.74929806e-04 -9.75888731e-08 -3.87292271e-07 -3.82031637e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 2.32185847e-04 -1.15988546e-03 -4.63572864e-02] [-6.12249455e-04 1.60207017e-03 4.51017501e-02] [ 4.85758408e-05 1.16318922e-03 3.30387203e-02] [ 5.56639546e-04 -1.40235038e-03 -3.52354708e-02] [ 1.14193206e-04 -1.92453437e-02 -5.56244072e-03] [ 1.66059263e-02 9.46262092e-03 -5.38894081e-03] [-1.67058298e-02 9.65556017e-03 -5.56853255e-03] [ 4.53183800e-04 -4.24417117e-02 9.14427438e-03] [ 3.66220475e-02 2.07335266e-02 8.88178819e-03] [-3.72720873e-02 2.16368303e-02 9.60846933e-03] [ 2.07768309e-02 2.81327008e-02 -1.56604813e-02] [-2.96458790e-02 5.94327586e-03 -1.55628317e-02] [ 1.43363343e-02 -2.35314529e-02 -1.50414421e-02] [-2.04667761e-02 2.21856657e-02 1.35695174e-02] [-1.37369895e-02 -3.14736401e-02 1.35467632e-02] [ 2.87834977e-02 -1.35823824e-03 1.31460813e-02] [-7.42060540e-04 -3.85336566e-03 -3.72258301e-03] [ 1.00154623e-03 3.74664528e-03 -9.32567522e-04] [ 8.69670797e-04 3.80338407e-03 2.58924845e-03] [-7.97299138e-04 -3.82677313e-03 1.53965198e-03] [ 1.89928644e-03 3.02219535e-04 -1.48478089e-03] [-2.01892209e-03 -2.34779673e-04 6.97517277e-04] [-2.19860022e-03 -1.43847355e-04 -8.18895952e-05] [ 1.89677490e-03 3.03699614e-04 -2.64534379e-04]] Final stress: [-1.65294189e-04 -5.40877911e-04 -1.68932715e-04 -1.11629514e-06 2.27056222e-06 1.95331108e-04] Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.07519734e-05 -5.74570443e-05 1.17210464e-05] [-1.07520006e-05 5.74565597e-05 1.13257023e-05] [-1.07527379e-05 5.74566522e-05 -9.25858947e-06] [ 1.07522901e-05 -5.74574229e-05 -9.85724022e-06] [ 6.81049987e-10 -2.05793655e-06 -5.47916041e-07] [ 1.78285417e-06 1.02851267e-06 -5.48544667e-07] [-1.78411752e-06 1.03002911e-06 -5.48726437e-07] [-8.98097267e-10 1.11379942e-06 -4.23387462e-07] [-9.61533456e-07 -5.55501536e-07 -4.22214041e-07] [ 9.63442354e-07 -5.57644535e-07 -4.23137227e-07] [-1.82943808e-05 -1.88674253e-05 -1.87189439e-07] [ 2.26135229e-05 -1.05170875e-05 -1.87242143e-07] [-4.02142390e-05 -2.15195945e-05 -1.87450695e-07] [ 1.82935856e-05 2.11720448e-05 -1.50623924e-07] [-2.46077647e-05 9.36571505e-06 -1.51170592e-07] [ 4.22094528e-05 2.03667811e-05 -1.50929943e-07] [-2.30556573e-05 -3.01756221e-06 1.84928754e-06] [ 2.30555598e-05 3.01742451e-06 1.88710022e-06] [ 2.30556137e-05 3.01743675e-06 -1.90236267e-06] [-2.30557426e-05 -3.01760000e-06 -1.86922218e-06] [ 6.67291869e-06 -2.44775498e-06 -2.41286182e-05] [-6.67286501e-06 2.44769224e-06 -2.41028652e-05] [-6.67305516e-06 2.44769993e-06 2.41209881e-05] [ 6.67309774e-06 -2.44777325e-06 2.41433060e-05]] Final stress: [3.64088619e-05 3.66645853e-05 5.28840243e-05 8.28657362e-13 1.08931121e-12 1.68518583e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 2.70540698e-05 -9.33508441e-05 1.04926782e-04] [-2.70536771e-05 9.33508760e-05 1.08070768e-04] [-2.70525771e-05 9.33505346e-05 -1.07117687e-04] [ 2.70534096e-05 -9.33507829e-05 -1.04328824e-04] [-1.05077740e-10 -2.17346860e-06 -7.40512754e-07] [ 1.88270882e-06 1.08694222e-06 -7.40425750e-07] [-1.88221012e-06 1.08651283e-06 -7.40491765e-07] [ 1.21015523e-09 -8.62409672e-07 3.48763791e-07] [ 7.46127193e-07 4.29879797e-07 3.47994619e-07] [-7.48665618e-07 4.32767786e-07 3.50042509e-07] [ 4.10451447e-05 3.77949020e-05 -9.53904831e-08] [-9.63459272e-05 -8.49707698e-05 -9.54381530e-08] [ 1.29440947e-04 -5.66334265e-05 -9.48434595e-08] [-4.10451646e-05 -4.08164936e-05 -3.16662827e-08] [ 9.89627155e-05 8.64814467e-05 -3.17442959e-08] [-1.32058216e-04 5.81444268e-05 -3.16060078e-08] [ 1.56385956e-05 -3.87484833e-06 -1.20085233e-05] [-1.56384616e-05 3.87482520e-06 -1.20511282e-05] [-1.56385838e-05 3.87483283e-06 1.20491342e-05] [ 1.56387450e-05 -3.87488012e-06 1.19983686e-05] [-6.33328880e-06 1.25675044e-06 -9.21450290e-06] [ 6.33324228e-06 -1.25675724e-06 -9.18939006e-06] [ 6.33335225e-06 -1.25677052e-06 9.20060406e-06] [-6.33339116e-06 1.25675415e-06 9.21971727e-06]] Final stress: [ 3.64433929e-05 3.67561224e-05 5.22286695e-05 7.62736531e-13 -9.90012746e-13 -1.66698238e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 5.54145409e-06 -1.17375677e-04 2.71606197e-06] [-5.54162450e-06 1.17376164e-04 2.71375795e-06] [-5.54125634e-06 1.17376192e-04 -2.79138498e-06] [ 5.54104459e-06 -1.17375623e-04 -2.83844206e-06] [-5.81495605e-10 1.57935876e-07 4.22822353e-08] [-1.37311887e-07 -7.85339324e-08 4.24693561e-08] [ 1.38520553e-07 -7.99195122e-08 4.32694946e-08] [ 2.21874852e-10 -2.12899625e-08 9.73132175e-09] [ 1.71340333e-08 1.01285290e-08 8.99498431e-09] [-1.76153106e-08 1.06786893e-08 9.33737682e-09] [-1.29831761e-05 8.03842824e-06 3.57336666e-09] [ 2.53613264e-05 -5.57268034e-05 3.49371811e-09] [-5.12301753e-05 -5.57990896e-05 3.57347397e-09] [ 1.29831133e-05 -8.15720314e-06 1.15516844e-08] [-2.52592027e-05 5.57861003e-05 1.15277796e-08] [ 5.11282530e-05 5.58582110e-05 1.16514336e-08] [-2.64266779e-05 -5.16508137e-06 9.55380294e-06] [ 2.64266457e-05 5.16516360e-06 9.55246646e-06] [ 2.64265502e-05 5.16517050e-06 -9.55132481e-06] [-2.64265847e-05 -5.16508094e-06 -9.55369465e-06] [ 8.12844218e-06 -5.90549674e-06 -9.01293318e-07] [-8.12847069e-06 5.90556015e-06 -9.03204756e-07] [-8.12844353e-06 5.90556053e-06 9.02231531e-07] [ 8.12841459e-06 -5.90549419e-06 8.99567496e-07]] Final stress: [-7.90191730e-06 -7.28722416e-06 -3.15192822e-05 -2.43029494e-13 9.38302101e-14 1.64221568e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 5.41578808e-05 -1.28488092e-04 1.77048983e-05] [-5.41582861e-05 1.28487871e-04 1.76938980e-05] [-5.41578586e-05 1.28488178e-04 -1.76893526e-05] [ 5.41580769e-05 -1.28487860e-04 -1.77026224e-05] [-2.25009025e-11 7.24318688e-09 2.25682750e-09] [-6.21680631e-09 -3.57984670e-09 2.17439350e-09] [ 6.32705421e-09 -3.66174735e-09 2.29926131e-09] [-2.00923309e-10 1.17719752e-08 -3.71299647e-09] [-1.02119641e-08 -5.71987113e-09 -3.75090026e-09] [ 1.04861592e-08 -6.11450773e-09 -3.84388840e-09] [-3.03441129e-05 8.65238895e-05 -3.67567813e-10] [ 1.37954324e-04 -2.69141889e-05 -8.82900669e-10] [ 2.17272141e-05 -1.54137526e-04 -4.03827731e-10] [ 3.03440334e-05 -8.65215515e-05 -3.26553609e-10] [-1.37956457e-04 2.69131127e-05 6.81533302e-12] [-2.17249049e-05 1.54136196e-04 -1.91451700e-10] [ 4.41710272e-05 -8.88328903e-06 1.85303450e-05] [-4.41710817e-05 8.88327202e-06 1.85303919e-05] [-4.41710445e-05 8.88328790e-06 -1.85304157e-05] [ 4.41710447e-05 -8.88325671e-06 -1.85304147e-05] [-1.40576938e-05 -1.04954689e-05 6.30211194e-06] [ 1.40576752e-05 1.04954688e-05 6.30193310e-06] [ 1.40576929e-05 1.04954792e-05 -6.30190485e-06] [-1.40576906e-05 -1.04954609e-05 -6.30212525e-06]] Final stress: [-7.69715587e-06 -7.03719370e-06 -3.23926711e-05 -1.58077697e-12 -1.77688314e-12 -1.51699665e-05] Minimization converged after 13 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. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-7.49904809e-05 -6.44250441e-05 5.70055115e-04] [ 7.00840719e-05 1.14268490e-04 -4.87646350e-04] [ 7.49210130e-05 6.44088865e-05 -4.88207569e-04] [-7.00883533e-05 -1.14266734e-04 4.84428408e-04] [-4.38610204e-09 1.19679604e-06 3.47190295e-07] [-1.04280044e-06 -5.95008162e-07 3.48072251e-07] [ 1.05333434e-06 -6.06705951e-07 3.55868307e-07] [-2.79911193e-08 6.14869493e-05 -1.93465190e-05] [-5.31380388e-05 -3.06803835e-05 -1.93228536e-05] [ 5.32659405e-05 -3.07842953e-05 -1.93578597e-05] [ 7.54216813e-06 -2.06992939e-06 2.14151070e-04] [ 1.33931487e-04 -1.14191723e-04 2.02302946e-04] [ 1.34519281e-04 3.33407849e-05 1.36429405e-04] [-7.54901915e-06 2.15158703e-05 -2.21261480e-04] [-1.50745138e-04 1.04481886e-04 -2.09401131e-04] [-1.17677278e-04 -4.30749083e-05 -1.43548829e-04] [ 1.69575105e-04 -5.75227703e-06 1.81014523e-04] [-1.60605405e-04 1.48214073e-04 1.55309886e-04] [-1.69579582e-04 5.75229788e-06 -1.81712357e-04] [ 1.60607597e-04 -1.48216146e-04 -1.55407602e-04] [ 1.13817258e-04 1.89881460e-05 -1.60978597e-04] [-1.03761527e-04 -8.27426950e-06 -1.78325622e-04] [-1.13865494e-04 -1.89898091e-05 1.61892865e-04] [ 1.03758237e-04 8.27305354e-06 1.77881418e-04]] Final stress: [ 1.34244659e-05 1.24337341e-05 4.02124353e-06 -2.10275370e-05 2.33770022e-06 8.17865312e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.25531598e-05 2.52923922e-06 -2.90397429e-05] [ 5.37834840e-05 -2.08313606e-05 -3.39268540e-05] [-9.24618319e-06 1.46077417e-05 -3.77433292e-05] [ 4.00124680e-05 -1.59187604e-05 1.93423853e-05] [ 1.82377438e-05 -3.23534147e-05 -3.50409822e-05] [-6.75846805e-06 -3.83323954e-05 3.12127885e-05] [-3.49548850e-07 -3.93877081e-05 1.08286922e-05] [ 4.42817605e-05 5.14801961e-05 5.64739994e-06] [ 8.23723327e-06 5.01690091e-06 6.28268651e-05] [ 3.30077126e-05 -1.29271645e-05 -1.11441994e-05] [ 4.13080733e-05 9.31649706e-07 4.42959939e-06] [-9.14974118e-06 4.52617720e-05 -1.15473370e-05] [-6.69650603e-05 -5.17131467e-06 2.23602055e-05] [ 4.63184267e-05 -6.43392553e-06 1.57548704e-05] [-6.07288199e-05 -8.72317844e-06 -1.29898164e-05] [-1.50570240e-05 1.68049870e-05 2.29732265e-05] [ 8.15208170e-06 -2.64339440e-06 5.35540743e-06] [-3.83839517e-06 3.62452773e-05 1.48071554e-05] [-2.30505024e-05 2.09326588e-05 -3.00600154e-05] [-1.03280382e-05 7.86249334e-06 -4.69467131e-05] [-1.90576156e-05 -1.59330525e-05 7.91839425e-06] [ 1.96589349e-05 1.91375591e-05 1.76186448e-05] [-7.40114654e-05 2.01850342e-06 6.59170812e-07] [-1.90389678e-06 -2.41733092e-05 6.70418398e-06]] Final stress: [ 0.03275508 0.03330891 0.13515958 0.00087971 -0.00049954 -0.00051059] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-3.57157246e-05 -1.02802246e-04 -8.19034695e-05] [-9.68865630e-06 7.27039163e-05 4.89938407e-04] [ 3.54649021e-05 1.02723127e-04 6.01092278e-04] [ 9.77039620e-06 -7.27692011e-05 -2.07622565e-04] [ 2.54280008e-08 -1.89569454e-04 -6.19206530e-05] [ 1.64188839e-04 9.47462079e-05 -6.20088541e-05] [-1.64347623e-04 9.48670084e-05 -6.20225461e-05] [-1.33059297e-07 4.51789907e-04 -1.35502333e-04] [-3.90865975e-04 -2.25637075e-04 -1.35271198e-04] [ 3.91367278e-04 -2.26083188e-04 -1.35379143e-04] [ 2.83126923e-06 -2.97219376e-05 -1.70737631e-04] [ 7.46436730e-05 -6.88398303e-05 -1.99831057e-04] [ 6.10699436e-05 -1.31481748e-06 -1.15439315e-04] [-2.77928978e-06 -2.45804515e-05 1.01251520e-04] [-2.75291805e-05 9.59954643e-05 1.30394122e-04] [-1.08192492e-04 2.85379560e-05 4.59003842e-05] [ 9.81174567e-05 -5.49157319e-05 6.12483345e-05] [-1.08805312e-04 -1.80881071e-05 7.75169355e-05] [-9.81323329e-05 5.49008814e-05 -6.40715075e-05] [ 1.08835095e-04 1.80777819e-05 -8.20134931e-05] [ 6.17955603e-05 4.16092672e-06 -4.93005718e-05] [-7.17915831e-05 -1.00440084e-06 -4.16408156e-05] [-6.19896228e-05 -4.17236806e-06 5.60494814e-05] [ 7.18610106e-05 9.95631619e-07 4.12736913e-05]] Final stress: [ 1.44120140e-05 1.49889636e-05 7.53015293e-06 1.84222641e-05 -1.46531616e-06 1.29739064e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 4.62391691e-05 -8.36644973e-05 -5.22498330e-04] [-2.80648392e-06 6.27385478e-05 5.89707694e-04] [-4.61926758e-05 8.36733066e-05 5.90997951e-04] [ 2.81843789e-06 -6.27358975e-05 -5.67061441e-04] [ 1.29096204e-08 -9.11371076e-06 -3.81240750e-06] [ 7.86868133e-06 4.53942184e-06 -3.79923630e-06] [-7.89113459e-06 4.56921257e-06 -3.81999321e-06] [ 3.00735878e-08 6.04709501e-05 -1.81674373e-05] [-5.24424491e-05 -3.02846684e-05 -1.81850128e-05] [ 5.23542844e-05 -3.01964488e-05 -1.81511160e-05] [-2.02215017e-06 -9.22358674e-05 -2.23941311e-04] [-1.11647760e-04 2.06691864e-05 -1.65610544e-04] [-4.84546546e-06 -3.55964442e-05 -2.40821615e-04] [ 2.02024797e-06 8.07854181e-05 2.15673054e-04] [ 1.21548035e-04 -1.49477900e-05 1.57333968e-04] [-5.07027634e-06 4.13259489e-05 2.32555482e-04] [-7.41022706e-05 -3.95286994e-05 4.05459214e-05] [ 8.32823460e-05 -1.74103471e-05 6.73884737e-05] [ 7.41057763e-05 3.95285709e-05 -4.08340030e-05] [-8.32826912e-05 1.74135576e-05 -6.80308752e-05] [-5.44125461e-05 -2.64186424e-06 -4.08574863e-05] [ 6.33217436e-05 -1.70813037e-05 -2.27342838e-05] [ 5.44358729e-05 2.64215034e-06 4.18227447e-05] [-6.33216742e-05 1.70812674e-05 2.22998047e-05]] Final stress: [ 1.45678797e-05 1.50232726e-05 8.31759983e-06 1.80858487e-05 1.22645231e-06 -1.42825128e-05] Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-3.29482858e-05 3.34515228e-05 1.61174367e-04] [ 5.14460488e-05 -3.35111040e-05 -1.11767262e-04] [ 3.29126995e-05 -3.34252097e-05 -1.55839477e-04] [-5.13921000e-05 3.35205657e-05 1.98084801e-04] [ 1.65145585e-08 -4.11745049e-05 -1.54000831e-05] [ 3.55882270e-05 2.05488756e-05 -1.53675093e-05] [-3.56750721e-05 2.06171487e-05 -1.54078498e-05] [-1.15901021e-08 2.87450503e-05 -6.68519944e-06] [-2.49330480e-05 -1.43642261e-05 -6.71097861e-06] [ 2.49794116e-05 -1.44081155e-05 -6.71437951e-06] [ 1.50263714e-04 1.10910574e-06 -4.18317783e-04] [ 7.87889305e-05 9.36393724e-05 -3.87131476e-04] [-2.34792104e-05 -3.90420954e-05 -3.63256930e-04] [-1.50205560e-04 -7.85852063e-05 4.09998873e-04] [-1.17490545e-05 -5.49591529e-05 3.78828947e-04] [-4.36276170e-05 7.78267073e-05 3.54917483e-04] [ 2.61641172e-04 -6.73001394e-05 1.18460900e-04] [-1.63027166e-04 7.27033234e-05 2.13539831e-04] [-2.61627718e-04 6.73027458e-05 -1.17732029e-04] [ 1.63036719e-04 -7.26982640e-05 -2.15205041e-04] [ 1.30491728e-04 1.94013706e-05 -1.27608853e-04] [-7.20919082e-05 -8.24144951e-06 -1.86264360e-04] [-1.30518217e-04 -1.93983696e-05 1.28123432e-04] [ 7.21213812e-05 8.24204903e-06 1.86280577e-04]] Final stress: [ 1.48560463e-05 1.20387993e-05 4.21366790e-06 1.83961020e-06 -1.88178397e-05 7.77052036e-06] Minimization converged after 194 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[ 1.74702619e-03 2.23455538e-02 3.10969696e-02] [ 1.38980362e-04 -2.13763812e-02 7.97200919e-03] [-1.89665162e-03 -2.23373297e-02 2.02312731e-02] [-1.50406108e-04 2.13525802e-02 2.90892685e-03] [-7.52487410e-06 -7.13611802e-05 -1.04334383e-03] [ 1.27914866e-04 5.95807672e-05 -1.09290621e-03] [-1.24982290e-04 4.82065626e-05 -1.08719691e-03] [-1.28799858e-05 4.42198328e-02 -1.34170077e-02] [-3.82010777e-02 -2.20477042e-02 -1.35654747e-02] [ 3.84782697e-02 -2.22229935e-02 -1.33419344e-02] [ 1.34036265e-02 -2.63714196e-03 -1.02201650e-02] [-1.31341028e-02 2.47938017e-02 -3.23492739e-03] [-8.46371823e-03 -5.84114095e-03 -3.27257698e-03] [-1.33319838e-02 -5.88983003e-03 4.15284109e-03] [ 2.05628122e-02 -2.05228862e-02 -2.73224980e-03] [ 1.02483429e-03 1.01511021e-02 -2.74262828e-03] [-1.67206551e-03 3.18758069e-03 -2.26246781e-03] [ 2.34295303e-03 -1.37341970e-03 -1.97247496e-03] [ 1.67368300e-03 -3.19415875e-03 2.02554594e-03] [-2.30950090e-03 1.36455935e-03 1.41489722e-03] [ 1.92826397e-03 1.35050729e-03 5.15837047e-03] [-4.43345212e-04 1.82455790e-04 4.14384599e-03] [-2.10794292e-03 -1.35354930e-03 -4.48702969e-03] [ 4.27817833e-04 -1.87864490e-04 -4.63229576e-03]] Final stress: [-8.71853915e-05 9.07966071e-06 -9.89676782e-05 1.60901795e-04 -5.84903597e-05 -1.01009052e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-6.01157095e-05 -7.42492575e-05 4.98713514e-06] [ 8.76245199e-06 1.03958782e-04 3.17820601e-05] [ 3.64944584e-06 -4.46115008e-05 -1.56661867e-05] [-1.26466818e-05 1.53693270e-04 8.16256336e-06] [-9.73270807e-06 5.24185049e-05 1.21389001e-04] [-7.31718274e-06 -1.29252393e-05 4.07542526e-06] [ 1.14914012e-04 6.16140441e-05 1.16401956e-04] [ 5.19959454e-05 8.50143997e-05 -7.36689607e-05] [-2.89622957e-05 -3.10690441e-05 1.27257949e-05] [ 1.00279749e-04 -4.72759886e-05 2.25554271e-05] [-4.77681787e-06 -6.07544811e-05 -2.44661840e-05] [ 5.43561391e-05 -2.92581141e-06 -9.29241735e-05] [-4.99901183e-05 -9.98066956e-05 1.85725881e-05] [-7.36163460e-06 1.47666387e-05 2.78335136e-05] [ 5.62232778e-05 -2.91560642e-05 -4.76148125e-05] [-6.88465697e-06 -4.01165487e-05 1.03443893e-05] [-6.19676345e-05 -2.82709269e-05 7.27339761e-05] [-6.23333295e-05 -2.87709784e-05 1.80489004e-05] [-9.67324277e-05 6.23369551e-06 -1.54449348e-04] [-2.11073763e-05 -2.05017277e-05 6.95831039e-05] [ 6.40719937e-05 5.33620884e-05 -4.79596044e-05] [-4.79519068e-05 -6.91623159e-05 -1.55034946e-05] [ 8.25328855e-05 2.38079040e-05 -2.58326467e-06] [-5.89054198e-05 3.47272536e-05 -6.43598060e-05]] Final stress: [ 3.35845822e-02 3.24778199e-02 1.35160215e-01 -1.54277988e-06 -1.01369409e-03 -2.98652831e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.82351970e-05 -3.64205990e-04 -1.23495986e-04] [-1.82351543e-05 3.64206002e-04 -1.23502390e-04] [-1.82350268e-05 3.64206159e-04 1.23495636e-04] [ 1.82351435e-05 -3.64206164e-04 1.23503656e-04] [ 2.01690526e-11 -1.88644755e-09 -4.33723168e-10] [ 1.53362847e-09 9.81656000e-10 -4.98213332e-10] [-1.59464353e-09 9.54722079e-10 -5.21501814e-10] [-1.27647559e-10 5.40028688e-10 -1.93420835e-11] [-3.59688612e-10 -2.62897148e-10 -1.79748993e-10] [ 4.24588753e-10 -3.14848037e-10 -3.45670194e-11] [-3.17792996e-04 -1.03880016e-03 1.55150199e-09] [-6.91547097e-04 3.24836249e-04 1.32693138e-09] [ 4.83153271e-04 6.18945548e-05 1.49444831e-09] [ 3.17792933e-04 1.03879986e-03 -1.13336521e-09] [ 6.91547402e-04 -3.24836068e-04 -1.33562101e-09] [-4.83153560e-04 -6.18944531e-05 -1.26874470e-09] [-1.14611009e-04 -2.66552277e-04 5.82666901e-04] [ 1.14610992e-04 2.66552277e-04 5.82666714e-04] [ 1.14610996e-04 2.66552276e-04 -5.82666864e-04] [-1.14611007e-04 -2.66552280e-04 -5.82666691e-04] [ 1.34032196e-05 6.57930775e-05 4.07687272e-04] [-1.34032109e-05 -6.57930782e-05 4.07687173e-04] [-1.34032094e-05 -6.57930720e-05 -4.07687248e-04] [ 1.34032198e-05 6.57930696e-05 -4.07687122e-04]] Final stress: [ 2.51475909e-05 1.93550879e-05 -3.30129846e-05 1.98653662e-13 -3.09046496e-13 7.40382250e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.94087743e-05 -3.72542865e-04 -1.15502045e-04] [ 1.94087853e-05 3.72542903e-04 -1.15507262e-04] [ 1.94088795e-05 3.72542885e-04 1.15502238e-04] [-1.94088584e-05 -3.72542865e-04 1.15507302e-04] [ 2.88328339e-11 -9.82084358e-10 -1.71244463e-10] [ 8.52382359e-10 4.57753141e-10 -1.61728297e-10] [-8.83853879e-10 5.07035081e-10 -1.31718414e-10] [-8.42555452e-11 1.17104593e-09 -2.18107865e-10] [-1.00432485e-09 -5.86840798e-10 -2.57305954e-10] [ 1.03779807e-09 -6.08502138e-10 -1.83433414e-10] [ 3.04667554e-04 -9.85323385e-04 1.02488331e-09] [-4.44472555e-04 4.55003447e-05 9.96941749e-10] [ 6.53910626e-04 2.91564528e-04 1.10792555e-09] [-3.04667577e-04 9.85323371e-04 -8.07273259e-10] [ 4.44472595e-04 -4.55003764e-05 -8.43422059e-10] [-6.53910626e-04 -2.91564499e-04 -7.56621709e-10] [ 1.24485732e-04 -2.54293800e-04 5.61104799e-04] [-1.24485739e-04 2.54293799e-04 5.61104680e-04] [-1.24485734e-04 2.54293798e-04 -5.61104767e-04] [ 1.24485734e-04 -2.54293801e-04 -5.61104649e-04] [-1.33238469e-05 5.98566112e-05 4.07229782e-04] [ 1.33238502e-05 -5.98566077e-05 4.07229695e-04] [ 1.33238597e-05 -5.98566068e-05 -4.07229728e-04] [-1.33238514e-05 5.98566096e-05 -4.07229643e-04]] Final stress: [ 2.48398790e-05 1.96059265e-05 -3.17037375e-05 8.87006728e-14 -2.41906441e-13 -8.11665390e-06] Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 18 steps. Minimization converged after 16 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 17 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 3.68852742e-05 -4.23563986e-04 -1.15373000e-05] [-3.68858209e-05 4.23563063e-04 -9.81432693e-06] [-3.68858032e-05 4.23562724e-04 9.82025120e-06] [ 3.68875196e-05 -4.23561876e-04 9.95816478e-06] [ 1.34519523e-10 5.93585123e-08 -1.39169393e-09] [-5.16417963e-08 -3.02551654e-08 -1.59228297e-10] [ 5.06179312e-08 -2.94839169e-08 -1.58166585e-09] [ 3.66433891e-10 -1.30980789e-06 4.03864507e-07] [ 1.13349406e-06 6.54469078e-07 4.05249649e-07] [-1.13492356e-06 6.55776096e-07 4.03705001e-07] [-7.92339365e-05 1.09693044e-05 -8.02248402e-08] [ 5.91771778e-05 -1.80541160e-04 -8.00471167e-08] [-1.93080345e-04 -1.96090671e-04 -7.99977769e-08] [ 7.92342752e-05 -1.15440671e-05 2.02588103e-07] [-5.86797503e-05 1.80828186e-04 2.05743002e-07] [ 1.92582274e-04 1.96378436e-04 2.03270192e-07] [-1.30085753e-04 -9.21405258e-05 2.02304723e-04] [ 1.30085532e-04 9.21404453e-05 2.02314059e-04] [ 1.30085989e-04 9.21405460e-05 -2.02290325e-04] [-1.30085748e-04 -9.21404745e-05 -2.02317431e-04] [ 1.16399003e-05 -1.84246972e-05 2.36368571e-04] [-1.16395278e-05 1.84246565e-05 2.36394439e-04] [-1.16388635e-05 1.84246447e-05 -2.36390543e-04] [ 1.16395587e-05 -1.84246057e-05 -2.36391299e-04]] Final stress: [ 1.89546610e-05 1.91433516e-05 -6.39977749e-06 -5.20040887e-12 -1.33759529e-11 7.63312621e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-4.15521739e-05 -4.45261481e-04 -1.59815651e-05] [ 4.15523126e-05 4.45262654e-04 -1.56399059e-05] [ 4.15526208e-05 4.45262308e-04 1.56914982e-05] [-4.15522810e-05 -4.45263499e-04 1.56241782e-05] [ 2.49435568e-10 -5.50820956e-09 -2.37525832e-09] [ 4.30243009e-09 2.55054881e-09 -2.65200148e-09] [-4.84563534e-09 3.22697674e-09 -2.98716205e-09] [-1.82833456e-10 -3.34680231e-07 9.03840667e-08] [ 2.90164788e-07 1.67346979e-07 8.95858404e-08] [-2.89925254e-07 1.67100155e-07 9.03129876e-08] [ 1.06205390e-04 2.66889548e-04 -2.84073423e-08] [ 3.94347079e-04 -3.02240899e-04 -2.82902641e-08] [-2.48664312e-04 -2.62227492e-04 -2.78453115e-08] [-1.06205115e-04 -2.66782385e-04 4.62821879e-08] [-3.94440235e-04 3.02187005e-04 4.42883221e-08] [ 2.48757071e-04 2.62174193e-04 4.45400282e-08] [ 1.40285001e-04 -1.21459857e-04 2.53851041e-04] [-1.40284909e-04 1.21459960e-04 2.53857366e-04] [-1.40284959e-04 1.21459842e-04 -2.53852547e-04] [ 1.40284990e-04 -1.21459946e-04 -2.53855612e-04] [-9.67700107e-06 -3.89810172e-05 2.49272307e-04] [ 9.67690300e-06 3.89810629e-05 2.49280554e-04] [ 9.67673146e-06 3.89810616e-05 -2.49280762e-04] [-9.67687676e-06 -3.89810968e-05 -2.49279388e-04]] Final stress: [ 1.92843737e-05 1.93096367e-05 -9.94304023e-06 6.70319220e-12 1.50993390e-12 -5.01775990e-06] Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 4 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 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 8 steps. Minimization converged after 8 steps. Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 15 steps. Minimization converged after 14 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 8 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 15 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. 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 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 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 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 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 0 steps. Minimization converged after 1 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 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 7 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 2 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 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 2 steps. Minimization converged after 3 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 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 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 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 8 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 0 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 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 7 steps. Minimization converged after 1 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 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 2 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 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 7 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 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 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 5 steps. Minimization converged after 5 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]: [[ 1.17 0.64284 0.59705 0.00001 -0.00007 -0. ] [ 0.64284 1.16959 0.59846 -0.00002 0.00013 0.00015] [ 0.59705 0.59846 1.11943 0. 0.00002 -0.00004] [ 0.00001 -0.00002 0. -0.21569 -0. 0.00005] [-0.00007 0.00013 0.00002 -0. -0.21542 0.00023] [-0. 0.00015 -0.00004 0.00005 0.00023 0.25243]] 95%% Error estimate [ASE units]: [[0.01103 0.03126 0.00976 0.00028 0.00017 0.00077] [0.03126 0.00751 0.02111 0.00013 0.00062 0.00036] [0.00976 0.02111 0. 0.00007 0.00007 0.00018] [0.00028 0.00013 0.00007 0.00034 0. 1.38333] [0.00017 0.00062 0.00007 0. 0.00045 0.00865] [0.00077 0.00036 0.00018 1.38333 0.00865 0.02104]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.691664 is too big compared to maximum elastic constant component 1.169997 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.011146 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 3 steps. Minimization converged after 30 steps. Minimization converged after 19 steps. Minimization converged after 9 steps. Minimization converged after 29 steps. Minimization converged after 25 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-7.16446624e-11 2.43810824e-03 -1.90970285e-03] [ 6.02751112e-13 -2.43810808e-03 -1.90969904e-03] [-1.40125790e-10 -2.43810796e-03 1.90969856e-03] [-5.05799569e-11 2.43810812e-03 1.90969832e-03] [-1.11186459e-10 1.03219772e-09 1.67608927e-10] [-7.38569261e-10 -3.99869339e-10 1.38009076e-10] [ 9.20700877e-10 -6.32358221e-10 2.23005642e-10] [-1.28423958e-10 -5.54969781e-09 1.48701584e-09] [ 4.34216874e-09 2.80608714e-09 1.35455958e-09] [-4.05903922e-09 2.49114923e-09 1.14150742e-09] [-9.51763668e-11 -4.08856949e-03 -2.12120739e-10] [-2.65727816e-03 1.47173651e-03 -2.03586242e-10] [ 2.65727834e-03 1.47173629e-03 -3.33347588e-10] [-4.53204696e-11 4.08857042e-03 4.94659978e-10] [ 2.65727721e-03 -1.47173689e-03 4.67939127e-10] [-2.65727711e-03 -1.47173700e-03 4.65913660e-10] [-9.63570890e-12 7.27741773e-04 5.20305697e-03] [-1.63382641e-11 -7.27741773e-04 5.20305702e-03] [-1.41893164e-11 -7.27741780e-04 -5.20305699e-03] [-2.04651851e-11 7.27741789e-04 -5.20305703e-03] [-1.01854636e-11 5.62124710e-03 -8.47741760e-03] [-3.58574479e-12 -5.62124707e-03 -8.47741750e-03] [-8.50810389e-12 -5.62124704e-03 8.47741746e-03] [-1.34574574e-11 5.62124708e-03 8.47741748e-03]] Final stress: [ 1.65005475e-02 1.19688446e-02 1.58100178e-02 -2.01317888e-13 3.14784234e-13 -2.71662388e-14] Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-4.94687703e-02 1.06751263e-02 4.27713280e-01] [ 4.94686792e-02 -1.06751095e-02 4.27712156e-01] [ 4.94687587e-02 -1.06751459e-02 -4.27713921e-01] [-4.94686782e-02 1.06751149e-02 -4.27712259e-01] [ 1.67563007e-08 -1.36728370e-07 -6.13801043e-09] [ 8.43845245e-08 4.79980755e-08 1.46375898e-08] [-1.05042460e-07 7.98821396e-08 1.74320336e-09] [-1.95419716e-08 -2.88852816e-08 6.93413352e-08] [ 7.88221146e-08 4.39085012e-08 9.02695571e-08] [-4.67745691e-08 1.50520990e-09 8.70710764e-08] [ 5.14527476e-01 -1.05099608e-01 2.87642768e-07] [-1.77354318e-01 4.26175363e-01 3.08568815e-07] [ 1.79488310e-02 -8.45760367e-01 3.58984026e-07] [-5.14527479e-01 1.05099278e-01 -1.61919491e-07] [ 1.77354619e-01 -4.26175193e-01 -1.51265949e-07] [-1.79491237e-02 8.45760521e-01 -2.07715702e-07] [ 1.13202727e-01 3.35715376e-01 -2.49080738e-01] [-1.13202724e-01 -3.35715360e-01 -2.49080775e-01] [-1.13202723e-01 -3.35715364e-01 2.49080756e-01] [ 1.13202723e-01 3.35715365e-01 2.49080790e-01] [ 5.95036105e-02 -7.33985337e-02 -1.24142182e-01] [-5.95036158e-02 7.33985355e-02 -1.24142186e-01] [-5.95036147e-02 7.33985320e-02 1.24142191e-01] [ 5.95036121e-02 -7.33985378e-02 1.24142197e-01]] Final stress: [ 1.61227611e-02 2.25668049e-02 1.19544125e-02 -1.40195772e-10 6.33461072e-11 7.43153079e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 4.94687090e-02 1.06750910e-02 4.27713854e-01] [-4.94686187e-02 -1.06750749e-02 4.27712087e-01] [-4.94686967e-02 -1.06750702e-02 -4.27713259e-01] [ 4.94686329e-02 1.06750745e-02 -4.27712472e-01] [-2.10039427e-08 -8.71954844e-08 2.76826688e-08] [ 6.49507822e-08 6.10643239e-08 3.40418792e-08] [-4.11582831e-08 2.21679177e-08 3.77610211e-08] [ 5.41042382e-08 7.37324952e-07 -1.90679956e-07] [-6.06210002e-07 -4.21311828e-07 -2.11927685e-07] [ 5.38320772e-07 -3.19359688e-07 -1.22547156e-07] [-5.14527599e-01 -1.05099405e-01 2.49494306e-07] [-1.79493262e-02 -8.45760493e-01 2.81511217e-07] [ 1.77354524e-01 4.26175545e-01 2.27672045e-07] [ 5.14527611e-01 1.05099705e-01 -1.83075886e-07] [ 1.79490510e-02 8.45760325e-01 -2.22584478e-07] [-1.77354272e-01 -4.26175673e-01 -1.87432679e-07] [-1.13202822e-01 3.35715279e-01 -2.49080012e-01] [ 1.13202822e-01 -3.35715282e-01 -2.49080044e-01] [ 1.13202819e-01 -3.35715285e-01 2.49080019e-01] [-1.13202813e-01 3.35715270e-01 2.49080054e-01] [-5.95037185e-02 -7.33985069e-02 -1.24142079e-01] [ 5.95037145e-02 7.33985099e-02 -1.24142093e-01] [ 5.95037091e-02 7.33985072e-02 1.24142104e-01] [-5.95037144e-02 -7.33985094e-02 1.24142100e-01]] Final stress: [ 1.61227714e-02 2.25668117e-02 1.19543998e-02 -2.13188940e-10 -6.69476430e-11 -7.43153517e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-8.39890590e-04 6.51661687e-04 5.95123748e-03] [ 8.39890591e-04 -6.51661690e-04 5.95123784e-03] [ 8.39890587e-04 -6.51661684e-04 -5.95123744e-03] [-8.39890590e-04 6.51661691e-04 -5.95123781e-03] [ 3.76554864e-12 -4.18006185e-11 -1.02887143e-11] [ 2.65173994e-11 1.52489410e-11 -5.52230484e-12] [-3.23638893e-11 2.32295849e-11 -8.07942602e-12] [-2.70101996e-12 8.85576057e-11 -1.68477454e-11] [-7.78035414e-11 -3.65020236e-11 -1.61682889e-11] [ 8.41354764e-11 -5.23275867e-11 -1.96294023e-11] [ 2.13145900e-02 -5.76623645e-04 -6.15474756e-11] [-1.94873230e-02 1.21394814e-02 -6.78035233e-11] [-7.95046630e-03 -8.20941826e-03 -6.60091324e-11] [-2.13145900e-02 5.76623612e-04 6.50504479e-11] [ 1.94873230e-02 -1.21394814e-02 6.62979275e-11] [ 7.95046627e-03 8.20941827e-03 6.47624903e-11] [-4.33458923e-03 2.44881069e-03 1.84213596e-03] [ 4.33458923e-03 -2.44881069e-03 1.84213597e-03] [ 4.33458923e-03 -2.44881069e-03 -1.84213596e-03] [-4.33458923e-03 2.44881069e-03 -1.84213597e-03] [ 1.51224644e-04 -1.97108252e-03 -2.17094380e-03] [-1.51224645e-04 1.97108252e-03 -2.17094379e-03] [-1.51224645e-04 1.97108252e-03 2.17094380e-03] [ 1.51224645e-04 -1.97108252e-03 2.17094379e-03]] Final stress: [-1.21066352e-02 -6.97574410e-03 -6.13894293e-03 -1.88924407e-14 -4.65511068e-15 5.13768843e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 8.39989907e-04 6.51626239e-04 5.95149568e-03] [-8.39989915e-04 -6.51626240e-04 5.95149607e-03] [-8.39989909e-04 -6.51626249e-04 -5.95149568e-03] [ 8.39989908e-04 6.51626248e-04 -5.95149602e-03] [-2.49643839e-13 -6.03062045e-12 -1.29282696e-11] [ 3.50627860e-12 2.97143560e-12 -9.26841937e-12] [ 2.26318964e-13 -7.80486786e-14 -5.68206593e-12] [-1.01507552e-11 -1.15160548e-10 9.54469837e-12] [ 1.19614318e-10 7.65078001e-11 2.09404716e-11] [-1.03564546e-10 4.43870496e-11 1.54300912e-11] [-2.13147078e-02 -5.76431583e-04 -8.24271611e-11] [ 7.95064940e-03 -8.20949063e-03 -7.45899924e-11] [ 1.94874521e-02 1.21393887e-02 -7.22336214e-11] [ 2.13147078e-02 5.76431609e-04 5.32778918e-11] [-7.95064943e-03 8.20949062e-03 5.65161308e-11] [-1.94874520e-02 -1.21393887e-02 5.95487845e-11] [ 4.33466630e-03 2.44884894e-03 1.84218384e-03] [-4.33466630e-03 -2.44884894e-03 1.84218385e-03] [-4.33466630e-03 -2.44884894e-03 -1.84218384e-03] [ 4.33466630e-03 2.44884894e-03 -1.84218385e-03] [-1.51201770e-04 -1.97109417e-03 -2.17092749e-03] [ 1.51201769e-04 1.97109417e-03 -2.17092748e-03] [ 1.51201768e-04 1.97109417e-03 2.17092748e-03] [-1.51201769e-04 -1.97109417e-03 2.17092748e-03]] Final stress: [-1.21066343e-02 -6.97574266e-03 -6.13894669e-03 1.20011328e-14 -1.83131473e-15 -5.13768735e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-2.41667797e-13 1.54788499e-03 -2.34020532e-03] [ 2.08057559e-12 -1.54788499e-03 -2.34020534e-03] [-8.99393861e-13 -1.54788500e-03 2.34020528e-03] [ 1.26623712e-12 1.54788499e-03 2.34020536e-03] [ 5.69653672e-13 -3.30141470e-12 -3.69582143e-12] [ 4.03904687e-12 6.51804999e-13 -1.78726478e-12] [-6.98430203e-12 2.90600877e-12 -5.21815924e-12] [-6.34887650e-13 -1.20012889e-11 5.59219338e-12] [ 1.05790932e-11 7.02321534e-12 6.92479407e-12] [-8.93360386e-12 5.39340794e-12 5.36822670e-12] [ 1.71612724e-13 1.66474477e-03 6.95288452e-12] [-1.35983427e-03 6.90036545e-03 1.52496530e-11] [ 1.35983427e-03 6.90036545e-03 1.29248034e-11] [ 7.71022135e-13 -1.66474480e-03 -7.93772248e-12] [ 1.35983430e-03 -6.90036544e-03 -7.88896943e-12] [-1.35983430e-03 -6.90036543e-03 -8.54453092e-12] [ 2.17076357e-13 8.02136679e-03 -2.47998846e-03] [-1.19682042e-13 -8.02136679e-03 -2.47998846e-03] [ 9.32032229e-14 -8.02136679e-03 2.47998846e-03] [-2.03531636e-13 8.02136679e-03 2.47998846e-03] [ 6.66133815e-16 -9.80754034e-03 -5.78125955e-04] [ 2.58863894e-13 9.80754034e-03 -5.78125956e-04] [ 4.91324646e-14 9.80754034e-03 5.78125955e-04] [ 2.00728323e-13 -9.80754034e-03 5.78125956e-04]] Final stress: [ 1.17077692e-02 2.11361122e-02 1.12893254e-02 2.11600268e-14 4.74342474e-15 -9.49087957e-16] Minimization converged after 22 steps. Minimization converged after 31 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 20 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 4.30987908e-02 1.48541967e-03 1.62673276e-02] [-4.30987932e-02 -1.48541531e-03 1.62670417e-02] [-4.30987924e-02 -1.48541699e-03 -1.62673163e-02] [ 4.30987934e-02 1.48541475e-03 -1.62669847e-02] [ 2.05276262e-09 -3.24138950e-08 -9.50416673e-09] [ 2.53396545e-08 1.40977853e-08 -8.83093706e-09] [-2.82871606e-08 1.80835114e-08 -8.95245214e-09] [-5.77967872e-09 8.04422504e-08 -1.53758756e-08] [-7.07692100e-08 -3.53145933e-08 -1.56905905e-08] [ 7.94947992e-08 -4.69349724e-08 -1.72332270e-08] [ 8.28793238e-02 -1.24186671e-02 5.50346559e-08] [-2.71995647e-02 -2.02572075e-02 5.65393589e-08] [-2.74131142e-02 -3.30209336e-02 5.60224438e-08] [-8.28793189e-02 1.24185609e-02 -5.27506835e-08] [ 2.71996557e-02 2.02572559e-02 -5.69920961e-08] [ 2.74130180e-02 3.30209900e-02 -5.57737862e-08] [ 3.95439801e-03 1.63322287e-02 1.91207367e-03] [-3.95439657e-03 -1.63322287e-02 1.91206410e-03] [-3.95439761e-03 -1.63322283e-02 -1.91207140e-03] [ 3.95439696e-03 1.63322287e-02 -1.91206553e-03] [-1.00299523e-02 1.46939809e-03 -2.04344541e-02] [ 1.00299525e-02 -1.46939760e-03 -2.04344603e-02] [ 1.00299510e-02 -1.46939724e-03 2.04344578e-02] [-1.00299522e-02 1.46939770e-03 2.04344609e-02]] Final stress: [ 4.62870156e-03 1.15371701e-02 5.12056704e-03 -1.12030297e-11 1.91510848e-11 4.32759547e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-4.31146188e-02 1.48575139e-03 1.62753934e-02] [ 4.31146205e-02 -1.48574770e-03 1.62751244e-02] [ 4.31146230e-02 -1.48574974e-03 -1.62754131e-02] [-4.31146241e-02 1.48574954e-03 -1.62751352e-02] [-2.89403274e-09 -3.34052473e-08 -3.75588177e-09] [ 3.07295481e-08 1.92717825e-08 -3.14785725e-09] [-2.51949098e-08 1.27768102e-08 -2.74928413e-11] [ 6.26573953e-09 7.62570299e-08 -9.43039480e-09] [-7.81936293e-08 -4.59591786e-08 -1.30529018e-08] [ 6.73045519e-08 -3.24469696e-08 -8.74648454e-09] [-8.29053316e-02 -1.24239658e-02 5.74958837e-08] [ 2.74222332e-02 -3.30338681e-02 5.75478270e-08] [ 2.72060865e-02 -2.02695438e-02 6.08778620e-08] [ 8.29053283e-02 1.24239146e-02 -3.91560999e-08] [-2.74221852e-02 3.30338962e-02 -4.06117526e-08] [-2.72061302e-02 2.02695659e-02 -3.92091260e-08] [-3.95614606e-03 1.63387189e-02 1.91264124e-03] [ 3.95614493e-03 -1.63387190e-02 1.91263359e-03] [ 3.95614553e-03 -1.63387185e-02 -1.91263830e-03] [-3.95614474e-03 1.63387189e-02 -1.91263229e-03] [ 1.00351441e-02 1.47233155e-03 -2.04446776e-02] [-1.00351443e-02 -1.47233125e-03 -2.04446828e-02] [-1.00351427e-02 -1.47233053e-03 2.04446825e-02] [ 1.00351437e-02 1.47233094e-03 2.04446854e-02]] Final stress: [ 4.62843541e-03 1.15376685e-02 5.12070417e-03 -1.56473353e-11 -1.81430415e-11 -4.32741701e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.14513596e-02 -2.46603775e-02 1.23596745e-02] [-1.14513595e-02 2.46603774e-02 1.23596707e-02] [-1.14513595e-02 2.46603776e-02 -1.23596586e-02] [ 1.14513592e-02 -2.46603777e-02 -1.23596793e-02] [-1.25278689e-09 2.02796661e-08 4.03655054e-09] [-1.52525729e-08 -8.76648781e-09 3.41612923e-09] [ 1.69542467e-08 -1.12108283e-08 3.91198396e-09] [ 1.23966781e-10 4.96452079e-09 -2.91441860e-09] [-4.52384619e-09 -2.66291367e-09 -3.15211168e-09] [ 4.24585123e-09 -2.35240127e-09 -2.84588780e-09] [ 6.39751288e-02 1.10876752e-02 -2.75190505e-09] [-2.12655662e-02 6.54035245e-02 -2.93881309e-09] [-4.72666586e-02 -8.79222456e-02 -2.89121489e-09] [-6.39751285e-02 -1.10876760e-02 2.14369218e-10] [ 2.12655665e-02 -6.54035243e-02 6.00526338e-11] [ 4.72666581e-02 8.79222461e-02 2.13531501e-10] [ 1.12191132e-02 1.25878368e-03 -3.01347003e-04] [-1.12191132e-02 -1.25878368e-03 -3.01346808e-04] [-1.12191133e-02 -1.25878371e-03 3.01346686e-04] [ 1.12191133e-02 1.25878372e-03 3.01346504e-04] [-1.42509222e-03 -6.18682534e-03 -8.60860930e-03] [ 1.42509215e-03 6.18682532e-03 -8.60860945e-03] [ 1.42509223e-03 6.18682535e-03 8.60860906e-03] [-1.42509228e-03 -6.18682537e-03 8.60860863e-03]] Final stress: [-6.98578513e-03 -1.19461506e-02 -5.98974192e-03 -4.01851080e-13 2.44059023e-13 5.21603813e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.14514504e-02 -2.46605438e-02 1.23597940e-02] [ 1.14514502e-02 2.46605439e-02 1.23598217e-02] [ 1.14514504e-02 2.46605438e-02 -1.23597943e-02] [-1.14514503e-02 -2.46605438e-02 -1.23598144e-02] [-5.07358616e-10 -9.95919136e-09 -2.61512173e-09] [ 8.30145562e-09 5.39465801e-09 -2.51253468e-09] [-7.67039376e-09 4.43313641e-09 -2.42070491e-09] [-3.34375305e-11 -7.90244092e-10 3.84779764e-10] [ 4.70624428e-10 3.83383436e-10 3.09657522e-10] [-4.18176604e-10 3.35046713e-10 2.95169132e-10] [-6.39753386e-02 1.10878549e-02 -4.32582787e-09] [ 4.72668988e-02 -8.79226432e-02 -4.35326854e-09] [ 2.12654812e-02 6.54036777e-02 -4.52802967e-09] [ 6.39753391e-02 -1.10878490e-02 4.06280088e-09] [-4.72669039e-02 8.79226399e-02 4.16335709e-09] [-2.12654768e-02 -6.54036802e-02 4.28378770e-09] [-1.12192052e-02 1.25880217e-03 -3.01365072e-04] [ 1.12192053e-02 -1.25880220e-03 -3.01364455e-04] [ 1.12192052e-02 -1.25880217e-03 3.01365002e-04] [-1.12192053e-02 1.25880220e-03 3.01364563e-04] [ 1.42509222e-03 -6.18683136e-03 -8.60857704e-03] [-1.42509221e-03 6.18683135e-03 -8.60857653e-03] [-1.42509222e-03 6.18683135e-03 8.60857703e-03] [ 1.42509217e-03 -6.18683134e-03 8.60857675e-03]] Final stress: [-6.98578356e-03 -1.19461482e-02 -5.98974188e-03 -1.10446134e-12 8.51847881e-13 -5.21603782e-03] Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 3.81012500e-03 2.36288973e-02 -2.50866844e-03] [-3.81012501e-03 -2.36288973e-02 -2.50866888e-03] [-3.81012500e-03 -2.36288973e-02 2.50866870e-03] [ 3.81012500e-03 2.36288973e-02 2.50866850e-03] [-9.59756558e-12 2.26755226e-10 8.09146639e-11] [-1.86939325e-10 -1.03415249e-10 7.90921773e-11] [ 1.99947281e-10 -1.22222621e-10 8.06712197e-11] [-7.99442457e-12 1.58206115e-10 -5.37195843e-11] [-1.27506228e-10 -7.08999526e-11 -5.19253529e-11] [ 1.38953071e-10 -8.63124572e-11 -5.45257797e-11] [ 4.07518526e-02 -3.22109631e-02 2.80045836e-11] [-2.98649426e-02 4.79002019e-02 2.59252495e-11] [-1.65755049e-02 -1.51572871e-02 2.55045335e-11] [-4.07518526e-02 3.22109634e-02 -1.41172924e-11] [ 2.98649425e-02 -4.79002020e-02 -1.46421318e-11] [ 1.65755051e-02 1.51572870e-02 -1.41763001e-11] [-4.06925723e-03 6.20017057e-03 2.20852722e-03] [ 4.06925723e-03 -6.20017057e-03 2.20852723e-03] [ 4.06925723e-03 -6.20017057e-03 -2.20852723e-03] [-4.06925723e-03 6.20017057e-03 -2.20852722e-03] [-1.05491896e-03 -3.67074508e-03 2.06412873e-03] [ 1.05491896e-03 3.67074508e-03 2.06412872e-03] [ 1.05491896e-03 3.67074508e-03 -2.06412872e-03] [-1.05491896e-03 -3.67074508e-03 -2.06412873e-03]] Final stress: [-6.18808343e-03 -5.99968026e-03 -1.18601757e-02 -8.23675531e-15 -1.18765416e-15 5.04407305e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-3.81015053e-03 2.36295282e-02 -2.50875249e-03] [ 3.81015053e-03 -2.36295282e-02 -2.50875262e-03] [ 3.81015053e-03 -2.36295282e-02 2.50875273e-03] [-3.81015054e-03 2.36295282e-02 2.50875314e-03] [-2.69914043e-11 -5.83488591e-10 -1.71888170e-10] [ 5.20065213e-10 3.17199204e-10 -1.76294951e-10] [-4.87585416e-10 2.67873224e-10 -1.75363085e-10] [-8.91497987e-12 -1.15503607e-10 3.72224473e-12] [ 1.06476494e-10 6.61199984e-11 4.10949053e-12] [-9.43875256e-11 4.85187446e-11 2.06744344e-13] [-4.07526834e-02 -3.22120155e-02 7.89537589e-12] [ 1.65757039e-02 -1.51575133e-02 8.17519413e-12] [ 2.98658354e-02 4.79014162e-02 8.65996857e-12] [ 4.07526834e-02 3.22120161e-02 -8.42533603e-11] [-1.65757044e-02 1.51575130e-02 -8.77544502e-11] [-2.98658349e-02 -4.79014165e-02 -9.28236750e-11] [ 4.06937165e-03 6.20033461e-03 2.20860362e-03] [-4.06937165e-03 -6.20033461e-03 2.20860362e-03] [-4.06937165e-03 -6.20033461e-03 -2.20860363e-03] [ 4.06937165e-03 6.20033461e-03 -2.20860362e-03] [ 1.05496706e-03 -3.67080895e-03 2.06412851e-03] [-1.05496706e-03 3.67080895e-03 2.06412852e-03] [-1.05496706e-03 3.67080895e-03 -2.06412852e-03] [ 1.05496706e-03 -3.67080895e-03 -2.06412851e-03]] Final stress: [-6.18808308e-03 -5.99966828e-03 -1.18601745e-02 1.64112211e-14 -5.52300709e-15 -5.04406953e-03] Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 112 steps. Minimization converged after 109 steps. Minimization converged after 112 steps. Minimization converged after 110 steps. Minimization converged after 103 steps. Minimization converged after 104 steps. Minimization converged after 102 steps. Minimization converged after 102 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 95 steps. Minimization converged after 92 steps. Minimization converged after 92 steps. Minimization converged after 92 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.01355243e-02 5.27199907e-03 6.12698856e-03] [-1.01355243e-02 -5.27199907e-03 6.12698854e-03] [-1.01355243e-02 -5.27199907e-03 -6.12698856e-03] [ 1.01355243e-02 5.27199907e-03 -6.12698856e-03] [-8.13917510e-13 1.07858722e-11 3.84503540e-12] [-7.04281078e-12 -4.20416479e-12 2.93103042e-12] [ 8.51263504e-12 -6.12365714e-12 3.62601615e-12] [-1.10694787e-12 1.53093094e-11 -3.73279185e-12] [-8.77020678e-12 -5.67834668e-12 -1.06503695e-12] [ 1.08385523e-11 -7.92910182e-12 -2.30366420e-12] [ 6.94413246e-02 1.04104858e-02 2.66008613e-12] [-3.54408145e-02 2.71667546e-02 3.38277471e-12] [-1.90604711e-02 -2.62318490e-02 3.76301934e-12] [-6.94413246e-02 -1.04104858e-02 -9.08942111e-13] [ 3.54408145e-02 -2.71667546e-02 -5.52193933e-13] [ 1.90604711e-02 2.62318490e-02 -6.62217606e-13] [-1.91509958e-02 -8.74032344e-04 -2.25424359e-03] [ 1.91509958e-02 8.74032344e-04 -2.25424359e-03] [ 1.91509958e-02 8.74032344e-04 2.25424359e-03] [-1.91509958e-02 -8.74032344e-04 2.25424359e-03] [ 3.00089944e-04 -1.61604668e-02 -2.06455532e-03] [-3.00089944e-04 1.61604668e-02 -2.06455532e-03] [-3.00089945e-04 1.61604668e-02 2.06455532e-03] [ 3.00089944e-04 -1.61604668e-02 2.06455532e-03]] Final stress: [-6.23831144e-04 -7.86807979e-04 -2.96158586e-04 6.82649165e-16 -9.62288582e-16 1.05922352e-02] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.01354938e-02 5.27202723e-03 6.12699897e-03] [ 1.01354938e-02 -5.27202723e-03 6.12699895e-03] [ 1.01354938e-02 -5.27202723e-03 -6.12699899e-03] [-1.01354938e-02 5.27202723e-03 -6.12699896e-03] [-3.33669724e-13 9.54192281e-12 4.37683223e-12] [-7.24030558e-12 -4.37436198e-12 3.45878881e-12] [ 8.01220201e-12 -4.83740825e-12 4.52632376e-12] [-2.86992652e-14 -6.28830321e-12 3.28870264e-12] [ 5.08559861e-12 2.98505665e-12 2.90378832e-12] [-5.36276579e-12 3.30330208e-12 3.69448569e-12] [-6.94412329e-02 1.04103789e-02 6.15046481e-12] [ 1.90603340e-02 -2.62318822e-02 5.99127145e-12] [ 3.54408914e-02 2.71668248e-02 7.64980493e-12] [ 6.94412329e-02 -1.04103789e-02 -1.45033397e-12] [-1.90603340e-02 2.62318823e-02 -1.61538890e-12] [-3.54408914e-02 -2.71668248e-02 -1.71007398e-12] [ 1.91509700e-02 -8.74014941e-04 -2.25423935e-03] [-1.91509700e-02 8.74014941e-04 -2.25423935e-03] [-1.91509700e-02 8.74014941e-04 2.25423935e-03] [ 1.91509700e-02 -8.74014941e-04 2.25423935e-03] [-3.00099407e-04 -1.61604491e-02 -2.06456872e-03] [ 3.00099407e-04 1.61604491e-02 -2.06456872e-03] [ 3.00099407e-04 1.61604491e-02 2.06456872e-03] [-3.00099407e-04 -1.61604491e-02 2.06456872e-03]] Final stress: [-6.23831351e-04 -7.86807845e-04 -2.96158213e-04 2.62367571e-15 -4.10000734e-15 -1.05922347e-02] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.37181932e-12 6.67475634e-04 -3.10108039e-04] [ 1.98046874e-14 -6.67475633e-04 -3.10108101e-04] [-1.93122638e-13 -6.67475635e-04 3.10108029e-04] [-1.66006098e-13 6.67475634e-04 3.10108060e-04] [ 2.64325305e-13 2.44974041e-11 6.90736357e-12] [-2.10151202e-11 -1.26906818e-11 7.31797956e-12] [ 1.99266437e-11 -1.18106080e-11 6.29160612e-12] [ 1.44033806e-12 -8.40227887e-12 2.30859776e-12] [ 4.47264448e-12 2.52498022e-12 1.33892897e-12] [-7.24434401e-12 5.77271564e-12 3.21832838e-12] [-1.27114985e-12 -9.06513217e-04 1.09020055e-11] [ 8.77159543e-04 -1.63858719e-03 1.33129147e-11] [-8.77159540e-04 -1.63858720e-03 1.29714406e-11] [-8.83737528e-14 9.06513246e-04 -4.41308172e-12] [-8.77159571e-04 1.63858718e-03 -5.66209536e-12] [ 8.77159571e-04 1.63858718e-03 -3.87226850e-12] [ 4.32154312e-14 -6.80596754e-04 -1.24704524e-03] [ 2.50632848e-13 6.80596754e-04 -1.24704524e-03] [-7.66053887e-14 6.80596754e-04 1.24704524e-03] [ 1.57762692e-13 -6.80596754e-04 1.24704525e-03] [-1.18016708e-13 3.87614715e-03 1.88636789e-03] [ 8.23050395e-14 -3.87614715e-03 1.88636789e-03] [-2.90498149e-14 -3.87614715e-03 -1.88636789e-03] [-9.20929999e-14 3.87614715e-03 -1.88636789e-03]] Final stress: [1.36978725e-02 7.73137060e-03 7.30719053e-03 4.92471942e-15 6.82071609e-15 2.57299335e-16] Minimization converged after 22 steps. Minimization converged after 8 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-5.53547624e-10 -8.72417400e-03 -4.80784516e-04] [-9.69679387e-10 8.72417660e-03 -4.80783674e-04] [-9.47814902e-10 8.72417632e-03 4.80824779e-04] [-4.47305373e-10 -8.72417586e-03 4.80747049e-04] [-1.24768836e-09 3.05189017e-08 8.33407898e-09] [-2.36267997e-08 -1.39113575e-08 8.29918813e-09] [ 2.55692586e-08 -1.64387419e-08 9.19672097e-09] [-7.73671628e-10 3.53553991e-08 -8.23414958e-09] [-3.26077501e-08 -1.74319390e-08 -9.85169468e-09] [ 3.44980427e-08 -1.94732839e-08 -1.13731402e-08] [-2.37767250e-09 1.42193039e-02 -7.62820994e-09] [ 1.47886728e-02 -1.23992294e-02 -7.16870584e-09] [-1.47886687e-02 -1.23992346e-02 -6.84290947e-09] [-5.25583577e-10 -1.42192880e-02 7.79750250e-09] [-1.47886896e-02 1.23992236e-02 6.64046609e-09] [ 1.47886906e-02 1.23992224e-02 6.81643586e-09] [-1.38176026e-10 9.98965463e-03 -3.20740948e-03] [-7.00540737e-11 -9.98965448e-03 -3.20740812e-03] [-1.50029766e-10 -9.98965477e-03 3.20740915e-03] [-4.37799796e-11 9.98965492e-03 3.20740844e-03] [-3.32089245e-10 5.67846444e-03 9.52823124e-03] [-2.93735565e-11 -5.67846448e-03 9.52823090e-03] [-9.88343497e-11 -5.67846441e-03 -9.52823020e-03] [-2.46614063e-10 5.67846458e-03 -9.52823156e-03]] Final stress: [ 9.75861211e-03 7.09573558e-03 9.70979913e-03 4.03188235e-13 -4.43816618e-13 -1.10642210e-12] Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 21 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 72 steps. Minimization converged after 73 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.81885827e-03 -5.24217140e-03 4.72718291e-03] [ 1.81885825e-03 5.24217140e-03 4.72718379e-03] [ 1.81885826e-03 5.24217135e-03 -4.72718257e-03] [-1.81885825e-03 -5.24217134e-03 -4.72718346e-03] [-7.63601682e-12 2.10287343e-12 -6.17706997e-11] [ 2.60014787e-11 -1.01453568e-13 -3.48852058e-11] [-1.38843381e-11 -1.76477166e-11 -2.97727676e-11] [ 6.23333329e-12 6.16666718e-11 -6.85753676e-11] [-9.33274569e-11 -3.27923244e-11 -5.13876719e-11] [ 8.87447338e-11 -2.30225283e-11 -5.17603009e-11] [ 1.19461341e-02 -4.94459791e-03 -2.46437581e-10] [-1.09296172e-02 6.45099924e-03 -2.13226771e-10] [-3.94594001e-03 -4.29665432e-03 -1.88520293e-10] [-1.19461341e-02 4.94459785e-03 6.88657712e-11] [ 1.09296172e-02 -6.45099921e-03 1.41900612e-10] [ 3.94593995e-03 4.29665435e-03 1.05986372e-10] [-3.60570427e-03 9.46113639e-04 2.91045036e-03] [ 3.60570427e-03 -9.46113638e-04 2.91045038e-03] [ 3.60570427e-03 -9.46113640e-04 -2.91045037e-03] [-3.60570427e-03 9.46113640e-04 -2.91045039e-03] [-3.18635895e-04 -3.36086801e-04 -1.11423585e-03] [ 3.18635894e-04 3.36086801e-04 -1.11423584e-03] [ 3.18635896e-04 3.36086800e-04 1.11423585e-03] [-3.18635895e-04 -3.36086799e-04 1.11423583e-03]] Final stress: [-7.41214848e-03 -4.25798058e-03 -3.95419773e-03 -2.27643454e-14 -1.74490796e-13 3.17854242e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 1.81885270e-03 -5.24214991e-03 4.72716321e-03] [-1.81885270e-03 5.24214994e-03 4.72716366e-03] [-1.81885270e-03 5.24214991e-03 -4.72716324e-03] [ 1.81885271e-03 -5.24214993e-03 -4.72716344e-03] [ 1.08601587e-11 -6.69883593e-11 -4.57930915e-11] [ 6.49969245e-11 1.99334160e-11 -3.26783878e-11] [-8.75595152e-11 4.66413019e-11 -4.77965167e-11] [ 2.23382216e-11 7.37343520e-11 -7.44548867e-12] [-6.62252475e-11 -5.24957855e-11 -4.75663953e-12] [ 4.27808899e-11 -1.98084327e-11 6.18657903e-13] [-1.19460965e-02 -4.94457382e-03 -8.99251261e-11] [ 3.94593413e-03 -4.29665080e-03 -5.26963324e-11] [ 1.09295815e-02 6.45099295e-03 -5.87481417e-11] [ 1.19460965e-02 4.94457372e-03 5.95502668e-11] [-3.94593406e-03 4.29665083e-03 5.08249512e-11] [-1.09295816e-02 -6.45099289e-03 4.09521059e-11] [ 3.60569423e-03 9.46111106e-04 2.91043912e-03] [-3.60569422e-03 -9.46111105e-04 2.91043912e-03] [-3.60569422e-03 -9.46111107e-04 -2.91043912e-03] [ 3.60569422e-03 9.46111104e-04 -2.91043912e-03] [ 3.18630870e-04 -3.36088651e-04 -1.11422818e-03] [-3.18630868e-04 3.36088653e-04 -1.11422818e-03] [-3.18630869e-04 3.36088652e-04 1.11422819e-03] [ 3.18630871e-04 -3.36088652e-04 1.11422818e-03]] Final stress: [-7.41214844e-03 -4.25798053e-03 -3.95419704e-03 1.48367438e-13 -3.90919614e-15 -3.17854254e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.40853995e-12 -1.28073318e-04 -3.94857527e-04] [-2.47565022e-12 1.28073320e-04 -3.94857580e-04] [ 2.06184983e-12 1.28073321e-04 3.94857521e-04] [ 1.53044244e-12 -1.28073319e-04 3.94857542e-04] [ 9.30794396e-13 2.50727217e-11 8.13987766e-12] [-2.39230302e-11 -1.37591466e-11 8.76043682e-12] [ 2.28302377e-11 -1.20369270e-11 8.85397311e-12] [ 2.19103869e-13 1.26662014e-11 -9.38138456e-14] [-1.79680715e-11 -8.31862357e-12 -4.74686956e-12] [ 1.58055236e-11 -7.05008274e-12 -2.01122799e-12] [-1.50213175e-12 7.01318959e-04 1.10179832e-11] [-7.91272405e-04 2.63125652e-03 7.44633316e-12] [ 7.91272408e-04 2.63125651e-03 1.21795216e-11] [ 2.22466490e-12 -7.01318977e-04 -2.83704771e-12] [ 7.91272418e-04 -2.63125651e-03 -2.56577946e-12] [-7.91272423e-04 -2.63125650e-03 -2.98756833e-12] [-1.20209398e-13 2.19295083e-03 -1.57433177e-03] [-2.82551760e-14 -2.19295084e-03 -1.57433177e-03] [ 1.07081011e-13 -2.19295084e-03 1.57433177e-03] [ 2.91988655e-13 2.19295084e-03 1.57433177e-03] [-8.94839758e-14 -4.42190789e-03 1.93742215e-03] [ 2.28849600e-13 4.42190789e-03 1.93742215e-03] [ 4.20056622e-13 4.42190789e-03 -1.93742215e-03] [-1.86684002e-13 -4.42190789e-03 -1.93742215e-03]] Final stress: [ 7.63907414e-03 1.37420052e-02 7.30640658e-03 -3.74733390e-15 -1.39702881e-14 -1.57678310e-15] Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 19 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 2.20842784e-02 -1.46595209e-02 4.62088165e-02] [-2.20842982e-02 1.46595413e-02 4.62060070e-02] [-2.20842710e-02 1.46595299e-02 -4.62090462e-02] [ 2.20842927e-02 -1.46595269e-02 -4.62077879e-02] [-1.27125907e-08 1.26963099e-06 4.35922396e-07] [-1.12161952e-06 -6.29391187e-07 4.45242186e-07] [ 1.13647139e-06 -6.52201189e-07 4.14037523e-07] [-2.26996661e-08 4.18395710e-07 -4.60098909e-08] [-3.66027979e-07 -1.91996007e-07 -5.15268260e-08] [ 3.92501656e-07 -2.33116977e-07 -4.49298020e-08] [ 8.28004526e-02 -5.31602256e-02 4.90500201e-07] [-3.01147863e-02 2.48337914e-02 4.98856827e-07] [-7.48724140e-02 -5.08339705e-02 5.11952211e-07] [-8.28004337e-02 5.31598866e-02 -2.29708351e-07] [ 3.01150842e-02 -2.48336358e-02 -2.38376582e-07] [ 7.48720965e-02 5.08341454e-02 -2.39803685e-07] [ 2.82436778e-02 1.28507355e-02 8.74607955e-03] [-2.82436669e-02 -1.28507405e-02 8.74602236e-03] [-2.82436670e-02 -1.28507408e-02 -8.74604872e-03] [ 2.82436669e-02 1.28507396e-02 -8.74600737e-03] [-2.33365232e-02 2.00134473e-03 9.00835297e-03] [ 2.33365200e-02 -2.00134156e-03 9.00830788e-03] [ 2.33365179e-02 -2.00134112e-03 -9.00832083e-03] [-2.33365328e-02 2.00134805e-03 -9.00832139e-03]] Final stress: [ 2.62575042e-03 8.41012510e-03 2.32256666e-03 -1.04354149e-10 8.35680259e-11 1.81360247e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.21537277e-02 -1.46862322e-02 4.63047417e-02] [ 2.21537184e-02 1.46862641e-02 4.63025478e-02] [ 2.21537069e-02 1.46862423e-02 -4.63051848e-02] [-2.21537143e-02 -1.46862783e-02 -4.63030290e-02] [-3.21299969e-08 -3.48094039e-07 -6.26251506e-09] [ 3.40190889e-07 2.09370522e-07 -1.47184265e-08] [-2.95606264e-07 1.46864656e-07 -8.43995154e-09] [-5.06366518e-10 -3.29357511e-07 1.36740091e-07] [ 2.95853737e-07 1.66082244e-07 1.28452011e-07] [-2.88517695e-07 1.61268278e-07 1.25998405e-07] [-8.29743451e-02 -5.32275180e-02 4.58217916e-07] [ 7.49925265e-02 -5.09096170e-02 4.85136679e-07] [ 3.01316118e-02 2.48093822e-02 4.87092165e-07] [ 8.29743699e-02 5.32283559e-02 -2.80827857e-07] [-7.49932993e-02 5.09091834e-02 -3.09174739e-07] [-3.01308614e-02 -2.48097832e-02 -3.41352299e-07] [-2.82754912e-02 1.28817739e-02 8.74355281e-03] [ 2.82754877e-02 -1.28817738e-02 8.74351523e-03] [ 2.82754916e-02 -1.28817751e-02 -8.74355049e-03] [-2.82754814e-02 1.28817743e-02 -8.74348414e-03] [ 2.33701542e-02 2.01405200e-03 9.00751387e-03] [-2.33701671e-02 -2.01405287e-03 9.00750292e-03] [-2.33701589e-02 -2.01405405e-03 -9.00751195e-03] [ 2.33701604e-02 2.01405023e-03 -9.00747493e-03]] Final stress: [ 2.62480749e-03 8.41364424e-03 2.32256957e-03 1.75305004e-11 -2.08686168e-10 -1.81235114e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 6.71026112e-04 -3.41806038e-03 -6.91826758e-04] [-6.71026105e-04 3.41806042e-03 -6.91827887e-04] [-6.71026026e-04 3.41806035e-03 6.91825420e-04] [ 6.71026014e-04 -3.41806049e-03 6.91825441e-04] [-2.21131055e-10 4.12288298e-09 8.38578540e-10] [-3.06539955e-09 -1.78499265e-09 6.87262275e-10] [ 3.39495937e-09 -2.24208685e-09 8.05166489e-10] [ 3.18744503e-10 -7.32119854e-09 1.24076960e-09] [ 5.84893634e-09 3.34139438e-09 1.17307131e-09] [-6.30261654e-09 3.96495958e-09 1.30883927e-09] [ 1.56627021e-02 3.44127153e-03 -2.39974748e-10] [-5.82236059e-03 1.02852773e-02 -1.30251365e-10] [-9.80180018e-03 -9.12026087e-03 -1.29394838e-10] [-1.56627023e-02 -3.44126753e-03 -3.27067695e-10] [ 5.82235737e-03 -1.02852791e-02 -4.03495000e-10] [ 9.80180356e-03 9.12025876e-03 -3.74419430e-10] [-4.73885023e-04 -1.91519408e-03 7.76189539e-04] [ 4.73885012e-04 1.91519408e-03 7.76189571e-04] [ 4.73884998e-04 1.91519406e-03 -7.76189683e-04] [-4.73885012e-04 -1.91519408e-03 -7.76189628e-04] [-2.26708911e-05 -9.58096381e-04 -9.87781272e-04] [ 2.26709072e-05 9.58096386e-04 -9.87781201e-04] [ 2.26709346e-05 9.58096395e-04 9.87780959e-04] [-2.26709230e-05 -9.58096397e-04 9.87781050e-04]] Final stress: [-4.24250519e-03 -7.58738995e-03 -3.87691510e-03 5.33909322e-13 7.87796099e-14 3.28317640e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-6.70519893e-04 -3.42014633e-03 -6.92173520e-04] [ 6.70519822e-04 3.42014647e-03 -6.92167529e-04] [ 6.70519858e-04 3.42014622e-03 6.92176628e-04] [-6.70519816e-04 -3.42014638e-03 6.92170153e-04] [ 4.70493106e-11 -6.65077660e-10 -4.33679259e-10] [ 5.97126015e-10 2.77879685e-10 -3.89611260e-10] [-6.68995581e-10 3.77629428e-10 -4.29239533e-10] [-1.76476056e-11 9.73142233e-10 -6.68497924e-10] [-8.63464633e-10 -4.40169678e-10 -5.84391202e-10] [ 9.20822918e-10 -5.01063468e-10 -6.56844416e-10] [-1.56708054e-02 3.44340971e-03 -1.64359566e-09] [ 9.80656513e-03 -9.12436969e-03 -1.42891841e-09] [ 5.82487463e-03 1.02906893e-02 -1.43250131e-09] [ 1.56708054e-02 -3.44341092e-03 7.50944548e-10] [-9.80656413e-03 9.12437033e-03 7.35731789e-10] [-5.82487557e-03 -1.02906888e-02 7.08694413e-10] [ 4.73904552e-04 -1.91634508e-03 7.76838274e-04] [-4.73904540e-04 1.91634508e-03 7.76838386e-04] [-4.73904536e-04 1.91634507e-03 -7.76838310e-04] [ 4.73904527e-04 -1.91634508e-03 -7.76838476e-04] [ 2.34658667e-05 -9.58832555e-04 -9.88775514e-04] [-2.34658677e-05 9.58832557e-04 -9.88775395e-04] [-2.34658723e-05 9.58832550e-04 9.88775433e-04] [ 2.34658692e-05 -9.58832553e-04 9.88775341e-04]] Final stress: [-4.24255018e-03 -7.58744714e-03 -3.87698101e-03 6.61663506e-13 5.58787529e-14 -3.28317825e-03] Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 76 steps. Minimization converged after 76 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 2.10719076e-03 1.68799432e-03 4.19073341e-04] [-2.10719075e-03 -1.68799431e-03 4.19074969e-04] [-2.10719095e-03 -1.68799429e-03 -4.19049789e-04] [ 2.10719095e-03 1.68799429e-03 -4.19050999e-04] [ 7.54609802e-10 -2.49031547e-08 -7.21960114e-09] [ 2.10096588e-08 1.17168562e-08 -7.24644833e-09] [-2.20545991e-08 1.31919233e-08 -7.23227558e-09] [-3.49626016e-10 1.26794337e-08 -4.52367388e-09] [-1.07215461e-08 -5.99228422e-09 -4.54726334e-09] [ 1.12337085e-08 -6.69440625e-09 -4.53899900e-09] [ 2.34151225e-02 -4.89330338e-03 -2.27781037e-09] [-1.59748212e-02 1.58944966e-02 -2.30888808e-09] [-1.67031790e-02 -2.93216005e-02 -2.28016214e-09] [-2.34151230e-02 4.89331820e-03 -1.76488512e-09] [ 1.59748087e-02 -1.58945036e-02 -1.79051469e-09] [ 1.67031922e-02 2.93215926e-02 -1.77648437e-09] [-5.99972723e-03 5.65266255e-03 1.27375078e-03] [ 5.99972720e-03 -5.65266256e-03 1.27375105e-03] [ 5.99972717e-03 -5.65266255e-03 -1.27375125e-03] [-5.99972720e-03 5.65266254e-03 -1.27375104e-03] [-2.05101193e-03 -5.09984817e-03 6.36188971e-03] [ 2.05101196e-03 5.09984817e-03 6.36188996e-03] [ 2.05101188e-03 5.09984816e-03 -6.36188972e-03] [-2.05101185e-03 -5.09984816e-03 -6.36188950e-03]] Final stress: [-4.04612749e-03 -3.40862614e-03 -7.49046092e-03 2.78007896e-14 -4.69310257e-14 3.07364053e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-2.10583333e-03 1.68965055e-03 4.18220377e-04] [ 2.10583324e-03 -1.68965055e-03 4.18236009e-04] [ 2.10583334e-03 -1.68965053e-03 -4.18221326e-04] [-2.10583340e-03 1.68965055e-03 -4.18221194e-04] [-5.90411791e-10 -1.81849068e-08 -4.97820224e-09] [ 1.61109020e-08 9.66490225e-09 -4.99273806e-09] [-1.52880028e-08 8.51256354e-09 -4.96627514e-09] [-1.33004920e-10 -4.36791114e-09 1.13677190e-09] [ 3.79979270e-09 2.29839259e-09 1.10284659e-09] [-3.62947181e-09 2.04676665e-09 1.12001058e-09] [-2.33916957e-02 -4.88938434e-03 -1.80914717e-09] [ 1.66825656e-02 -2.92852665e-02 -1.80737577e-09] [ 1.59617749e-02 1.58774697e-02 -1.84061149e-09] [ 2.33916961e-02 4.88939498e-03 9.68514482e-10] [-1.66825751e-02 2.92852608e-02 9.59863424e-10] [-1.59617660e-02 -1.58774746e-02 9.97881979e-10] [ 5.99255202e-03 5.64616000e-03 1.27069016e-03] [-5.99255198e-03 -5.64616000e-03 1.27069052e-03] [-5.99255198e-03 -5.64616000e-03 -1.27069037e-03] [ 5.99255200e-03 5.64616000e-03 -1.27069036e-03] [ 2.04733258e-03 -5.09250720e-03 6.35798903e-03] [-2.04733263e-03 5.09250721e-03 6.35798949e-03] [-2.04733260e-03 5.09250721e-03 -6.35798923e-03] [ 2.04733255e-03 -5.09250720e-03 -6.35798900e-03]] Final stress: [-4.04577545e-03 -3.40926381e-03 -7.49017841e-03 3.05537731e-14 2.09690057e-13 -3.07378748e-03] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 108 steps. Minimization converged after 107 steps. Minimization converged after 107 steps. Minimization converged after 107 steps. Minimization converged after 101 steps. Minimization converged after 103 steps. Minimization converged after 101 steps. Minimization converged after 102 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 106 steps. Minimization converged after 105 steps. Minimization converged after 104 steps. Minimization converged after 105 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.31114699e-03 1.96855171e-03 -1.88061038e-03] [ 3.31114699e-03 -1.96855171e-03 -1.88061039e-03] [ 3.31114699e-03 -1.96855171e-03 1.88061036e-03] [-3.31114699e-03 1.96855171e-03 1.88061040e-03] [ 1.02289358e-12 -6.49114096e-12 -8.94839758e-13] [ 5.22330790e-12 2.22909191e-12 -8.17568235e-13] [-6.88904489e-12 4.36606307e-12 -2.05246931e-12] [-4.68458605e-13 1.09623421e-12 1.74982251e-12] [-1.33515421e-12 -9.66726699e-13 1.02395870e-12] [ 1.82465154e-12 -1.02140518e-12 1.09751097e-12] [ 1.90337428e-02 -1.30397814e-03 7.29447324e-12] [-1.69160565e-02 9.71716988e-03 6.01427903e-12] [-9.31455630e-03 -1.07856325e-02 7.08968695e-12] [-1.90337428e-02 1.30397812e-03 -3.33429511e-12] [ 1.69160565e-02 -9.71716987e-03 -3.17131594e-12] [ 9.31455628e-03 1.07856325e-02 -3.60272523e-12] [-7.07454540e-03 3.85939057e-04 -8.28622472e-04] [ 7.07454540e-03 -3.85939058e-04 -8.28622473e-04] [ 7.07454540e-03 -3.85939058e-04 8.28622473e-04] [-7.07454540e-03 3.85939058e-04 8.28622473e-04] [ 2.76944074e-03 -4.31475053e-03 1.13363429e-03] [-2.76944074e-03 4.31475053e-03 1.13363429e-03] [-2.76944074e-03 4.31475053e-03 -1.13363429e-03] [ 2.76944074e-03 -4.31475053e-03 -1.13363429e-03]] Final stress: [-2.66047755e-04 -3.35754655e-04 -1.02742636e-04 -1.77609967e-15 -4.61292553e-15 6.42022353e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 3.31115578e-03 1.96856440e-03 -1.88058692e-03] [-3.31115578e-03 -1.96856440e-03 -1.88058690e-03] [-3.31115578e-03 -1.96856440e-03 1.88058684e-03] [ 3.31115578e-03 1.96856440e-03 1.88058688e-03] [-2.12958557e-13 1.26444966e-11 5.00433028e-12] [-1.11303744e-11 -5.98383842e-12 4.79674633e-12] [ 1.12743148e-11 -6.62098154e-12 5.07835440e-12] [-2.06473727e-12 -3.48718832e-11 1.36644029e-11] [ 3.12241344e-11 1.91190397e-11 1.37105882e-11] [-2.92594282e-11 1.61507474e-11 1.46838965e-11] [-1.90337685e-02 -1.30400694e-03 8.37156541e-12] [ 9.31458978e-03 -1.07856134e-02 8.31777447e-12] [ 1.69160638e-02 9.71716828e-03 8.73856317e-12] [ 1.90337685e-02 1.30400690e-03 4.14037114e-12] [-9.31458974e-03 1.07856134e-02 4.40377673e-12] [-1.69160639e-02 -9.71716826e-03 5.64352501e-12] [ 7.07454459e-03 3.85945864e-04 -8.28621425e-04] [-7.07454459e-03 -3.85945864e-04 -8.28621425e-04] [-7.07454459e-03 -3.85945864e-04 8.28621426e-04] [ 7.07454459e-03 3.85945864e-04 8.28621426e-04] [-2.76944423e-03 -4.31475362e-03 1.13362712e-03] [ 2.76944423e-03 4.31475362e-03 1.13362712e-03] [ 2.76944423e-03 4.31475362e-03 -1.13362712e-03] [-2.76944423e-03 -4.31475362e-03 -1.13362712e-03]] Final stress: [-2.66048158e-04 -3.35754423e-04 -1.02742475e-04 -2.56136596e-15 1.78021101e-15 -6.42022356e-03] Minimization converged after 30 steps. Minimization converged after 22 steps. Minimization converged after 8 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 9 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 19 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.68632277e-03 5.05470182e-03 5.70260118e-04] [ 1.68632278e-03 -5.05470182e-03 5.70260236e-04] [ 1.68632277e-03 -5.05470182e-03 -5.70260561e-04] [-1.68632277e-03 5.05470182e-03 -5.70259686e-04] [ 1.96285770e-11 -8.12306389e-10 -2.10788942e-10] [ 6.70392103e-10 3.84775323e-10 -2.04481432e-10] [-6.99636682e-10 4.23423685e-10 -2.11693857e-10] [ 9.13553261e-12 -5.81695359e-10 1.60090829e-10] [ 4.88009189e-10 2.81209556e-10 1.62006408e-10] [-4.99870423e-10 2.99482661e-10 1.60470096e-10] [-3.57794065e-03 -1.06585449e-03 7.03859953e-11] [-3.12909078e-03 2.19618546e-03 7.42897686e-11] [-4.97606759e-05 -7.78701293e-04 7.18785300e-11] [ 3.57794064e-03 1.06585509e-03 -6.39442826e-11] [ 3.12909029e-03 -2.19618575e-03 -6.39915021e-11] [ 4.97611883e-05 7.78700980e-04 -6.43232351e-11] [-2.05401300e-03 -6.75776755e-04 -4.47962598e-04] [ 2.05401300e-03 6.75776754e-04 -4.47962597e-04] [ 2.05401300e-03 6.75776754e-04 4.47962589e-04] [-2.05401300e-03 -6.75776755e-04 4.47962609e-04] [ 1.18227428e-03 5.83858451e-04 1.38808041e-03] [-1.18227428e-03 -5.83858450e-04 1.38808042e-03] [-1.18227428e-03 -5.83858450e-04 -1.38808043e-03] [ 1.18227428e-03 5.83858452e-04 -1.38808040e-03]] Final stress: [4.37363693e-03 2.46084274e-03 2.27885417e-03 1.00690314e-14 1.01017895e-14 1.91153302e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.68616810e-03 5.05469807e-03 5.70272130e-04] [-1.68616810e-03 -5.05469808e-03 5.70271018e-04] [-1.68616810e-03 -5.05469808e-03 -5.70271491e-04] [ 1.68616810e-03 5.05469807e-03 -5.70271603e-04] [-8.41507419e-13 4.63381000e-11 5.37448419e-11] [-3.58511554e-11 -2.21863916e-11 5.24462973e-11] [ 3.58436059e-11 -2.26215713e-11 5.26135524e-11] [ 8.27282687e-13 9.33690902e-11 -6.79445389e-11] [-8.30782110e-11 -4.83935114e-11 -6.86720680e-11] [ 8.09024792e-11 -4.53843074e-11 -6.87886692e-11] [ 3.57809612e-03 -1.06621571e-03 8.78577609e-11] [ 4.96629466e-05 -7.78751377e-04 8.89376225e-11] [ 3.12872717e-03 2.19658351e-03 8.85837616e-11] [-3.57809610e-03 1.06621696e-03 -9.10217462e-11] [-4.96640108e-05 7.78750733e-04 -9.08463813e-11] [-3.12872614e-03 -2.19658410e-03 -9.16217403e-11] [ 2.05400620e-03 -6.75774368e-04 -4.47941552e-04] [-2.05400619e-03 6.75774368e-04 -4.47941544e-04] [-2.05400619e-03 6.75774367e-04 4.47941532e-04] [ 2.05400620e-03 -6.75774368e-04 4.47941564e-04] [-1.18225848e-03 5.83872055e-04 1.38809010e-03] [ 1.18225848e-03 -5.83872055e-04 1.38809010e-03] [ 1.18225848e-03 -5.83872055e-04 -1.38809011e-03] [-1.18225848e-03 5.83872055e-04 -1.38809009e-03]] Final stress: [ 4.37363783e-03 2.46084268e-03 2.27885478e-03 4.45101144e-15 -7.07985168e-15 -1.91153376e-03] Minimization converged after 76 steps. Minimization converged after 77 steps. Minimization converged after 30 steps. Minimization converged after 24 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 26 steps. Minimization converged after 20 steps. Minimization converged after 45 steps. Minimization converged after 44 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 6.78849239e-03 5.95865869e-03 -1.35264246e-03] [-6.78849238e-03 -5.95865870e-03 -1.35264130e-03] [-6.78849238e-03 -5.95865869e-03 1.35264083e-03] [ 6.78849239e-03 5.95865869e-03 1.35264299e-03] [ 2.08396399e-11 -9.49290035e-10 -3.21579319e-10] [ 8.27531307e-10 4.57459022e-10 -3.28562372e-10] [-8.62857619e-10 5.03070197e-10 -3.29449135e-10] [ 3.76507506e-12 -5.59288837e-10 2.54765764e-10] [ 4.89630780e-10 2.76777434e-10 2.56080046e-10] [-4.97529407e-10 2.87535107e-10 2.51973695e-10] [ 1.17261992e-03 -2.40950269e-03 1.14192955e-10] [-5.79153790e-03 2.37234361e-03 1.07587883e-10] [ 1.24960604e-03 4.56829019e-03 1.10064431e-10] [-1.17261989e-03 2.40950088e-03 -6.56467840e-11] [ 5.79153948e-03 -2.37234274e-03 -6.90847142e-11] [-1.24960765e-03 -4.56828926e-03 -6.71599216e-11] [-1.07650659e-03 1.13745967e-03 5.48134699e-04] [ 1.07650659e-03 -1.13745967e-03 5.48134660e-04] [ 1.07650659e-03 -1.13745967e-03 -5.48134666e-04] [-1.07650659e-03 1.13745967e-03 -5.48134682e-04] [ 1.88812539e-03 -5.33547942e-04 -1.68775079e-03] [-1.88812538e-03 5.33547940e-04 -1.68775079e-03] [-1.88812539e-03 5.33547941e-04 1.68775080e-03] [ 1.88812539e-03 -5.33547943e-04 1.68775081e-03]] Final stress: [ 2.35673030e-03 4.21704635e-03 2.16024519e-03 -2.38028790e-14 1.83855026e-14 1.80233595e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.78808277e-03 5.95788070e-03 -1.35256785e-03] [ 6.78808278e-03 -5.95788070e-03 -1.35256965e-03] [ 6.78808278e-03 -5.95788069e-03 1.35256854e-03] [-6.78808279e-03 5.95788071e-03 1.35256850e-03] [ 1.14023409e-11 6.14714391e-10 2.20921392e-10] [-5.55834073e-10 -3.23588982e-10 2.22701829e-10] [ 5.43004308e-10 -2.99178571e-10 2.31746372e-10] [ 7.54582508e-12 5.35881339e-10 -1.54449009e-10] [-5.00177233e-10 -2.82956658e-10 -1.63642877e-10] [ 4.81453460e-10 -2.63761180e-10 -1.60684851e-10] [-1.17228200e-03 -2.40932312e-03 2.01496376e-10] [-1.24920885e-03 4.56769882e-03 1.93939161e-10] [ 5.79112848e-03 2.37211672e-03 1.97678754e-10] [ 1.17228201e-03 2.40932378e-03 -1.21620281e-10] [ 1.24920826e-03 -4.56769916e-03 -1.21580452e-10] [-5.79112790e-03 -2.37211704e-03 -1.04646704e-10] [ 1.07652998e-03 1.13745129e-03 5.48099179e-04] [-1.07652998e-03 -1.13745129e-03 5.48099168e-04] [-1.07652998e-03 -1.13745129e-03 -5.48099181e-04] [ 1.07652998e-03 1.13745129e-03 -5.48099150e-04] [-1.88809557e-03 -5.33630288e-04 -1.68772299e-03] [ 1.88809557e-03 5.33630289e-04 -1.68772301e-03] [ 1.88809557e-03 5.33630290e-04 1.68772300e-03] [-1.88809557e-03 -5.33630287e-04 1.68772301e-03]] Final stress: [ 2.35672856e-03 4.21705003e-03 2.16024816e-03 -5.59140397e-14 3.35770872e-15 -1.80233562e-03] Minimization converged after 72 steps. Minimization converged after 72 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 48 steps. Minimization converged after 49 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-1.04695183e-02 1.58259449e-03 1.76728463e-02] [ 1.04696979e-02 -1.58260338e-03 1.77342774e-02] [ 1.04693725e-02 -1.58278887e-03 -1.77148973e-02] [-1.04695521e-02 1.58246710e-03 -1.77117629e-02] [ 3.55157284e-07 -1.84101873e-05 -4.54030510e-06] [ 1.62213374e-05 8.91072278e-06 -4.39623191e-06] [-1.68550153e-05 9.68983993e-06 -4.52401178e-06] [-2.03501778e-07 -7.44962229e-06 5.65248509e-06] [ 6.97608659e-06 4.01605036e-06 5.88785841e-06] [-6.69160148e-06 3.61557812e-06 5.61115345e-06] [ 7.81370368e-02 8.27375301e-03 -3.10286321e-06] [-5.10323891e-02 9.12462469e-02 -2.94047421e-06] [-3.86269885e-02 -1.03808407e-01 -2.98992093e-06] [-7.81365737e-02 -8.31609099e-03 7.51699161e-06] [ 5.10689294e-02 -9.12256215e-02 7.69075837e-06] [ 3.85898711e-02 1.03829937e-01 7.44946848e-06] [ 5.84471034e-03 2.32400649e-02 -3.01793987e-02] [-5.84468923e-03 -2.32400003e-02 -3.01791843e-02] [-5.84457499e-03 -2.32399155e-02 3.01804638e-02] [ 5.84474014e-03 2.32400694e-02 3.01791288e-02] [-4.98178055e-03 -1.30304375e-03 1.26438443e-02] [ 4.98178021e-03 1.30299881e-03 1.26442941e-02] [ 4.98177314e-03 1.30301721e-03 -1.26433119e-02] [-4.98164755e-03 -1.30305085e-03 -1.26436145e-02]] Final stress: [ 1.43734422e-03 3.07563174e-03 4.82465253e-03 1.98624800e-10 -1.85461441e-09 1.58054739e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.07035780e-02 1.52358790e-03 1.82506283e-02] [-1.07038233e-02 -1.52337919e-03 1.83216464e-02] [-1.07034841e-02 -1.52370252e-03 -1.82306023e-02] [ 1.07038272e-02 1.52322893e-03 -1.82962094e-02] [-2.97282456e-07 -2.38240492e-05 -7.29225225e-06] [ 2.11680225e-05 1.22963314e-05 -7.03371871e-06] [-2.07727489e-05 1.17222486e-05 -7.20408155e-06] [ 2.75583243e-08 1.57580070e-06 -2.57719590e-06] [-1.49825637e-06 -8.34347073e-07 -2.55631437e-06] [ 1.34570223e-06 -7.12982457e-07 -2.44778677e-06] [-7.93529805e-02 8.24353071e-03 -1.49598729e-05] [ 3.93107094e-02 -1.06271630e-01 -1.46212708e-05] [ 5.22039704e-02 9.34618515e-02 -1.51253214e-05] [ 7.93533102e-02 -8.22604399e-03 9.91686642e-06] [-3.93260057e-02 1.06262735e-01 9.75115028e-06] [-5.21890812e-02 -9.34702934e-02 9.98977016e-06] [-6.16061874e-03 2.38190558e-02 -3.07636118e-02] [ 6.16088653e-03 -2.38192171e-02 -3.07614951e-02] [ 6.16075432e-03 -2.38191268e-02 3.07628228e-02] [-6.16084534e-03 2.38191883e-02 3.07613043e-02] [ 5.35023065e-03 -1.28556044e-03 1.28921072e-02] [-5.35016192e-03 1.28553332e-03 1.28933782e-02] [-5.35025273e-03 1.28555524e-03 -1.28926671e-02] [ 5.35001390e-03 -1.28553620e-03 -1.28931416e-02]] Final stress: [ 1.44992562e-03 3.11376458e-03 4.84156051e-03 2.96983560e-10 4.99354879e-09 -1.56652732e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 2.01789175e-03 -1.88070611e-03 -3.28480363e-04] [-2.01789219e-03 1.88070606e-03 -3.28521371e-04] [-2.01789215e-03 1.88070611e-03 3.28554611e-04] [ 2.01789164e-03 -1.88070598e-03 3.28454934e-04] [-8.90784366e-10 4.60820498e-08 1.48572544e-08] [-3.92932429e-08 -2.21194478e-08 1.49959039e-08] [ 4.08353271e-08 -2.40465008e-08 1.49025181e-08] [-8.31467934e-10 4.96637826e-08 -1.64474597e-08] [-4.19712953e-08 -2.39230256e-08 -1.65432301e-08] [ 4.33466136e-08 -2.56663263e-08 -1.62299955e-08] [ 1.36685125e-02 -1.17932083e-03 -5.71729460e-09] [-9.59293209e-03 8.47975502e-03 -5.89572723e-09] [-1.30182792e-02 -1.71907838e-02 -5.78454230e-09] [-1.36685130e-02 1.17935827e-03 4.72512242e-09] [ 9.59290008e-03 -8.47977319e-03 4.79904164e-09] [ 1.30183119e-02 1.71907646e-02 4.78236140e-09] [-5.85541943e-03 8.48052757e-04 2.21814370e-03] [ 5.85541942e-03 -8.48052812e-04 2.21814487e-03] [ 5.85541944e-03 -8.48052778e-04 -2.21814428e-03] [-5.85541937e-03 8.48052750e-04 -2.21814444e-03] [-2.49594899e-03 -3.57977252e-03 5.28616814e-03] [ 2.49594870e-03 3.57977251e-03 5.28616759e-03] [ 2.49594873e-03 3.57977251e-03 -5.28616720e-03] [-2.49594895e-03 -3.57977251e-03 -5.28616862e-03]] Final stress: [-2.55792904e-03 -2.20034768e-03 -4.83286779e-03 -3.66504334e-13 -1.28720363e-12 1.85972307e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-2.01791813e-03 -1.88081247e-03 -3.28567950e-04] [ 2.01791749e-03 1.88081248e-03 -3.28453452e-04] [ 2.01791782e-03 1.88081242e-03 3.28505617e-04] [-2.01791825e-03 -1.88081263e-03 3.28577743e-04] [-1.36139559e-09 -7.78305017e-08 -2.59909164e-08] [ 6.87676112e-08 4.04352212e-08 -2.59577352e-08] [-6.64503497e-08 3.75207092e-08 -2.63349232e-08] [-3.51885840e-10 -2.39246420e-08 1.00804247e-08] [ 2.10110114e-08 1.23720069e-08 1.00446560e-08] [-2.03480228e-08 1.15739279e-08 1.01832205e-08] [-1.36685793e-02 -1.17921092e-03 -6.26616984e-09] [ 1.30185081e-02 -1.71908848e-02 -6.19189140e-09] [ 9.59283947e-03 8.47966640e-03 -6.15709413e-09] [ 1.36685779e-02 1.17913044e-03 1.49444364e-09] [-1.30184376e-02 1.71909263e-02 1.41598341e-09] [-9.59290828e-03 -8.47962747e-03 1.38146969e-09] [ 5.85540660e-03 8.48047911e-04 2.21818002e-03] [-5.85540659e-03 -8.48047857e-04 2.21817933e-03] [-5.85540657e-03 -8.48047868e-04 -2.21817908e-03] [ 5.85540653e-03 8.48047909e-04 -2.21818074e-03] [ 2.49597552e-03 -3.57979978e-03 5.28617571e-03] [-2.49597575e-03 3.57979979e-03 5.28617686e-03] [-2.49597561e-03 3.57979978e-03 -5.28617614e-03] [ 2.49597534e-03 -3.57979978e-03 -5.28617561e-03]] Final stress: [-2.55792998e-03 -2.20034628e-03 -4.83287018e-03 7.27895460e-13 5.21093236e-13 -1.85972185e-03] Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 111 steps. Minimization converged after 111 steps. Minimization converged after 110 steps. Minimization converged after 107 steps. Minimization converged after 101 steps. Minimization converged after 103 steps. Minimization converged after 101 steps. Minimization converged after 102 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 108 steps. Minimization converged after 108 steps. Minimization converged after 106 steps. Minimization converged after 107 steps. Minimization converged after 68 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-6.49477694e-12 3.08846942e-03 2.86322629e-03] [-1.68255646e-10 -3.08846929e-03 2.86322953e-03] [ 3.19904849e-11 -3.08846932e-03 -2.86322533e-03] [-3.08398029e-11 3.08846946e-03 -2.86322805e-03] [-8.41885183e-11 -1.98319861e-10 -2.75366063e-10] [ 5.27567712e-11 1.42988753e-10 -2.07171724e-10] [ 1.49262769e-10 -7.49286744e-11 -3.92574584e-11] [-1.62826238e-11 5.18018961e-11 -1.37270417e-10] [-1.16455956e-10 -3.65643071e-11 -2.02324935e-10] [ 1.08667075e-10 -4.85749774e-11 -1.62010690e-10] [-1.19133592e-10 -1.96457099e-03 -7.25412010e-10] [ 5.29960095e-03 -1.35531673e-03 -8.29149153e-10] [-5.29960072e-03 -1.35531701e-03 -6.53524581e-10] [-5.22997201e-11 1.96456975e-03 3.20068078e-10] [-5.29960025e-03 1.35531746e-03 3.26486013e-10] [ 5.29960033e-03 1.35531735e-03 3.11941466e-10] [-1.60273461e-11 -7.16595140e-05 -1.19396070e-03] [-2.57821542e-12 7.16595192e-05 -1.19396064e-03] [-9.17926846e-12 7.16595253e-05 1.19396067e-03] [ 6.82448542e-12 -7.16595130e-05 1.19396059e-03] [-1.53971835e-11 2.11486081e-03 3.09621840e-03] [-9.43668563e-12 -2.11486078e-03 3.09621845e-03] [-2.56124908e-12 -2.11486079e-03 -3.09621845e-03] [-1.23100419e-11 2.11486082e-03 -3.09621850e-03]] Final stress: [ 5.38603778e-03 3.16531358e-03 2.84555222e-03 -1.27354502e-13 -4.92151057e-13 -1.82037271e-15] Minimization converged after 20 steps. Minimization converged after 8 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 7 steps. Minimization converged after 29 steps. Minimization converged after 32 steps. Minimization converged after 26 steps. Minimization converged after 19 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-4.56265487e-04 -1.01905881e-03 -2.51611840e-04] [-4.56262988e-04 1.01905886e-03 -2.51393627e-04] [ 4.56266317e-04 1.01905929e-03 2.51615577e-04] [ 4.56263062e-04 -1.01905859e-03 2.51420243e-04] [ 3.60841865e-10 -1.07232096e-08 -5.46251067e-09] [ 7.00510681e-09 4.67175330e-09 -4.45848308e-09] [-7.55696872e-09 5.40681394e-09 -4.90033900e-09] [ 2.21455118e-10 -6.01171868e-09 3.23187477e-10] [ 4.69500538e-09 2.57897204e-09 -2.83827850e-10] [-5.45265233e-09 3.26404642e-09 4.05002330e-10] [ 2.62075639e-10 2.43996254e-03 -3.93484536e-08] [-4.53604980e-04 2.03858537e-03 4.97958249e-04] [ 4.53601822e-04 2.03858743e-03 -4.98037253e-04] [-2.24933627e-10 -2.43996811e-03 3.50385848e-08] [ 4.53609425e-04 -2.03858280e-03 -4.97963536e-04] [-4.53606731e-04 -2.03858455e-03 4.98032753e-04] [ 1.56308996e-03 2.25180268e-06 -5.39084829e-04] [ 1.56308952e-03 -2.25151539e-06 -5.39080089e-04] [-1.56308986e-03 -2.25163614e-06 5.39084451e-04] [-1.56308943e-03 2.25155209e-06 5.39079597e-04] [-2.59756511e-03 -1.74592539e-03 -1.46073208e-03] [-2.59756541e-03 1.74592554e-03 -1.46072855e-03] [ 2.59756516e-03 1.74592536e-03 1.46073145e-03] [ 2.59756543e-03 -1.74592552e-03 1.46072817e-03]] Final stress: [-2.76686780e-03 -1.83591465e-03 -1.23094321e-03 6.68376823e-12 -1.57850031e-03 2.16304408e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 4.56647312e-04 -1.01882774e-03 -2.51045074e-04] [ 4.56646653e-04 1.01882694e-03 -2.51032298e-04] [-4.56648857e-04 1.01882721e-03 2.51086628e-04] [-4.56649013e-04 -1.01882680e-03 2.51071520e-04] [-3.03604873e-10 2.68277214e-08 -6.30020092e-10] [-2.34443977e-08 -1.30002533e-08 -9.85051651e-10] [ 2.47516990e-08 -1.40959009e-08 1.43888484e-10] [-1.35009461e-09 2.94329272e-09 -7.61841190e-09] [-1.30142674e-10 3.49602458e-10 -5.94720495e-09] [ 2.95227587e-09 -2.82740203e-09 -8.06676466e-09] [-8.40025993e-10 2.43929319e-03 -1.05933672e-08] [-4.53419306e-04 2.03857838e-03 -4.97633704e-04] [ 4.53421660e-04 2.03857607e-03 4.97611844e-04] [-6.36978137e-10 -2.43933007e-03 -6.27959776e-09] [ 4.53454316e-04 -2.03855781e-03 4.97616585e-04] [-4.53452672e-04 -2.03855950e-03 -4.97627680e-04] [-1.56335005e-03 2.28880804e-06 -5.39024809e-04] [-1.56334994e-03 -2.28891837e-06 -5.39025081e-04] [ 1.56334971e-03 -2.28881560e-06 5.39023765e-04] [ 1.56334974e-03 2.28877835e-06 5.39022837e-04] [ 2.59694091e-03 -1.74589958e-03 -1.46040640e-03] [ 2.59694080e-03 1.74589959e-03 -1.46040666e-03] [-2.59694104e-03 1.74589948e-03 1.46040461e-03] [-2.59694122e-03 -1.74589942e-03 1.46040389e-03]] Final stress: [-2.76686362e-03 -1.83588559e-03 -1.23094323e-03 -2.79958682e-12 1.57847086e-03 -1.59727531e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 8.41609085e-03 1.90794187e-02 4.63570463e-03] [-8.41593959e-03 -1.90793592e-02 4.65436220e-03] [-8.41612242e-03 -1.90794354e-02 -4.63964013e-03] [ 8.41601017e-03 1.90794324e-02 -4.65090750e-03] [ 7.76203772e-08 -2.55173744e-06 -1.00672360e-06] [ 1.89958473e-06 1.14635277e-06 -8.88315349e-07] [-2.04674094e-06 1.32003982e-06 -9.55845312e-07] [ 2.18557229e-08 -7.10940810e-06 1.65028426e-06] [ 6.19772682e-06 3.54740906e-06 1.74424424e-06] [-6.21635722e-06 3.58382200e-06 1.66372853e-06] [ 3.67832970e-02 2.42255781e-02 -2.95359288e-06] [ 2.30169045e-02 1.94285887e-02 -2.87771440e-06] [-4.32510680e-02 -1.29861840e-02 -2.97575217e-06] [-3.67834050e-02 -2.42213785e-02 2.49483020e-06] [-2.30204814e-02 -1.94306322e-02 2.43039323e-06] [ 4.32547432e-02 1.29839977e-02 2.50020297e-06] [ 3.43521662e-04 1.72885358e-03 -1.30024064e-03] [-3.43571303e-04 -1.72888518e-03 -1.29978702e-03] [-3.43527779e-04 -1.72884704e-03 1.30009535e-03] [ 3.43541987e-04 1.72886645e-03 1.29982226e-03] [-5.75282834e-04 -2.50240070e-03 4.58660814e-03] [ 5.75291225e-04 2.50241340e-03 4.58694233e-03] [ 5.75340457e-04 2.50243592e-03 -4.58685231e-03] [-5.75276394e-04 -2.50239919e-03 -4.58693306e-03]] Final stress: [ 2.19308657e-03 1.30082263e-03 9.61409160e-04 -3.94684835e-10 -5.63029178e-10 1.33259419e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-8.37761178e-03 1.90753285e-02 4.63142084e-03] [ 8.37744384e-03 -1.90753093e-02 4.64783768e-03] [ 8.37756711e-03 -1.90753788e-02 -4.62813517e-03] [-8.37741042e-03 1.90752240e-02 -4.64100754e-03] [ 1.38717712e-07 -6.37744394e-07 -8.30206433e-07] [ 6.88728315e-07 2.26955905e-07 -8.97708535e-07] [-9.10030128e-07 5.13709258e-07 -1.02650049e-06] [-1.36591529e-07 9.27841140e-07 -6.89690090e-07] [-6.40922240e-07 -2.97316147e-07 -5.84346884e-07] [ 8.92887441e-07 -6.02227922e-07 -7.47488001e-07] [-3.68035144e-02 2.42310054e-02 -3.50682642e-06] [ 4.32451218e-02 -1.29653905e-02 -3.48806497e-06] [-2.30078850e-02 1.94845381e-02 -3.33797949e-06] [ 3.68034751e-02 -2.42351432e-02 1.89891083e-06] [-4.32414872e-02 1.29675040e-02 1.87177284e-06] [ 2.30042857e-02 -1.94824776e-02 1.78889550e-06] [-3.58251674e-04 1.71042661e-03 -1.26581512e-03] [ 3.58267854e-04 -1.71044976e-03 -1.26552462e-03] [ 3.58274469e-04 -1.71044457e-03 1.26572944e-03] [-3.58316374e-04 1.71046030e-03 1.26530716e-03] [ 5.90258374e-04 -2.49492707e-03 4.58516317e-03] [-5.90231521e-04 2.49490582e-03 4.58534203e-03] [-5.90258480e-04 2.49491817e-03 -4.58527040e-03] [ 5.90239654e-04 -2.49492123e-03 -4.58549822e-03]] Final stress: [ 2.19442353e-03 1.30031443e-03 9.59886979e-04 -6.24811765e-11 3.89641873e-10 -1.33280174e-03] Minimization converged after 81 steps. Minimization converged after 81 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-2.22077912e-12 -4.97372732e-04 -1.46928471e-05] [-4.60683786e-11 4.97372717e-04 -1.46915684e-05] [-1.31591796e-11 4.97372807e-04 1.46932664e-05] [-3.65449615e-11 -4.97372727e-04 1.46921561e-05] [-5.55968177e-11 7.17487181e-12 -4.24661417e-11] [ 1.91104771e-11 6.65978939e-11 -9.71593916e-11] [ 1.20205512e-10 -7.78727083e-11 1.63863645e-11] [-1.09863045e-11 -2.67866951e-10 -2.39912534e-11] [ 2.93562397e-10 1.42170831e-10 -3.49597018e-11] [-2.68949002e-10 1.14438514e-10 -5.31720813e-11] [-1.79595228e-11 1.00603385e-03 -2.68400675e-10] [-1.60789480e-04 8.66217810e-04 -3.59280050e-10] [ 1.60789521e-04 8.66217766e-04 -3.49608317e-10] [ 6.63485933e-12 -1.00603455e-03 1.04742912e-10] [ 1.60789921e-04 -8.66217475e-04 9.64641829e-11] [-1.60789926e-04 -8.66217464e-04 1.07720698e-10] [-6.57096599e-12 1.09444154e-03 -1.18897655e-03] [-9.94315741e-13 -1.09444154e-03 -1.18897654e-03] [-6.91269264e-12 -1.09444154e-03 1.18897654e-03] [-7.87009347e-13 1.09444154e-03 1.18897650e-03] [-2.60597099e-12 -1.22085486e-03 2.26337202e-03] [-2.33258866e-12 1.22085487e-03 2.26337206e-03] [ 2.66705982e-13 1.22085487e-03 -2.26337207e-03] [-5.21394039e-12 -1.22085486e-03 -2.26337207e-03]] Final stress: [ 3.12176914e-03 5.51559798e-03 2.90233555e-03 -2.41455054e-13 4.62251946e-15 -9.58968252e-15] Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.26366750e-10 -6.30361700e-05 1.23936794e-05] [ 5.38156366e-11 6.30363840e-05 1.23883757e-05] [-6.22970882e-11 6.30363764e-05 -1.23926943e-05] [ 2.94469726e-11 -6.30363274e-05 -1.23846224e-05] [ 1.07670844e-10 -2.39468073e-09 -7.29491412e-10] [ 1.62552354e-09 1.03187744e-09 -5.78682879e-10] [-1.83149423e-09 1.27844590e-09 -7.03546915e-10] [-1.38045327e-10 1.30009736e-09 -3.01110359e-10] [-1.16733956e-09 -5.13050935e-10 -2.57219024e-10] [ 1.53817187e-09 -8.79700868e-10 -5.68842872e-10] [ 5.88007421e-11 1.77871828e-04 9.55205990e-10] [-1.48855763e-04 4.52425804e-04 9.38898214e-10] [ 1.48855657e-04 4.52425933e-04 9.41813035e-10] [-4.95825603e-13 -1.77875354e-04 -1.37165129e-09] [ 1.48858188e-04 -4.52424197e-04 -1.50316343e-09] [-1.48858160e-04 -4.52424211e-04 -1.54372992e-09] [ 1.24829869e-11 3.97663009e-04 4.73324259e-04] [-1.63155600e-11 -3.97662978e-04 4.73324043e-04] [ 1.50910395e-11 -3.97662976e-04 -4.73324235e-04] [-1.53349000e-11 3.97663001e-04 -4.73324133e-04] [-3.45262707e-12 -6.28692243e-04 -9.69190405e-04] [ 1.30341213e-13 6.28692272e-04 -9.69190516e-04] [-1.02031285e-11 6.28692275e-04 9.69190425e-04] [ 7.94225796e-12 -6.28692249e-04 9.69190545e-04]] Final stress: [ 3.03823008e-03 4.21681696e-03 4.12857608e-03 3.42506207e-13 -1.15018238e-13 -3.99482512e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-6.83958445e-12 -4.83596346e-05 -3.40322185e-04] [-5.05271349e-11 4.83594740e-05 -3.40318708e-04] [ 9.56479756e-12 4.83596718e-05 3.40321548e-04] [-5.16423015e-11 -4.83596199e-05 3.40317561e-04] [-1.07023511e-10 -2.94648861e-10 1.57474866e-10] [ 3.67131048e-10 2.89654918e-10 2.93036151e-11] [-1.29393662e-10 2.86149437e-11 2.05565703e-10] [-4.46817733e-11 6.14043483e-10 5.10098630e-11] [-5.85715920e-10 -2.80797496e-10 1.62280189e-11] [ 6.65277777e-10 -3.77450793e-10 -2.79438417e-11] [ 5.73842640e-11 1.53096585e-04 -3.51227853e-10] [ 3.70034385e-04 2.22477577e-04 -5.43695651e-10] [-3.70034472e-04 2.22477693e-04 -5.12098170e-10] [ 3.61500829e-11 -1.53096126e-04 8.37182767e-10] [-3.70034333e-04 -2.22477820e-04 8.44161813e-10] [ 3.70034284e-04 -2.22477746e-04 8.59008685e-10] [-1.39443734e-11 2.48472335e-04 4.24967072e-05] [-4.70407047e-12 -2.48472337e-04 4.24967940e-05] [-1.29685707e-11 -2.48472338e-04 -4.24966695e-05] [-4.21127022e-12 2.48472353e-04 -4.24967518e-05] [ 5.44614354e-12 -3.16721368e-04 2.01140905e-04] [ 3.50467973e-13 3.16721340e-04 2.01140963e-04] [ 3.49352399e-12 3.16721346e-04 -2.01140831e-04] [ 2.79642975e-12 -3.16721366e-04 -2.01140898e-04]] Final stress: [ 1.23368509e-04 1.34605027e-03 -1.29838397e-03 -5.75462299e-13 -4.52302954e-14 6.82071869e-15] Minimization converged after 26 steps. Minimization converged after 20 steps. Minimization converged after 58 steps. Minimization converged after 57 steps. Minimization converged after 49 steps. Minimization converged after 48 steps. Minimization converged after 38 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 27 steps. Final forces: [[-3.49327094e-04 -1.36242285e-04 2.16022628e-03] [ 3.49434375e-04 1.36176509e-04 2.18720367e-03] [ 3.49255841e-04 1.36200938e-04 -2.15910729e-03] [-3.49463458e-04 -1.36068790e-04 -2.18337457e-03] [-3.10263179e-09 -4.64618382e-06 -1.50503083e-06] [ 3.63782013e-06 2.26542659e-06 -1.36099969e-06] [-3.58355911e-06 2.22791865e-06 -1.22280003e-06] [-6.72761842e-08 -5.14999383e-06 8.57318619e-07] [ 4.68306309e-06 2.68687871e-06 9.81566926e-07] [-4.49276346e-06 2.49996014e-06 7.40060827e-07] [ 9.36974072e-03 -7.10483316e-04 -5.08565519e-06] [-5.05384938e-03 4.47152158e-03 -5.12353766e-06] [-5.36043842e-03 -1.29061572e-02 -5.19816074e-06] [-9.36976421e-03 7.19148194e-04 4.06962812e-06] [ 5.04627073e-03 -4.47584193e-03 4.10166663e-06] [ 5.36797039e-03 1.29018486e-02 4.20508116e-06] [ 3.44045706e-03 1.57285142e-03 -5.86358519e-04] [-3.44053694e-03 -1.57281330e-03 -5.85582167e-04] [-3.44049593e-03 -1.57280221e-03 5.86106314e-04] [ 3.44048679e-03 1.57281764e-03 5.85636505e-04] [-2.32985639e-04 -8.78854548e-04 5.42902846e-04] [ 2.32987193e-04 8.78850595e-04 5.43436241e-04] [ 2.33037212e-04 8.78827005e-04 -5.43177652e-04] [-2.32953422e-04 -8.78862847e-04 -5.43370788e-04]] Final stress: [ 1.03502454e-03 2.53750485e-03 9.88022382e-04 7.32238455e-10 -1.46870450e-09 1.03008552e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.09500315e-03 5.59611601e-04 7.86059064e-03] [ 1.09495673e-03 -5.60039767e-04 7.89986746e-03] [ 1.09512002e-03 -5.59585904e-04 -7.85066456e-03] [-1.09473848e-03 5.59894863e-04 -7.88573747e-03] [ 4.05984081e-07 -5.58614300e-06 -3.02381055e-06] [ 4.29817642e-06 2.33411134e-06 -2.71414714e-06] [-5.07107543e-06 3.24772504e-06 -3.27776279e-06] [-3.26194918e-08 -1.05296646e-05 5.94569213e-07] [ 9.35211803e-06 5.27801734e-06 4.14067274e-07] [-9.41790334e-06 5.27946406e-06 6.73836326e-07] [-2.01032116e-02 -7.61010043e-04 -8.84033802e-06] [ 2.01180227e-02 -1.76398249e-02 -9.36000262e-06] [ 1.21710573e-04 3.53375345e-03 -9.21888371e-06] [ 2.01032841e-02 7.74459740e-04 4.12226160e-06] [-2.01295160e-02 1.76331433e-02 4.38969584e-06] [-1.10229263e-04 -3.54036992e-03 4.29660553e-06] [-4.22129854e-03 3.32400646e-03 3.92827517e-04] [ 4.22145165e-03 -3.32399347e-03 3.93943695e-04] [ 4.22143939e-03 -3.32398171e-03 -3.93534289e-04] [-4.22138704e-03 3.32400721e-03 -3.94211850e-04] [-3.74787407e-04 -2.13798643e-03 -7.46517777e-04] [ 3.74782050e-04 2.13794205e-03 -7.45667175e-04] [ 3.74667209e-04 2.13790536e-03 7.45640335e-04] [-3.74797610e-04 -2.13795534e-03 7.45407382e-04]] Final stress: [ 9.58428422e-04 2.76914500e-03 1.06605355e-03 -1.53194439e-10 1.94396769e-09 -1.01920241e-03] Minimization converged after 73 steps. Minimization converged after 74 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 49 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-4.60870928e-02 2.84867382e-02 -1.34639263e-02] [ 4.60869941e-02 -2.84863933e-02 -1.34820193e-02] [ 4.60871815e-02 -2.84866768e-02 1.34354406e-02] [-4.60872303e-02 2.84869293e-02 1.34367076e-02] [-1.73489137e-07 4.26073790e-05 1.21313480e-05] [-3.76491282e-05 -2.12765868e-05 1.26295785e-05] [ 3.82962278e-05 -2.18581047e-05 1.25502294e-05] [-1.87887727e-08 -1.16289157e-05 4.82922090e-06] [ 9.99251399e-06 5.79317468e-06 4.81609985e-06] [-1.01553282e-05 5.86389382e-06 4.85674013e-06] [ 4.28215604e-02 -1.09136711e-02 5.26593884e-06] [-5.16445777e-02 7.18986497e-02 5.39204635e-06] [-1.40658425e-02 -7.46552754e-02 5.18645994e-06] [-4.28211849e-02 1.08960840e-02 1.81544498e-06] [ 5.16592812e-02 -7.18901816e-02 1.78090102e-06] [ 1.40507185e-02 7.46641557e-02 1.73840441e-06] [ 2.80435624e-03 1.21131099e-02 -5.39565906e-03] [-2.80423336e-03 -1.21130293e-02 -5.39621435e-03] [-2.80413367e-03 -1.21130377e-02 5.39651964e-03] [ 2.80421468e-03 1.21130793e-02 5.39644373e-03] [-2.34896860e-02 -3.71331549e-03 -6.30081358e-03] [ 2.34895643e-02 3.71333205e-03 -6.30145683e-03] [ 2.34897864e-02 3.71334011e-03 6.30117500e-03] [-2.34899681e-02 -3.71333827e-03 6.30081042e-03]] Final stress: [ 7.56962073e-05 2.24034493e-03 2.57993475e-03 -8.57404306e-11 1.29295639e-09 4.68867096e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 4.60800463e-02 2.84745158e-02 -1.34742583e-02] [-4.60797733e-02 -2.84742251e-02 -1.34299177e-02] [-4.60792261e-02 -2.84740518e-02 1.34824921e-02] [ 4.60801147e-02 2.84740569e-02 1.34536022e-02] [ 4.70010462e-08 1.38841131e-05 1.62120527e-06] [-1.19018843e-05 -6.91820631e-06 1.31431473e-06] [ 1.18658554e-05 -6.84264504e-06 1.44310078e-06] [ 1.03631024e-06 5.54693373e-05 -1.13763634e-05] [-4.92364354e-05 -2.90462593e-05 -1.16330395e-05] [ 4.71673618e-05 -2.66459106e-05 -1.11079408e-05] [-4.28026513e-02 -1.09508295e-02 -7.16094716e-06] [ 1.40994591e-02 -7.46163035e-02 -7.07508435e-06] [ 5.16116838e-02 7.19236984e-02 -7.26325188e-06] [ 4.28013527e-02 1.08516361e-02 6.28182099e-06] [-1.40128172e-02 7.46662547e-02 5.97764838e-06] [-5.16971625e-02 -7.18749985e-02 5.97069272e-06] [-2.80563376e-03 1.21003862e-02 -5.38465720e-03] [ 2.80535316e-03 -1.21002104e-02 -5.38537682e-03] [ 2.80527419e-03 -1.21001534e-02 5.38630558e-03] [-2.80569672e-03 1.21004072e-02 5.38376183e-03] [ 2.34783966e-02 -3.70935219e-03 -6.29640868e-03] [-2.34779556e-02 3.70931429e-03 -6.29730534e-03] [-2.34778118e-02 3.70930610e-03 6.29836183e-03] [ 2.34780695e-02 -3.70935185e-03 6.29640837e-03]] Final stress: [ 7.67761343e-05 2.23980559e-03 2.57978070e-03 2.16103835e-09 3.83016708e-09 -4.68994764e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 2.49024432e-01 -1.27649287e-01 2.53652107e-01] [-2.49024389e-01 1.27649298e-01 2.53653393e-01] [-2.49024364e-01 1.27649315e-01 -2.53652129e-01] [ 2.49024383e-01 -1.27649293e-01 -2.53653639e-01] [-3.74793256e-09 -6.83872439e-08 2.06416965e-08] [ 5.06246587e-08 3.62886522e-08 2.61970473e-08] [-3.74479311e-08 2.43987171e-08 3.67706720e-08] [ 4.98373941e-08 1.90461219e-07 -7.18981097e-10] [-2.71518461e-07 -1.69848683e-07 -6.22336308e-08] [ 1.60604987e-07 -4.69726211e-08 1.09588520e-08] [ 4.69026606e-01 1.79919619e-01 -1.91057396e-07] [-1.74637771e-01 1.29617235e-01 -2.23800453e-07] [-1.82807300e-01 -8.01796399e-01 -2.42238306e-07] [-4.69026588e-01 -1.79919535e-01 2.58296001e-07] [ 1.74637663e-01 -1.29617301e-01 2.79039220e-07] [ 1.82807370e-01 8.01796379e-01 3.19671585e-07] [ 1.46034344e-01 1.63825711e-01 -1.07188629e-01] [-1.46034347e-01 -1.63825714e-01 -1.07188594e-01] [-1.46034344e-01 -1.63825712e-01 1.07188637e-01] [ 1.46034350e-01 1.63825713e-01 1.07188600e-01] [ 7.02634691e-02 -5.90145024e-02 -1.46353419e-02] [-7.02634693e-02 5.90145043e-02 -1.46353417e-02] [-7.02634615e-02 5.90145063e-02 1.46353557e-02] [ 7.02634685e-02 -5.90145029e-02 1.46353501e-02]] Final stress: [5.99470780e-03 1.57049730e-02 3.61688708e-03 2.58315494e-13 1.85614113e-10 2.36446214e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-2.48806374e-01 -1.27468799e-01 2.53542506e-01] [ 2.48806355e-01 1.27468886e-01 2.53540455e-01] [ 2.48806386e-01 1.27468913e-01 -2.53540745e-01] [-2.48806357e-01 -1.27468900e-01 -2.53540758e-01] [ 2.29268454e-08 6.47619144e-07 1.17003679e-07] [-5.48991840e-07 -3.42198557e-07 1.09588545e-07] [ 5.17819156e-07 -2.95780945e-07 7.16979864e-08] [-1.55443095e-08 5.78534249e-07 -2.49872959e-07] [-6.56510840e-07 -3.13529719e-07 -3.43572386e-07] [ 6.94216696e-07 -3.51722752e-07 -3.35593585e-07] [-4.69050948e-01 1.79769696e-01 5.18303424e-08] [ 1.82757039e-01 -8.01302906e-01 4.61830781e-08] [ 1.74602594e-01 1.29477519e-01 9.02845608e-08] [ 4.69050968e-01 -1.79768877e-01 -2.28898210e-07] [-1.82757862e-01 8.01302467e-01 -3.60129736e-07] [-1.74601817e-01 -1.29477918e-01 -3.36142341e-07] [-1.45942378e-01 1.63733937e-01 -1.07138906e-01] [ 1.45942385e-01 -1.63733940e-01 -1.07138923e-01] [ 1.45942388e-01 -1.63733957e-01 1.07138870e-01] [-1.45942380e-01 1.63733944e-01 1.07138901e-01] [-7.00733764e-02 -5.88888367e-02 -1.45844070e-02] [ 7.00733677e-02 5.88888443e-02 -1.45844248e-02] [ 7.00733708e-02 5.88888427e-02 1.45844070e-02] [-7.00733753e-02 -5.88888393e-02 1.45843924e-02]] Final stress: [ 5.99398140e-03 1.56971214e-02 3.61362107e-03 1.57815627e-10 1.77152606e-11 -2.36284516e-04] 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: [[ 3.25873717e-02 -1.05597031e-02 1.87772412e-02] [ 7.10585835e-02 1.12243872e-01 1.17346163e-02] [-3.25871413e-02 1.05598709e-02 -1.87660945e-02] [-7.10584920e-02 -1.12243444e-01 -1.17128822e-02] [ 6.89859787e-08 -1.73613414e-05 -5.83997623e-06] [ 1.44621056e-05 8.45882980e-06 -4.61225047e-06] [-1.45256339e-05 8.57566927e-06 -5.24210445e-06] [ 8.31071887e-08 8.44543968e-06 -2.52268035e-06] [-7.62739930e-06 -4.39913125e-06 -2.97245072e-06] [ 7.33501927e-06 -4.13103732e-06 -2.58786347e-06] [-9.19294273e-02 -3.13441895e-02 -2.37562997e-02] [-1.22391318e-02 -8.63772294e-02 1.51852801e-02] [ 4.70440150e-02 5.63605325e-02 -6.22618760e-02] [ 9.19294601e-02 3.13421660e-02 2.37533915e-02] [ 1.22406192e-02 8.63780956e-02 -1.51883353e-02] [-4.70456373e-02 -5.63595820e-02 6.22589922e-02] [-5.31788524e-03 -1.83299401e-02 -1.24253630e-02] [-2.55699424e-02 -1.88830638e-02 -1.71529026e-02] [ 5.31792077e-03 1.83299646e-02 1.24251420e-02] [ 2.55699594e-02 1.88830883e-02 1.71526577e-02] [-2.22752867e-02 -1.31323162e-02 -8.00421234e-03] [-2.65975581e-02 -1.67975207e-02 -1.21774482e-02] [ 2.22753181e-02 1.31322967e-02 8.00422574e-03] [ 2.65974581e-02 1.67975134e-02 1.21776444e-02]] Final stress: [ 1.40513243e-05 7.94025017e-04 8.65368910e-04 -3.08883298e-03 -1.97699656e-03 -1.26978023e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-5.27922090e-02 -5.92924543e-02 8.24813911e-02] [-6.49220590e-02 1.53856946e-01 9.92380547e-02] [ 5.27920842e-02 5.92926187e-02 -8.24761568e-02] [ 6.49220966e-02 -1.53856361e-01 -9.92166294e-02] [-4.94782803e-08 -2.13774489e-05 -6.76244146e-06] [ 1.76862817e-05 1.04354153e-05 -5.72717710e-06] [-1.75826740e-05 1.03283255e-05 -5.57884168e-06] [-1.14239047e-08 -6.87778386e-07 -2.86028141e-07] [ 5.65775115e-07 3.51093011e-07 -2.98351331e-07] [-4.98285673e-07 2.99071012e-07 -3.92725573e-07] [ 2.82107741e-01 -4.45831934e-03 3.64915461e-02] [-1.13713468e-01 1.41707791e-01 -3.77587835e-02] [-8.17637210e-03 -2.13517092e-01 2.41704911e-02] [-2.82108061e-01 4.46605794e-03 -3.64938028e-02] [ 1.13706772e-01 -1.41711796e-01 3.77564652e-02] [ 8.18341386e-03 2.13513199e-01 -2.41732046e-02] [-1.19568443e-02 5.32356034e-03 -3.70641705e-02] [ 3.97515339e-02 -4.58127689e-02 -2.22593475e-02] [ 1.19568434e-02 -5.32362037e-03 3.70637301e-02] [-3.97515530e-02 4.58127941e-02 2.22593283e-02] [-6.03269584e-02 -8.49472150e-03 -4.39433946e-02] [-1.16670276e-02 3.77542653e-02 -3.58118230e-02] [ 6.03269256e-02 8.49475519e-03 4.39431454e-02] [ 1.16670320e-02 -3.77542031e-02 3.58122063e-02]] Final stress: [ 0.00279438 0.00526969 0.00278282 -0.00349241 0.00128113 0.00079126] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 7.10501503e-02 -1.12226279e-01 1.17133388e-02] [ 3.25880084e-02 1.05662751e-02 1.87872102e-02] [-7.10502291e-02 1.12226393e-01 -1.17165801e-02] [-3.25878200e-02 -1.05664709e-02 -1.87791881e-02] [ 2.93174386e-08 -2.38734286e-06 -1.05449859e-06] [ 2.08995733e-06 1.16649487e-06 -1.08913566e-06] [-2.21702559e-06 1.27344457e-06 -1.26033630e-06] [-1.29372804e-09 8.20740797e-07 5.79827601e-08] [-7.18149032e-07 -4.15688629e-07 4.37322830e-08] [ 7.37733174e-07 -4.29646419e-07 3.41357566e-08] [ 9.19164166e-02 -3.13622424e-02 2.37385281e-02] [-4.70398606e-02 5.63747310e-02 6.22570588e-02] [ 1.22273947e-02 -8.63706460e-02 -1.51963823e-02] [-9.19163145e-02 3.13514328e-02 -2.37389346e-02] [ 4.70492181e-02 -5.63693880e-02 -6.22575315e-02] [-1.22369168e-02 8.63761479e-02 1.51958136e-02] [-2.55717436e-02 1.88919346e-02 -1.71416973e-02] [-5.32713737e-03 1.83376118e-02 -1.24158787e-02] [ 2.55717751e-02 -1.88919626e-02 1.71418221e-02] [ 5.32711862e-03 -1.83375772e-02 1.24156832e-02] [-2.65969253e-02 1.68031210e-02 -1.21689424e-02] [-2.22727231e-02 1.31369814e-02 -7.99739486e-03] [ 2.65968976e-02 -1.68030676e-02 1.21689865e-02] [ 2.22727705e-02 -1.31370236e-02 7.99735659e-03]] Final stress: [ 1.42614775e-05 7.94131079e-04 8.64836814e-04 3.08823183e-03 -1.97639827e-03 1.26135163e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-6.49036377e-02 -1.53819193e-01 9.92176885e-02] [-5.28133434e-02 5.93035822e-02 8.25090685e-02] [ 6.49036320e-02 1.53819004e-01 -9.92108784e-02] [ 5.28131267e-02 -5.93037444e-02 -8.24997888e-02] [-6.15002345e-08 -7.36614612e-06 -2.26342330e-06] [ 6.63681010e-06 3.84345165e-06 -2.39342450e-06] [-6.35930052e-06 3.60822026e-06 -2.18603176e-06] [-1.56115225e-08 5.29373641e-06 -1.81029359e-06] [-4.33332779e-06 -2.54300963e-06 -1.48202045e-06] [ 4.36822366e-06 -2.57903386e-06 -1.52975027e-06] [-2.82095442e-01 -4.46770813e-03 -3.64976970e-02] [ 8.19263992e-03 -2.13497878e-01 -2.41500406e-02] [ 1.13675962e-01 1.41701572e-01 3.77975996e-02] [ 2.82095450e-01 4.46779989e-03 3.64963098e-02] [-8.19258768e-03 2.13497929e-01 2.41485321e-02] [-1.13675967e-01 -1.41701585e-01 -3.77989880e-02] [ 3.97630369e-02 4.58289907e-02 -2.22587357e-02] [-1.19563781e-02 -5.32226736e-03 -3.70626359e-02] [-3.97630316e-02 -4.58289996e-02 2.22586186e-02] [ 1.19563672e-02 5.32226870e-03 3.70625102e-02] [-1.16440474e-02 -3.77420635e-02 -3.58113947e-02] [-6.03306115e-02 8.51744831e-03 -4.39333182e-02] [ 1.16440454e-02 3.77420365e-02 3.58114198e-02] [ 6.03305509e-02 -8.51745068e-03 4.39333953e-02]] Final stress: [ 0.00279334 0.00526951 0.00278232 0.00349224 0.00128101 -0.00079128] Minimization converged after 101 steps. Minimization converged after 106 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 114 steps. Final forces: [[ 2.06729492e-04 -2.05715340e-04 -2.22227738e-05] [ 1.70217856e-04 -2.54219057e-04 8.85264042e-05] [ 2.06753884e-04 2.21106232e-05 8.60506614e-05] [-6.74194892e-05 -3.67328306e-04 -3.46056252e-05] [ 7.33436721e-04 1.45070224e-04 7.10416618e-06] [-7.75392472e-04 -4.90802291e-04 -5.85428847e-04] [-5.76202692e-04 7.85451846e-04 5.48522169e-04] [-4.20950345e-04 2.20603421e-04 -4.43319333e-04] [ 3.89026787e-04 -1.80737297e-04 4.74355048e-04] [-2.57922002e-04 -3.48258768e-04 7.86798475e-05] [ 1.01391175e-05 3.18464955e-05 2.10219896e-05] [-2.66707658e-04 2.71595814e-04 -6.07724346e-05] [ 3.01603589e-04 5.17026585e-04 1.62835391e-04] [-1.35941033e-04 -1.27524578e-04 -2.19884786e-04] [-4.71100601e-04 5.45046770e-05 -1.10458645e-04] [ 1.75973144e-04 1.85553543e-04 -2.09898428e-04] [ 4.59524089e-04 1.49178039e-05 -3.62747602e-04] [-2.59025167e-04 1.67330006e-04 -1.25427596e-04] [ 1.10760965e-04 -7.32679361e-05 4.82216972e-04] [ 2.96006369e-04 1.47635047e-05 6.41066556e-05] [ 4.24342807e-04 -1.80296668e-04 1.41834940e-04] [-4.88407957e-06 -1.88664495e-04 -1.91328966e-05] [-1.17934507e-04 7.71974960e-05 -1.17149930e-05] [-1.31034773e-04 -9.11573037e-05 5.03597160e-05]] Final stress: [ 0.03497568 0.03523567 0.14276735 -0.00150796 0.00042346 0.0017666 ] Minimization converged after 107 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 102 steps. Minimization converged after 100 steps. Minimization converged after 99 steps. Minimization converged after 102 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-8.29807699e-03 -3.15805398e-02 6.41236069e-03] [ 8.29805022e-03 3.15805204e-02 6.41077001e-03] [ 8.29806150e-03 3.15805303e-02 -6.41160098e-03] [-8.29805677e-03 -3.15805221e-02 -6.41114417e-03] [-5.31880553e-09 1.82469964e-07 7.42316001e-08] [-1.49514806e-07 -8.42358103e-08 6.74503257e-08] [ 1.61521616e-07 -9.72257963e-08 7.38098578e-08] [-1.94995527e-08 6.74977812e-07 -2.00426771e-07] [-5.56923379e-07 -3.13134071e-07 -1.79518008e-07] [ 5.94456456e-07 -3.57217501e-07 -1.94884451e-07] [ 1.86061911e-01 4.15033741e-02 1.90293958e-07] [-6.08386314e-02 1.38135479e-01 1.68885028e-07] [-2.27208393e-02 -2.53216440e-02 1.77961121e-07] [-1.86061912e-01 -4.15031308e-02 -2.05862910e-07] [ 6.08384272e-02 -1.38135594e-01 -1.79502616e-07] [ 2.27210513e-02 2.53215170e-02 -1.90179941e-07] [ 1.81514675e-02 -5.04063878e-02 1.12135251e-02] [-1.81514643e-02 5.04063885e-02 1.12135046e-02] [-1.81514677e-02 5.04063890e-02 -1.12135275e-02] [ 1.81514650e-02 -5.04063871e-02 -1.12135010e-02] [-5.31075696e-02 8.99048711e-03 -1.20226653e-02] [ 5.31075668e-02 -8.99048778e-03 -1.20226864e-02] [ 5.31075619e-02 -8.99048571e-03 1.20226793e-02] [-5.31075692e-02 8.99048804e-03 1.20226834e-02]] Final stress: [ 1.83412213e-03 -3.32239294e-04 -5.02425345e-04 -1.30670555e-11 8.32121471e-11 2.56058790e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 7.72595278e-03 -3.15022548e-02 5.14366353e-03] [-7.72594267e-03 3.15022438e-02 5.14305346e-03] [-7.72594097e-03 3.15022480e-02 -5.14319822e-03] [ 7.72592762e-03 -3.15022357e-02 -5.14224475e-03] [-1.96642475e-08 -6.60598982e-07 -1.95928907e-07] [ 5.84815235e-07 3.50932721e-07 -1.91867654e-07] [-5.46594446e-07 3.06227852e-07 -1.76962692e-07] [ 2.14587408e-08 7.10152808e-07 -1.77590611e-07] [-6.27576073e-07 -3.76994435e-07 -1.72721180e-07] [ 5.89892661e-07 -3.30290638e-07 -1.61310464e-07] [-1.83615388e-01 3.94404500e-02 1.12175809e-07] [ 2.24912792e-02 -2.38237787e-02 1.04326903e-07] [ 5.78917041e-02 1.32416480e-01 9.87381235e-08] [ 1.83615375e-01 -3.94408732e-02 -1.91449455e-07] [-2.24909014e-02 2.38240009e-02 -1.76160228e-07] [-5.78920642e-02 -1.32416277e-01 -1.66771750e-07] [-1.53710115e-02 -4.84365782e-02 1.09824009e-02] [ 1.53710082e-02 4.84365763e-02 1.09823767e-02] [ 1.53710118e-02 4.84365762e-02 -1.09823964e-02] [-1.53710107e-02 -4.84365771e-02 -1.09823847e-02] [ 5.19596138e-02 7.82557077e-03 -1.25496914e-02] [-5.19596161e-02 -7.82557147e-03 -1.25497043e-02] [-5.19596070e-02 -7.82556867e-03 1.25497071e-02] [ 5.19596080e-02 7.82557028e-03 1.25497136e-02]] Final stress: [ 1.69448057e-03 -3.41163881e-04 -5.00504436e-04 -1.73281992e-11 -6.40036691e-11 -2.60390096e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-5.83985638e-12 4.95652616e-04 1.70328086e-04] [ 4.98368426e-11 -4.95652578e-04 1.70331847e-04] [ 2.87642438e-11 -4.95652534e-04 -1.70329444e-04] [ 9.08059739e-12 4.95652609e-04 -1.70332577e-04] [ 1.40815375e-11 5.85313353e-10 1.74884940e-10] [-5.75550066e-10 -3.32549571e-10 2.45473364e-10] [ 5.14689291e-10 -2.81028367e-10 1.76553799e-10] [ 9.83671365e-11 -8.74436745e-10 3.23572613e-10] [ 3.93940880e-10 2.77362688e-10 1.57509783e-10] [-5.73580572e-10 4.94087049e-10 2.60268414e-10] [ 1.29518618e-11 -7.37549752e-04 -4.78221573e-10] [ 5.37535796e-04 3.15529954e-05 -4.77598699e-10] [-5.37535834e-04 3.15530320e-05 -5.21583780e-10] [-7.68309305e-11 7.37548999e-04 7.14396657e-10] [-5.37535112e-04 -3.15525633e-05 7.58712789e-10] [ 5.37535242e-04 -3.15527256e-05 7.21452260e-10] [ 3.05308556e-12 -3.47808902e-04 -5.27936135e-04] [ 1.02748920e-11 3.47808912e-04 -5.27936068e-04] [ 3.85697030e-12 3.47808906e-04 5.27936165e-04] [ 8.91345331e-12 -3.47808889e-04 5.27936072e-04] [ 2.94503311e-12 5.70662095e-04 6.60518186e-04] [-6.34684932e-12 -5.70662093e-04 6.60518245e-04] [-7.30575013e-12 -5.70662091e-04 -6.60518187e-04] [ 3.67511577e-12 5.70662095e-04 -6.60518245e-04]] Final stress: [ 3.47880694e-03 1.96953978e-03 1.84091431e-03 -1.53842057e-13 1.78681203e-14 3.18693397e-14] Minimization converged after 28 steps. Minimization converged after 7 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.86820115e-10 1.77082302e-05 4.01634844e-04] [ 5.72980674e-11 -1.77080171e-05 4.01629597e-04] [ 1.57204133e-10 -1.77078766e-05 -4.01629361e-04] [ 2.64999134e-11 1.77081924e-05 -4.01635210e-04] [ 1.16592345e-10 5.29159755e-09 1.34325884e-09] [-4.85358823e-09 -2.84356300e-09 1.57249411e-09] [ 4.59787008e-09 -2.55508170e-09 1.38871881e-09] [ 3.58169441e-10 2.96583358e-09 -9.12715348e-10] [-3.80976140e-09 -2.10141882e-09 -1.62413405e-09] [ 3.03953041e-09 -1.23897742e-09 -1.07300957e-09] [-3.46330742e-11 -4.08065432e-04 -9.58600604e-11] [ 3.58492216e-04 -2.12549296e-05 -1.42134806e-10] [-3.58492188e-04 -2.12549832e-05 -1.32124852e-10] [-9.42660949e-11 4.08067692e-04 -4.95020458e-11] [-3.58494535e-04 2.12538138e-05 -3.10422086e-11] [ 3.58494646e-04 2.12536441e-05 4.45904188e-11] [ 1.33886235e-11 -2.11628990e-04 3.36706038e-04] [ 4.50311455e-11 2.11629028e-04 3.36706093e-04] [ 1.10039200e-11 2.11629002e-04 -3.36706107e-04] [ 4.22025748e-11 -2.11628955e-04 -3.36706066e-04] [ 6.58850752e-12 2.94741967e-04 -4.79675162e-04] [-4.60952121e-12 -2.94741937e-04 -4.79675271e-04] [-9.40132412e-13 -2.94741930e-04 4.79675218e-04] [ 6.47260023e-13 2.94741963e-04 4.79675099e-04]] Final stress: [ 2.66394365e-03 1.91257602e-03 2.59962688e-03 -2.99120246e-13 1.71627815e-13 4.89530548e-14] Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 22 steps. Minimization converged after 42 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 5.02817052e-09 2.66642069e-04 -3.36413649e-05] [ 2.20942300e-09 -1.72608772e-04 2.47327779e-06] [ 1.28513198e-09 -2.66640116e-04 3.36595114e-05] [-1.74305645e-09 1.72605177e-04 -2.45284692e-06] [ 2.89917969e-09 5.44904338e-09 1.62701352e-10] [-1.25951637e-08 -5.59167322e-09 3.23233829e-10] [ 7.94256161e-09 3.76841724e-10 -1.61871025e-09] [ 5.16261186e-10 4.91898566e-09 -2.50122378e-09] [ 1.57861069e-09 -2.94068492e-09 -3.62467711e-09] [-4.65026095e-09 -8.42340364e-10 2.94637790e-10] [ 2.90973579e-09 -3.01285160e-04 1.29372325e-04] [ 6.10069060e-05 -3.38262405e-04 3.16135405e-07] [-6.10122610e-05 -3.38255952e-04 3.15507925e-07] [ 2.27729613e-09 3.01274123e-04 -1.29377155e-04] [-6.10005108e-05 3.38262320e-04 -3.31429212e-07] [ 6.09960777e-05 3.38267689e-04 -3.23753579e-07] [ 3.25690169e-10 -1.26227289e-04 -8.54425088e-04] [ 3.84861143e-10 3.35224407e-04 -5.64088461e-04] [ 1.54979918e-11 1.26227765e-04 8.54424403e-04] [ 2.14593898e-11 -3.35224929e-04 5.64087361e-04] [ 4.92682783e-10 3.48295199e-04 6.89156959e-04] [ 3.80102127e-10 -6.29733606e-05 7.01719275e-05] [ 2.50949002e-10 -3.48295120e-04 -6.89157465e-04] [ 2.58885802e-10 6.29729844e-05 -7.01728798e-05]] Final stress: [-1.83202723e-03 -9.36666353e-04 -8.15759671e-04 -7.50400745e-04 2.18860149e-11 6.16503711e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-2.45052947e-09 1.72519555e-04 2.51682106e-06] [-9.34702658e-09 -2.66448795e-04 -3.35754802e-05] [ 4.26568994e-09 -1.72512300e-04 -2.40855085e-06] [-1.07935771e-09 2.66444628e-04 3.36498502e-05] [-7.86732514e-10 1.03006812e-08 -8.82614082e-09] [-2.02508372e-08 -4.46149909e-09 -1.02957216e-08] [ 2.61997133e-08 -8.60283250e-09 -2.59444313e-09] [-2.67926840e-09 -2.03427013e-08 -1.13842753e-08] [ 2.14360889e-08 1.15638233e-08 -1.45310411e-08] [-1.82120062e-08 6.49602599e-09 -1.47003067e-08] [-3.86017629e-09 -3.01081577e-04 -1.29324305e-04] [ 6.10252194e-05 -3.38129843e-04 -3.14814519e-07] [-6.10177875e-05 -3.38138525e-04 -3.00887031e-07] [-1.82270909e-09 3.01078249e-04 1.29298764e-04] [-6.10140460e-05 3.38138315e-04 2.69839961e-07] [ 6.10176317e-05 3.38134355e-04 2.67586490e-07] [-6.68329808e-10 -3.35029344e-04 -5.63790305e-04] [-3.83066467e-10 1.26152730e-04 -8.53830691e-04] [ 1.60438884e-11 3.35030159e-04 5.63787306e-04] [ 2.51483528e-10 -1.26152663e-04 8.53826849e-04] [-5.94648664e-10 6.29835883e-05 7.02016940e-05] [-5.69198321e-10 -3.48107561e-04 6.88654056e-04] [-1.30851827e-11 -6.29831129e-05 -7.02073623e-05] [-4.69666972e-10 3.48107187e-04 -6.88658040e-04]] Final stress: [-1.83199316e-03 -9.36665955e-04 -8.15768188e-04 7.50358115e-04 -4.25144455e-11 -5.23741728e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 6.36885529e-06 -1.75077996e-04 3.17115103e-05] [ 6.37607180e-06 1.75090431e-04 3.15992282e-05] [-6.38497398e-06 1.75062827e-04 -3.26390758e-05] [-6.37895730e-06 -1.75077269e-04 -3.25269954e-05] [-1.32361131e-09 -5.71031708e-07 1.91779965e-08] [ 4.27185703e-07 2.74644151e-07 4.91383001e-08] [-4.24843783e-07 2.71478902e-07 4.76499736e-08] [ 2.68729085e-09 2.20292190e-07 1.02523344e-07] [-1.46148568e-07 -1.03522615e-07 1.23989290e-07] [ 1.47450474e-07 -1.01463411e-07 1.16606997e-07] [-9.27850796e-10 1.79692743e-04 2.11530940e-07] [-1.44015431e-05 2.38076417e-04 -6.40796676e-05] [ 1.44109761e-05 2.38069950e-04 6.45277485e-05] [-4.86332846e-09 -1.79196684e-04 1.88278934e-07] [ 1.40321083e-05 -2.38307313e-04 6.44876162e-05] [-1.40172970e-05 -2.38321513e-04 -6.41368278e-05] [ 3.51867098e-04 1.81794754e-04 7.36199044e-04] [ 3.51867970e-04 -1.81792618e-04 7.36204343e-04] [-3.51868837e-04 -1.81789249e-04 -7.36166284e-04] [-3.51868483e-04 1.81788963e-04 -7.36155763e-04] [-9.75430846e-05 -3.28059971e-04 -2.44770292e-04] [-9.75440517e-05 3.28058602e-04 -2.44766165e-04] [ 9.75425902e-05 3.28058121e-04 2.44822372e-04] [ 9.75423404e-05 -3.28060593e-04 2.44830312e-04]] Final stress: [ 1.82030249e-03 9.67716112e-04 9.64327592e-04 7.61293976e-11 -6.97396371e-04 1.88498945e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-6.34699498e-06 -1.75249350e-04 3.34272830e-05] [-6.33316524e-06 1.75254249e-04 3.06245314e-05] [ 6.35201395e-06 1.75239152e-04 -3.35228977e-05] [ 6.33917137e-06 -1.75237040e-04 -3.09158270e-05] [-1.11130524e-08 -8.04940740e-08 1.99967911e-08] [ 4.98112314e-08 4.41801100e-08 3.46653810e-08] [-3.45336125e-08 2.26645118e-08 3.83054033e-08] [ 2.51187957e-08 4.11698817e-08 3.99826838e-10] [-3.31922192e-08 -4.21208535e-08 2.45519727e-09] [-1.10982984e-08 1.24992535e-08 2.59526348e-08] [-9.15883591e-09 1.79463745e-04 5.16923325e-07] [-1.42635437e-05 2.38120839e-04 6.48204027e-05] [ 1.42609303e-05 2.38111607e-04 -6.37699127e-05] [ 1.97275984e-09 -1.79374171e-04 -4.47401796e-07] [ 1.41699909e-05 -2.38162524e-04 -6.47289185e-05] [-1.41593371e-05 -2.38166524e-04 6.38384062e-05] [-3.51713392e-04 1.81703515e-04 7.35854715e-04] [-3.51713620e-04 -1.81703316e-04 7.35791736e-04] [ 3.51712406e-04 -1.81701044e-04 -7.35847115e-04] [ 3.51718528e-04 1.81700983e-04 -7.35784208e-04] [ 9.76744997e-05 -3.28080917e-04 -2.44650375e-04] [ 9.76741568e-05 3.28081551e-04 -2.44692170e-04] [-9.76750706e-05 3.28081376e-04 2.44656780e-04] [-9.76743811e-05 -3.28080031e-04 2.44706272e-04]] Final stress: [ 1.82029421e-03 9.67713012e-04 9.64341226e-04 -1.12390118e-11 6.97389508e-04 9.40411460e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.59989966e-04 -4.73384190e-04 4.01803498e-04] [-1.59990291e-04 4.73383732e-04 4.01827751e-04] [ 1.59991117e-04 4.73383440e-04 -4.01821983e-04] [ 1.59990591e-04 -4.73383349e-04 -4.01847823e-04] [ 9.42307927e-11 5.13361673e-08 8.70899641e-09] [-4.51979572e-08 -2.59266965e-08 8.90062674e-09] [ 4.49006146e-08 -2.56540365e-08 8.98899952e-09] [ 8.99912749e-10 -6.76346856e-08 1.27031083e-08] [ 5.86111706e-08 3.29817088e-08 1.27824739e-08] [-6.05673630e-08 3.51415031e-08 1.36540126e-08] [-4.58386662e-11 -1.65849043e-04 -7.84136033e-09] [-1.21158278e-04 3.76509754e-04 -5.38630304e-05] [ 1.21157955e-04 3.76509888e-04 5.38476619e-05] [ 1.55015056e-10 1.65880634e-04 8.10988323e-10] [ 1.21130830e-04 -3.76525715e-04 5.38566747e-05] [-1.21131186e-04 -3.76525324e-04 -5.38538121e-05] [ 3.34792520e-04 1.01143357e-06 -2.16595553e-04] [ 3.34792648e-04 -1.01143616e-06 -2.16594422e-04] [-3.34792533e-04 -1.01139301e-06 2.16593876e-04] [-3.34792337e-04 1.01141689e-06 2.16593858e-04] [-5.95646052e-04 -6.50501366e-04 -5.32436008e-05] [-5.95646123e-04 6.50501314e-04 -5.32429673e-05] [ 5.95646170e-04 6.50501218e-04 5.32406865e-05] [ 5.95646086e-04 -6.50501258e-04 5.32404770e-05]] Final stress: [-1.73031433e-03 -1.02183575e-03 -8.21026723e-04 -1.21847290e-12 -7.64309073e-04 4.39910786e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 1.60057214e-04 -4.73209393e-04 4.01561209e-04] [ 1.60056752e-04 4.73208908e-04 4.01697037e-04] [-1.60057746e-04 4.73208588e-04 -4.01575992e-04] [-1.60056260e-04 -4.73208776e-04 -4.01709007e-04] [ 1.31373864e-10 -1.69965442e-09 3.07495029e-10] [ 1.87254517e-11 4.62644971e-10 8.99350122e-10] [-3.63765518e-10 8.24226132e-10 6.00954092e-10] [-2.31829172e-10 -3.01070358e-08 6.31310915e-09] [ 2.95542082e-08 1.59496802e-08 7.71917041e-09] [-2.88140228e-08 1.52601105e-08 7.29973402e-09] [ 1.25843724e-10 -1.66011671e-04 -2.32786533e-08] [-1.21278984e-04 3.76521903e-04 5.38423435e-05] [ 1.21279650e-04 3.76521665e-04 -5.38890786e-05] [ 3.69582920e-10 1.66041936e-04 2.48712948e-08] [ 1.21252640e-04 -3.76537456e-04 -5.38406624e-05] [-1.21254116e-04 -3.76536180e-04 5.38902439e-05] [-3.34742406e-04 1.08130822e-06 -2.16635630e-04] [-3.34742369e-04 -1.08131318e-06 -2.16632158e-04] [ 3.34742518e-04 -1.08117899e-06 2.16635234e-04] [ 3.34742235e-04 1.08109345e-06 2.16632544e-04] [ 5.95763157e-04 -6.50512250e-04 -5.32932416e-05] [ 5.95763349e-04 6.50512215e-04 -5.32902954e-05] [-5.95763195e-04 6.50512149e-04 5.32921441e-05] [-5.95763229e-04 -6.50512239e-04 5.32905754e-05]] Final stress: [-1.73031886e-03 -1.02183432e-03 -8.21024330e-04 1.04953218e-12 7.64306301e-04 -9.31283188e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.78720950e-04 -2.08129138e-03 3.03222130e-03] [-1.78618977e-04 2.08133148e-03 3.03601120e-03] [-1.78636188e-04 2.08133671e-03 -3.03301952e-03] [ 1.78651411e-04 -2.08135186e-03 -3.03709274e-03] [-3.64987607e-08 1.08119264e-06 3.00381388e-07] [-9.05730681e-07 -4.98027162e-07 2.84464294e-07] [ 9.57030589e-07 -5.69616952e-07 2.87701550e-07] [ 1.44904759e-07 -1.29871413e-06 3.21764589e-07] [ 8.93265575e-07 4.68300856e-07 2.00656279e-07] [-1.16226738e-06 7.90034258e-07 3.51010813e-07] [ 8.79851190e-03 4.34421566e-03 -6.79147611e-07] [-6.48451337e-03 9.63288548e-03 -6.43099557e-07] [-5.60566068e-03 -1.21413223e-02 -7.06594634e-07] [-8.79847449e-03 -4.34385855e-03 7.66778091e-07] [ 6.48414467e-03 -9.63311191e-03 7.27835727e-07] [ 5.60594970e-03 1.21411850e-02 7.31569275e-07] [ 9.19587365e-04 -1.36458801e-03 -2.20593669e-03] [-9.19582195e-04 1.36458926e-03 -2.20583788e-03] [-9.19591242e-04 1.36458791e-03 2.20593036e-03] [ 9.19606454e-04 -1.36458230e-03 2.20583851e-03] [ 3.75670129e-04 1.05135006e-03 2.57344507e-03] [-3.75667131e-04 -1.05135069e-03 2.57351043e-03] [-3.75655318e-04 -1.05134291e-03 -2.57348122e-03] [ 3.75666312e-04 1.05134511e-03 -2.57353214e-03]] Final stress: [ 1.37961744e-03 6.79375743e-04 6.25012177e-04 -7.39684396e-12 -5.06303784e-11 6.82040367e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.26047086e-04 -2.14398780e-03 3.07373686e-03] [ 2.26072172e-04 2.14389968e-03 3.07425858e-03] [ 2.26174326e-04 2.14387717e-03 -3.06834240e-03] [-2.26080295e-04 -2.14387340e-03 -3.07271609e-03] [ 4.57974943e-08 2.63109244e-06 2.11918319e-07] [-2.14206464e-06 -1.34644334e-06 1.94304312e-07] [ 2.06795486e-06 -1.25027946e-06 1.78882079e-07] [ 6.60801083e-08 2.18606078e-06 -1.07389151e-06] [-1.85599956e-06 -1.14406585e-06 -1.05263071e-06] [ 1.68556275e-06 -9.69814859e-07 -9.31255990e-07] [-9.00393475e-03 4.41185844e-03 -1.10608389e-06] [ 5.75588441e-03 -1.22923621e-02 -1.13002856e-06] [ 6.64617646e-03 9.87409330e-03 -1.05955918e-06] [ 9.00393219e-03 -4.41260009e-03 -2.87346961e-07] [-5.75525910e-03 1.22927295e-02 -1.86193213e-07] [-6.64683358e-03 -9.87370578e-03 -1.76705427e-07] [-9.91877142e-04 -1.42866150e-03 -2.24863182e-03] [ 9.91883006e-04 1.42864489e-03 -2.24858434e-03] [ 9.91880957e-04 1.42864994e-03 2.24851632e-03] [-9.91878802e-04 -1.42865153e-03 2.24844564e-03] [-3.83942131e-04 1.10056842e-03 2.60586836e-03] [ 3.83966584e-04 -1.10057847e-03 2.60583401e-03] [ 3.83954509e-04 -1.10057581e-03 -2.60592992e-03] [-3.83939051e-04 1.10056866e-03 -2.60603660e-03]] Final stress: [ 1.38210450e-03 6.77598364e-04 6.26216624e-04 -3.80154574e-10 -3.04709523e-11 -6.81044630e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.45047489e-02 -9.88605546e-03 -5.14114986e-03] [ 1.45047416e-02 9.88627292e-03 -5.12186778e-03] [ 1.45047170e-02 9.88636810e-03 5.14503788e-03] [-1.45046334e-02 -9.88598591e-03 5.12133989e-03] [-5.29090401e-09 -1.08415364e-06 -2.92066726e-07] [ 2.73138848e-07 3.69831309e-07 1.03831585e-07] [-3.28625399e-07 4.14108705e-07 1.80057207e-08] [-3.65681418e-09 -5.26670051e-06 5.67025077e-07] [ 3.99775125e-06 2.49755641e-06 2.33653930e-07] [-3.95573398e-06 2.46887572e-06 1.22662737e-07] [ 2.87216648e-02 1.29157647e-02 -4.37147629e-06] [-1.68603056e-02 6.07418047e-02 -4.50968775e-06] [-4.59370279e-02 -5.85021405e-02 -4.48238495e-06] [-2.87216379e-02 -1.29093060e-02 3.21116901e-06] [ 1.68543947e-02 -6.07451457e-02 3.36358307e-06] [ 4.59428475e-02 5.84988713e-02 3.24940317e-06] [-1.28236498e-02 5.24248975e-03 8.23084483e-03] [ 1.28236679e-02 -5.24245617e-03 8.23135495e-03] [ 1.28236654e-02 -5.24244248e-03 -8.23101883e-03] [-1.28236822e-02 5.24250542e-03 -8.23143094e-03] [-7.03201327e-03 5.98590544e-04 3.05230578e-03] [ 7.03202489e-03 -5.98567390e-04 3.05282594e-03] [ 7.03201387e-03 -5.98561123e-04 -3.05265395e-03] [-7.03201636e-03 5.98593701e-04 -3.05280163e-03]] Final stress: [-1.15235870e-03 -7.80776629e-04 -1.32526785e-03 -1.15805399e-09 3.07138413e-10 5.08556114e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 3.26701533e-03 8.42117589e-05 -1.14670602e-03] [-3.26665988e-03 -8.42246600e-05 -1.09676200e-03] [-3.26677574e-03 -8.43316406e-05 1.14637971e-03] [ 3.26649982e-03 8.45967151e-05 1.09640828e-03] [ 1.88968598e-07 -1.49121389e-06 -4.72588341e-07] [ 5.84112812e-07 4.20893509e-07 -8.16374160e-08] [-8.20638715e-07 7.73448578e-07 -1.24349733e-07] [-5.52351740e-09 -3.61016307e-07 1.94395167e-07] [ 2.04459354e-07 1.63281094e-07 1.37010562e-07] [-3.13073701e-07 2.20761587e-07 3.25848013e-07] [-3.73439279e-02 -1.57471385e-03 -8.92027590e-06] [ 4.52902084e-02 -7.36455713e-02 -8.84968114e-06] [ 4.11988985e-02 6.99717729e-02 -9.07417687e-06] [ 3.73438874e-02 1.57813085e-03 8.91941895e-06] [-4.52932388e-02 7.36439048e-02 8.91703485e-06] [-4.11957831e-02 -6.99735636e-02 9.60606145e-06] [ 2.42755686e-03 1.21920387e-02 -8.43585021e-03] [-2.42747576e-03 -1.21920405e-02 -8.43457435e-03] [-2.42752535e-03 -1.21919788e-02 8.43580072e-03] [ 2.42749434e-03 1.21920264e-02 8.43466596e-03] [ 8.12575658e-03 -2.17780122e-03 8.10617633e-03] [-8.12568435e-03 2.17780675e-03 8.10685912e-03] [-8.12575263e-03 2.17781705e-03 -8.10615398e-03] [ 8.12566790e-03 -2.17780647e-03 -8.10682061e-03]] Final stress: [-2.08084626e-03 -4.78037175e-04 -8.75753218e-04 1.09795297e-10 3.11679859e-09 7.97065931e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 6.05356043e-11 -2.71661378e-04 -1.38420495e-05] [-5.73209443e-11 2.71661344e-04 -1.38398502e-05] [ 6.32616744e-11 2.71661483e-04 1.38442234e-05] [ 3.38868378e-11 -2.71661365e-04 1.38402597e-05] [-1.16917158e-10 1.00667613e-09 7.32622296e-11] [-7.90341917e-10 -3.71415142e-10 -3.41571216e-12] [ 1.01388681e-09 -6.31268371e-10 1.29939032e-10] [ 1.05149020e-10 -4.80612883e-10 -1.20333077e-10] [ 9.85448390e-11 7.72286679e-11 -2.87650903e-10] [-3.16365822e-10 3.23859217e-10 -1.38817711e-10] [ 1.43821621e-11 4.28386848e-04 -7.96550682e-10] [-5.53586265e-06 5.12202952e-04 -9.21887780e-10] [ 5.53583619e-06 5.12202984e-04 -8.78622286e-10] [ 1.47262980e-10 -4.28385467e-04 2.02927349e-10] [ 5.53436720e-06 -5.12203843e-04 2.62037780e-10] [-5.53462976e-06 -5.12203519e-04 2.02590227e-10] [-1.48178969e-11 6.51152808e-04 -5.87420627e-04] [ 8.32739433e-12 -6.51152802e-04 -5.87420530e-04] [-1.16964216e-11 -6.51152809e-04 5.87420534e-04] [ 1.41226753e-11 6.51152826e-04 5.87420490e-04] [ 3.01803027e-12 -6.33177666e-04 1.11595691e-03] [ 1.42384799e-11 6.33177669e-04 1.11595695e-03] [ 1.94935032e-11 6.33177670e-04 -1.11595699e-03] [ 3.77864406e-13 -6.33177662e-04 -1.11595705e-03]] Final stress: [ 1.97596155e-03 3.47471812e-03 1.82666020e-03 -3.84426872e-13 -2.71779848e-13 -6.50198769e-14] Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.09087323e-10 -3.20796852e-05 1.02390077e-05] [ 1.49025979e-10 3.20795665e-05 1.02568630e-05] [-1.92069175e-11 3.20801415e-05 -1.02425815e-05] [ 3.38751721e-10 -3.20796795e-05 -1.02573228e-05] [ 4.71937707e-10 -1.35425287e-08 -2.01406058e-09] [ 1.12564073e-08 6.21857043e-09 -1.64666111e-09] [-1.22100566e-08 7.31292310e-09 -2.28312283e-09] [ 2.04763403e-10 -4.49862569e-09 1.58141544e-09] [ 1.24444288e-09 1.58172275e-09 4.74543738e-10] [-1.58674546e-09 2.01646638e-09 6.46327051e-10] [-1.09354914e-10 1.08708937e-04 -1.76855636e-09] [-1.22398550e-04 4.09332409e-04 -1.95712953e-09] [ 1.22398735e-04 4.09332171e-04 -2.02577025e-09] [ 2.18344787e-10 -1.08700902e-04 3.73762973e-09] [ 1.22393281e-04 -4.09336317e-04 4.09988330e-09] [-1.22393737e-04 -4.09335806e-04 3.96404005e-09] [ 6.12673523e-11 3.08667782e-04 2.85018817e-04] [ 1.75259807e-11 -3.08667668e-04 2.85019216e-04] [ 6.03661565e-11 -3.08667755e-04 -2.85018596e-04] [ 2.39370190e-11 3.08667905e-04 -2.85018960e-04] [-1.33223987e-11 -3.35131870e-04 -7.65548715e-04] [ 3.24873611e-11 3.35131768e-04 -7.65548023e-04] [ 2.58364987e-11 3.35131798e-04 7.65548678e-04] [-5.00233188e-12 -3.35131883e-04 7.65548809e-04]] Final stress: [ 1.91789629e-03 2.63599509e-03 2.60336320e-03 -1.38993777e-12 -1.78057865e-13 -8.88885696e-14] Minimization converged after 32 steps. Minimization converged after 26 steps. Minimization converged after 20 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.70010762e-08 5.45953521e-04 2.31576916e-04] [-4.13506764e-09 -6.27453660e-04 -6.35265700e-05] [ 6.85194520e-09 -5.45905059e-04 -2.30628851e-04] [ 2.80214585e-09 6.27485507e-04 6.22341689e-05] [-3.89311057e-08 9.76005213e-07 2.78032551e-07] [-8.93615330e-07 -4.61410300e-07 2.91437318e-07] [ 9.64095628e-07 -5.47325695e-07 3.30804040e-07] [-3.93481184e-08 3.68569009e-07 -1.26928352e-07] [-3.93809561e-07 -1.58360443e-07 -1.48658136e-07] [ 4.90494061e-07 -2.59414331e-07 -2.27752653e-07] [ 6.65218777e-08 -1.78357190e-04 2.19212651e-05] [ 2.75476451e-05 6.04060198e-05 1.11551768e-05] [-2.76593192e-05 6.05472329e-05 1.11738868e-05] [-1.36240831e-08 1.79219272e-04 -2.19292674e-05] [-2.83683718e-05 -6.08998291e-05 -1.11447557e-05] [ 2.84014833e-05 -6.09348848e-05 -1.12030445e-05] [-5.72932049e-09 4.90573547e-04 8.09594260e-04] [-6.86034501e-09 4.16158768e-04 8.31649430e-04] [-1.90706168e-09 -4.90568552e-04 -8.09612168e-04] [-4.08619477e-09 -4.16146803e-04 -8.31637438e-04] [ 5.11912629e-09 4.12677604e-04 -6.29912619e-04] [-2.97298249e-09 -1.41380713e-04 -6.93596298e-04] [-2.64966994e-09 -4.12673258e-04 6.29919576e-04] [ 7.34771166e-09 1.41380413e-04 6.93569395e-04]] Final stress: [ 9.48307656e-04 1.82449830e-03 9.67070432e-04 -7.09241938e-04 -1.98881293e-10 3.51993657e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.86714597e-09 6.29719421e-04 -6.31839033e-05] [-9.98736315e-09 -5.48009935e-04 2.33066370e-04] [-2.53816868e-08 -6.29737067e-04 6.38175908e-05] [-4.18586668e-08 5.47984869e-04 -2.30486242e-04] [-3.23925795e-08 6.89645769e-07 -1.60142581e-07] [-5.71449529e-07 -3.03715392e-07 -1.88500328e-07] [ 6.46470488e-07 -3.84133423e-07 -1.30252490e-07] [-4.76225050e-09 3.80146611e-07 -2.48330753e-07] [-2.86118290e-07 -1.74146048e-07 -2.16742651e-07] [ 3.02515624e-07 -1.89462418e-07 -2.33204633e-07] [-1.91491801e-08 -1.81055779e-04 -2.17224022e-05] [ 2.94731394e-05 6.19712408e-05 -1.10348709e-05] [-2.94354827e-05 6.19273155e-05 -1.10628799e-05] [-2.51711803e-08 1.77635825e-04 2.11343517e-05] [-2.63993202e-05 -6.01928719e-05 1.04373951e-05] [ 2.64484733e-05 -6.02503456e-05 1.04734512e-05] [-2.39248366e-09 -4.15598577e-04 8.33809217e-04] [ 1.02295178e-09 -4.92458227e-04 8.11591081e-04] [-5.20715321e-09 4.15590782e-04 -8.33812269e-04] [-1.50743545e-09 4.92460819e-04 -8.11702308e-04] [-1.97945771e-09 1.40871927e-04 -6.96881257e-04] [-3.39288450e-09 -4.12968832e-04 -6.33491082e-04] [-3.95591813e-09 -1.40867646e-04 6.96840571e-04] [-3.97997196e-09 4.12958746e-04 6.33384360e-04]] Final stress: [9.48155399e-04 1.82457050e-03 9.67020804e-04 7.09394109e-04 1.68293549e-10 9.89925702e-13] Minimization converged after 49 steps. Minimization converged after 50 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-1.23998612e-03 3.19245616e-03 -1.00844504e-03] [ 1.23998565e-03 -3.19217238e-03 -1.04146907e-03] [ 1.24036802e-03 -3.19249764e-03 9.78605029e-04] [-1.23995592e-03 3.19228549e-03 1.04491920e-03] [ 2.38351289e-08 -2.16352859e-06 -5.14039486e-07] [ 1.57225410e-06 9.93397729e-07 -3.52226449e-07] [-1.62994737e-06 1.05148836e-06 -3.60463625e-07] [ 2.46379702e-07 -1.45428218e-05 5.72844218e-06] [ 1.21929170e-05 6.95623072e-06 5.49438430e-06] [-1.28524564e-05 7.61550835e-06 5.76320722e-06] [-3.01806483e-02 -7.12615697e-03 1.03964668e-05] [ 8.24822043e-03 -3.08691666e-02 1.06839427e-05] [ 3.63750683e-03 7.02237015e-03 1.08197103e-05] [ 3.01809237e-02 7.10994492e-03 -7.19172173e-06] [-8.23417304e-03 3.08769919e-02 -7.42778456e-06] [-3.65198147e-03 -7.01400036e-03 -7.45772281e-06] [ 3.72559550e-03 6.72246723e-03 -3.94801048e-03] [-3.72551143e-03 -6.72242195e-03 -3.94944478e-03] [-3.72557838e-03 -6.72242374e-03 3.94850967e-03] [ 3.72554249e-03 6.72247623e-03 3.94950381e-03] [ 1.22248641e-03 -1.09120953e-03 4.71467733e-03] [-1.22234009e-03 1.09115824e-03 4.71410782e-03] [-1.22238077e-03 1.09116370e-03 -4.71465897e-03] [ 1.22237346e-03 -1.09117506e-03 -4.71387672e-03]] Final stress: [ 4.17201428e-04 1.63334713e-03 5.49928147e-04 -1.30694530e-09 2.67774076e-09 5.81613119e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 1.09555293e-03 3.24566840e-03 -8.90220501e-04] [-1.09548846e-03 -3.24549064e-03 -9.37588386e-04] [-1.09576730e-03 -3.24605206e-03 8.61804175e-04] [ 1.09537393e-03 3.24563755e-03 9.29695820e-04] [-1.42233491e-07 7.96238745e-07 1.15697858e-06] [-8.35952327e-07 -3.08198365e-07 1.21693767e-06] [ 1.10821139e-06 -6.27431024e-07 1.41930786e-06] [-1.23555631e-07 -1.55746193e-05 5.74051486e-06] [ 1.43937127e-05 8.15575687e-06 6.05436683e-06] [-1.40005948e-05 7.78248193e-06 6.00885583e-06] [ 3.04521372e-02 -7.26452994e-03 1.23796210e-05] [-3.84632269e-03 7.15277740e-03 1.29087196e-05] [-8.36928754e-03 -3.13377506e-02 1.28192341e-05] [-3.04521970e-02 7.25951318e-03 -8.01586361e-06] [ 3.85095600e-03 -7.15016690e-03 -8.29327104e-06] [ 8.36479418e-03 3.13402329e-02 -8.21354629e-06] [-3.77448939e-03 6.82554502e-03 -4.01051275e-03] [ 3.77440686e-03 -6.82554051e-03 -4.01198209e-03] [ 3.77444823e-03 -6.82551192e-03 4.01096146e-03] [-3.77438941e-03 6.82552293e-03 4.01231002e-03] [-1.27476931e-03 -1.10983743e-03 4.80302896e-03] [ 1.27461635e-03 1.10977598e-03 4.80240987e-03] [ 1.27466272e-03 1.10977914e-03 -4.80301818e-03] [-1.27463687e-03 -1.10979676e-03 -4.80207025e-03]] Final stress: [ 4.14160771e-04 1.64044937e-03 5.51131246e-04 -1.47516747e-09 -3.15400443e-09 -5.83463190e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.86309708e-03 -4.30002252e-04 4.53094045e-03] [ 1.86317639e-03 4.30023486e-04 4.53196786e-03] [ 1.86316574e-03 4.30027659e-04 -4.52664905e-03] [-1.86311278e-03 -4.30062357e-04 -4.52776603e-03] [ 7.74462867e-09 3.11559582e-07 -4.99249794e-07] [-2.82044661e-07 -1.62785343e-07 -5.06601232e-07] [ 2.38533745e-07 -1.27075842e-07 -5.54056063e-07] [ 9.91546328e-08 -1.95746572e-07 -5.32967235e-07] [ 7.14427549e-08 -1.77756411e-08 -6.09940833e-07] [-2.56573164e-07 2.05121994e-07 -4.91459479e-07] [ 2.01433881e-02 -1.75065279e-03 -9.63694298e-07] [-6.58483328e-03 8.23256630e-03 -9.65955012e-07] [-8.18798242e-03 -2.93921679e-02 -9.87408419e-07] [-2.01433493e-02 1.75066483e-03 -5.45313217e-07] [ 6.58478288e-03 -8.23261771e-03 -6.05529247e-07] [ 8.18794826e-03 2.93922114e-02 -6.05793999e-07] [-3.07855923e-03 9.22384044e-03 -2.94907880e-03] [ 3.07856925e-03 -9.22383902e-03 -2.94905346e-03] [ 3.07855806e-03 -9.22384651e-03 2.94892988e-03] [-3.07854561e-03 9.22384542e-03 2.94890364e-03] [ 9.27908604e-04 -3.72070711e-03 3.88571394e-03] [-9.27902303e-04 3.72070477e-03 3.88572812e-03] [-9.27894040e-04 3.72071167e-03 -3.88587548e-03] [ 9.27900532e-04 -3.72071367e-03 -3.88589310e-03]] Final stress: [-1.74658080e-03 -1.59977381e-03 -1.14297570e-03 1.26895718e-10 -9.98496309e-12 8.51148423e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-6.38190044e-03 5.84454718e-03 -7.04805243e-03] [ 6.38188699e-03 -5.84460651e-03 -7.04852260e-03] [ 6.38188755e-03 -5.84470542e-03 7.04745369e-03] [-6.38193493e-03 5.84463372e-03 7.04876611e-03] [ 1.77094347e-08 3.39579290e-07 1.26640047e-08] [-5.13184378e-07 -2.12442798e-07 5.96844470e-08] [ 5.08299757e-07 -1.86393633e-07 9.12214145e-08] [-5.22441048e-08 -6.80798900e-07 1.01857973e-07] [ 1.02624801e-06 4.86351962e-07 3.26210017e-07] [-9.27048952e-07 3.69583237e-07 2.84672443e-07] [-3.00174133e-02 -2.36570356e-03 7.92866544e-08] [ 5.10404686e-03 -3.99820972e-02 8.42296746e-08] [ 2.67103901e-02 1.27610025e-02 1.03045947e-07] [ 3.00174054e-02 2.36562343e-03 -2.32866285e-07] [-5.10389565e-03 3.99821709e-02 -2.60418037e-07] [-2.67105157e-02 -1.27609553e-02 -2.08838947e-07] [ 1.92306972e-03 1.14479556e-02 -2.18246944e-03] [-1.92307330e-03 -1.14479578e-02 -2.18248978e-03] [-1.92306754e-03 -1.14479341e-02 2.18245176e-03] [ 1.92306440e-03 1.14479280e-02 2.18247411e-03] [ 1.06475364e-03 -4.94882733e-03 8.10194658e-04] [-1.06475938e-03 4.94881901e-03 8.10181890e-04] [-1.06476301e-03 4.94881767e-03 -8.10221405e-04] [ 1.06475880e-03 -4.94882671e-03 -8.10207312e-04]] Final stress: [-1.88948765e-03 -1.36650294e-03 -1.08298195e-03 6.26350166e-11 4.64656331e-11 -6.72996939e-04] Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 52 steps. Minimization converged after 51 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 2.26983905e-05 -4.23896690e-04 -2.47145271e-05] [ 2.26988906e-05 4.23895697e-04 -2.46290347e-05] [-2.26983800e-05 4.23895901e-04 2.47645372e-05] [-2.26993934e-05 -4.23896248e-04 2.47010890e-05] [-8.21860366e-11 -7.63870577e-08 -2.22310521e-08] [ 6.63033404e-08 3.84539123e-08 -2.21562525e-08] [-6.59817092e-08 3.81783440e-08 -2.25153199e-08] [-8.12385269e-10 -2.56678425e-08 -1.33615397e-09] [ 2.51057515e-08 1.41687188e-08 6.93077817e-11] [-2.36560208e-08 1.23701600e-08 -8.69794684e-10] [ 2.71283718e-10 8.53102247e-04 -2.11513539e-08] [-1.17175551e-04 1.15057106e-03 -1.93503514e-04] [ 1.17174399e-04 1.15057201e-03 1.93460382e-04] [-5.28346700e-10 -8.53019130e-04 5.14743054e-09] [ 1.17105227e-04 -1.15061211e-03 1.93486888e-04] [-1.17104027e-04 -1.15061337e-03 -1.93476306e-04] [ 6.63924444e-04 -2.27104219e-04 -1.24153920e-03] [ 6.63924474e-04 2.27104189e-04 -1.24153638e-03] [-6.63924615e-04 2.27104299e-04 1.24153680e-03] [-6.63924420e-04 -2.27104322e-04 1.24153614e-03] [-3.75553892e-04 -8.18127823e-04 2.88850009e-04] [-3.75554174e-04 8.18127623e-04 2.88853316e-04] [ 3.75554009e-04 8.18127622e-04 -2.88852969e-04] [ 3.75554000e-04 -8.18127848e-04 -2.88852183e-04]] Final stress: [ 9.60540225e-04 8.10533701e-04 1.83164695e-03 -5.00740372e-13 -7.34761287e-04 7.26883552e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-2.27126334e-05 -4.24006202e-04 -2.46666732e-05] [-2.27126012e-05 4.24006426e-04 -2.46522379e-05] [ 2.27099204e-05 4.24008149e-04 2.48067803e-05] [ 2.27104785e-05 -4.24005912e-04 2.47533403e-05] [-1.73323891e-09 -9.59790305e-08 -3.21007836e-08] [ 8.37416896e-08 4.98695074e-08 -3.31535783e-08] [-7.99209859e-08 4.56486815e-08 -2.94354153e-08] [-1.33678165e-09 6.78406153e-09 -1.40183039e-08] [-7.05315018e-09 -2.49217602e-09 -1.45300966e-08] [ 1.01390478e-08 -5.82803883e-09 -1.70897756e-08] [-6.87616963e-10 8.53447404e-04 -2.06225498e-08] [-1.17487362e-04 1.15085074e-03 1.93473375e-04] [ 1.17489536e-04 1.15084866e-03 -1.93517281e-04] [-6.04659933e-10 -8.53284895e-04 -9.71353056e-09] [ 1.17345604e-04 -1.15093070e-03 -1.93504292e-04] [-1.17344039e-04 -1.15093229e-03 1.93485928e-04] [-6.64030585e-04 -2.27239497e-04 -1.24173087e-03] [-6.64030842e-04 2.27239637e-04 -1.24172745e-03] [ 6.64030450e-04 2.27239659e-04 1.24172578e-03] [ 6.64030102e-04 -2.27239369e-04 1.24172762e-03] [ 3.75637786e-04 -8.18145988e-04 2.88886401e-04] [ 3.75638130e-04 8.18146047e-04 2.88888669e-04] [-3.75638383e-04 8.18146155e-04 -2.88889774e-04] [-3.75638106e-04 -8.18146030e-04 -2.88888657e-04]] Final stress: [ 9.60546676e-04 8.10511385e-04 1.83165505e-03 -5.09296911e-12 7.34780522e-04 -1.85506085e-13] Minimization converged after 41 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 7.53921743e-03 -1.97900458e-03 2.58926405e-03] [-7.53923399e-03 1.97899710e-03 2.59792230e-03] [-7.53932353e-03 1.97892342e-03 -2.58871837e-03] [ 7.53923209e-03 -1.97891604e-03 -2.59802086e-03] [-2.14540011e-08 -8.99038683e-07 -2.65737277e-07] [ 7.24186428e-07 4.48603724e-07 -2.14985301e-07] [-6.75368759e-07 3.94166773e-07 -1.70953684e-07] [-6.84970574e-08 -1.49451919e-06 1.38935902e-07] [ 1.46763634e-06 8.59154669e-07 2.75265860e-07] [-1.30345642e-06 6.86748541e-07 1.23416272e-07] [ 3.80479450e-02 -7.28688587e-03 -1.67431541e-06] [-9.47831687e-03 1.39826884e-02 -1.62422684e-06] [-1.36810818e-02 -2.76078285e-02 -1.67941400e-06] [-3.80479606e-02 7.28995120e-03 1.53429481e-06] [ 9.47567552e-03 -1.39842081e-02 1.60527264e-06] [ 1.36837415e-02 2.76062908e-02 1.60398226e-06] [-1.87675477e-03 7.30168523e-03 -5.07204068e-03] [ 1.87672152e-03 -7.30169756e-03 -5.07177674e-03] [ 1.87674560e-03 -7.30168030e-03 5.07198409e-03] [-1.87674838e-03 7.30168324e-03 5.07181034e-03] [ 1.72437112e-03 -2.06182815e-03 3.19118791e-03] [-1.72437657e-03 2.06182696e-03 3.19137337e-03] [-1.72435371e-03 2.06182994e-03 -3.19128075e-03] [ 1.72437728e-03 -2.06182235e-03 -3.19135620e-03]] Final stress: [ 1.51557138e-04 1.04542066e-03 1.57378203e-03 -5.05998169e-11 -4.87790994e-10 7.69932783e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-9.21301934e-03 -2.77936747e-03 3.11579429e-03] [ 9.21299914e-03 2.77938906e-03 3.12566935e-03] [ 9.21311410e-03 2.77938401e-03 -3.11140300e-03] [-9.21299179e-03 -2.77936120e-03 -3.12228274e-03] [ 5.73524017e-08 1.38927967e-06 -1.13364084e-07] [-1.22885469e-06 -7.53753536e-07 -1.13414145e-07] [ 1.16504019e-06 -6.45749775e-07 -1.01948762e-07] [ 3.72777508e-08 6.98662555e-07 -8.00882160e-07] [-5.79980477e-07 -3.91422763e-07 -8.16505554e-07] [ 5.01835239e-07 -3.03711673e-07 -7.76524561e-07] [-4.42799015e-02 -8.14597659e-03 -2.59425557e-06] [ 1.56947344e-02 -3.09485649e-02 -2.67797955e-06] [ 1.18885485e-02 1.64289224e-02 -2.57790612e-06] [ 4.42799793e-02 8.14246845e-03 1.12309606e-06] [-1.56918665e-02 3.09501862e-02 1.14900130e-06] [-1.18915883e-02 -1.64270825e-02 1.12152721e-06] [ 2.26976812e-03 8.52339882e-03 -5.41189594e-03] [-2.26975022e-03 -8.52340703e-03 -5.41171686e-03] [-2.26976208e-03 -8.52340083e-03 5.41182454e-03] [ 2.26975004e-03 8.52340974e-03 5.41149620e-03] [-1.63428176e-03 -2.15271896e-03 2.55105250e-03] [ 1.63431372e-03 2.15271991e-03 2.55119313e-03] [ 1.63429003e-03 2.15272290e-03 -2.55119504e-03] [-1.63428853e-03 -2.15271533e-03 -2.55135728e-03]] Final stress: [ 1.34099254e-04 1.12178216e-03 1.61967037e-03 -4.39039405e-11 3.67834526e-10 -7.71681391e-04] Minimization converged after 79 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 87 steps. Final forces: [[-1.48471111e-03 4.08897039e-04 1.91066701e-03] [-1.28447403e-03 1.98044649e-04 -5.88621864e-04] [-1.16558907e-03 2.25817199e-04 5.90932189e-04] [-1.30766022e-03 7.04481510e-04 -1.89813696e-03] [-1.36952452e-04 1.12111344e-03 -9.61248310e-05] [-1.76063715e-03 -1.44002803e-03 -2.28823854e-03] [ 6.97617673e-04 -9.22106497e-04 -2.64289056e-04] [-1.41608474e-04 1.09005678e-03 8.76534786e-04] [-1.58224094e-03 -1.33702775e-03 1.99034968e-03] [ 5.48010511e-04 -9.86490238e-04 -1.43658582e-04] [-3.87624197e-04 1.16165279e-04 -2.95992421e-04] [ 4.14306381e-03 -4.72813218e-03 -6.63762924e-04] [ 1.35276098e-03 3.48828771e-03 9.11989214e-04] [-2.15748719e-03 9.37286795e-04 -3.50507362e-04] [ 4.17557216e-03 -4.24323769e-03 -2.43096304e-04] [ 2.56526162e-03 2.76955071e-03 5.15609527e-04] [-1.44516102e-04 -8.12708155e-04 8.86399606e-05] [ 1.13523105e-04 5.49222459e-04 -9.80022853e-05] [ 8.02694871e-05 -6.39200080e-04 8.67578555e-05] [-4.26255956e-04 1.10266893e-03 -8.66243368e-05] [-2.75525417e-04 2.83678557e-04 2.84359464e-04] [-5.60240294e-04 7.57168362e-04 9.23296983e-04] [-5.18580795e-04 2.43373592e-04 -9.13690914e-04] [-3.41975930e-04 1.11311761e-03 -2.48390283e-04]] Final stress: [ 3.56653041e-02 3.56599946e-02 1.43610509e-01 -7.55467755e-07 -2.84989969e-07 -1.18230691e-03] Minimization converged after 45 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 126 steps. Final forces: [[-1.00195454e-03 -1.00042244e-03 2.74984125e-04] [ 1.12527794e-04 9.03360258e-04 -3.70321601e-04] [-1.06317484e-03 -8.54894088e-04 2.95930330e-04] [ 9.78900393e-05 2.49347048e-04 2.47374280e-05] [-2.76746071e-04 2.30972520e-04 -3.11273718e-04] [-4.74868487e-04 -4.35193761e-04 3.69796705e-04] [ 3.33315310e-04 -5.06191760e-04 -5.00394786e-04] [ 6.47605112e-04 2.41192931e-04 -9.02185870e-04] [ 1.75622656e-04 -6.58549414e-05 1.02078930e-05] [ 7.18244312e-04 -3.51426724e-04 4.84448563e-04] [ 3.05002077e-04 5.91611683e-04 1.98555842e-04] [ 7.06905526e-04 -9.34344264e-04 -4.24046639e-05] [-5.56120028e-04 3.17781684e-04 2.22141045e-05] [ 4.72019289e-04 -1.63020355e-04 1.13503338e-04] [-2.81102437e-04 7.82541959e-04 1.15978076e-04] [ 9.22550187e-04 2.38223106e-04 4.15109218e-04] [-1.19421222e-04 -2.76886660e-04 9.52399024e-07] [-3.14034038e-04 1.32747531e-04 2.49092862e-04] [ 1.50943167e-04 -9.68658776e-05 5.41590142e-05] [-1.41184315e-04 3.55477644e-04 -2.38679178e-04] [-9.97280428e-05 -2.03277549e-04 -6.32610470e-05] [-1.99689253e-04 1.62055617e-04 5.89659572e-05] [-6.54976233e-04 1.66964877e-04 -6.33111227e-05] [ 5.40374038e-04 5.16101567e-04 -1.96803869e-04]] Final stress: [ 3.52144175e-02 3.47185614e-02 1.42684801e-01 4.93132654e-04 -2.13307325e-04 7.28923940e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 124 steps. Final forces: [[ 7.33628994e-03 -8.80386681e-03 8.07940867e-03] [ 2.72898747e-03 8.11125496e-03 -2.07945239e-02] [ 7.66462186e-03 -8.24095601e-03 7.19366075e-03] [ 2.02578554e-03 8.81419054e-03 -2.14677698e-02] [ 2.25273612e-03 -3.63322875e-03 2.35990742e-03] [-1.85812116e-04 -3.23171126e-03 2.80336653e-03] [-6.77324111e-04 -2.34115813e-03 6.42587682e-03] [-4.62284223e-03 1.98737804e-04 -1.12485896e-02] [-5.91737153e-03 -2.77961523e-03 4.05429863e-03] [-1.27786966e-03 1.26418260e-03 -2.30780747e-03] [ 1.35399528e-03 5.36179338e-05 3.86652390e-03] [-5.58694808e-03 6.43848855e-04 4.38855996e-03] [-4.56826082e-03 6.82989801e-04 3.38287491e-03] [-1.55123608e-03 1.32116558e-03 4.23957113e-03] [-3.28419593e-03 1.02740158e-03 4.19055970e-03] [-4.04503636e-03 -1.65907135e-03 3.54720225e-03] [-1.08876423e-04 -1.05196068e-03 1.16941993e-04] [ 2.63200109e-03 2.63031585e-03 9.67074150e-04] [ 4.78739127e-04 -7.78424311e-04 7.53185336e-04] [ 1.97391965e-03 1.55128265e-03 4.36994437e-05] [ 2.04633206e-03 -4.74765387e-04 -1.31751159e-03] [-3.69807693e-05 3.15415176e-03 1.20020343e-03] [ 2.14467969e-03 2.69160325e-04 -1.11804587e-03] [-7.75333699e-04 3.27245767e-03 6.41333170e-04]] Final stress: [ 3.52181275e-02 3.47248418e-02 1.42673851e-01 4.91060004e-04 2.14144542e-04 -6.95085618e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.86330114e-03 1.17405009e-03 -9.61115843e-04] [-8.92216051e-04 3.24201069e-03 -1.40366276e-03] [-1.78416057e-03 3.42123817e-04 2.11122551e-03] [-2.20146242e-03 2.29894516e-03 2.45669609e-03] [-2.11307634e-03 4.87988216e-04 1.00586381e-04] [-2.50324366e-03 -1.92506502e-03 -4.54148518e-05] [ 1.75310108e-03 1.42402817e-03 -2.97130251e-04] [ 4.53447891e-05 -4.39487201e-03 5.22454227e-04] [ 7.47842808e-04 1.50572940e-03 -1.58111672e-03] [ 3.44602887e-03 -1.90825838e-03 -6.33741798e-05] [ 1.57869089e-03 -5.42272609e-04 7.58297497e-04] [ 8.10341282e-04 -5.82754928e-04 -3.49237501e-04] [-2.24510146e-04 -5.89598227e-04 1.77006260e-03] [ 3.74961872e-03 2.22702014e-04 1.95054987e-03] [ 1.04936984e-03 1.30993046e-03 -7.01382948e-04] [ 5.23218356e-04 -1.71645058e-03 1.79530620e-03] [-6.20131860e-04 -6.25674084e-04 -1.12302195e-03] [ 2.41044686e-03 -4.86197906e-04 3.16672574e-05] [-1.14574655e-03 -9.80384403e-04 -1.45446762e-03] [ 1.99653012e-03 -9.14967154e-04 -1.10428735e-03] [ 1.98988134e-04 6.34939017e-04 1.25522523e-03] [-3.78988093e-03 1.55947851e-03 -2.23382687e-03] [ 3.65944041e-06 5.34272005e-04 1.63146160e-04] [-1.17545155e-03 -6.97022614e-05 -1.59717818e-03]] Final stress: [ 0.03327071 0.03233837 0.13481378 -0.00054023 0.00060699 -0.00081001] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-5.99447090e-04 -9.33346011e-04 1.82198981e-04] [-1.10637824e-04 -1.44677725e-04 -1.81478612e-04] [ 1.66820036e-04 -9.49313986e-05 -6.41148912e-04] [ 1.86981615e-03 -1.52500696e-04 1.15953452e-03] [ 1.42323188e-03 1.16492814e-03 -1.80291996e-03] [ 1.80931286e-04 4.29849935e-04 -7.44723382e-04] [-1.44280566e-04 -1.17594530e-03 -1.16827780e-03] [-5.75450383e-04 -1.74905812e-03 -3.74685350e-04] [ 7.89653013e-04 -3.32093954e-04 4.11927682e-04] [-7.69528312e-05 7.00584182e-04 -1.20551602e-03] [-8.62506613e-04 7.77038506e-04 2.98951926e-04] [ 2.52023696e-03 -1.01577824e-03 1.55144928e-03] [-9.41904661e-04 1.68469484e-03 6.81855312e-04] [ 2.56594724e-03 2.09305353e-03 8.53193248e-05] [-1.60064463e-03 2.03929189e-03 1.82206763e-03] [-1.60281173e-03 -1.73618956e-03 -5.17265774e-04] [-1.09730624e-03 -2.33212561e-04 -2.17802069e-04] [-4.08773736e-04 1.17099730e-05 4.82763817e-04] [-8.60150742e-04 -2.68832113e-04 5.74753540e-05] [-1.06532341e-04 -3.31948758e-04 5.34249200e-04] [-1.47969375e-04 -2.67000771e-04 -3.88158086e-04] [-5.05303706e-04 -2.27614320e-04 2.24291701e-04] [-4.80254586e-05 -3.85037484e-04 1.39694129e-04] [ 1.72061364e-04 1.47015991e-04 -3.89802896e-04]] Final stress: [ 3.35522224e-02 3.24257047e-02 1.35083089e-01 -5.16376968e-04 4.22729838e-04 4.79200415e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 106 steps. Final forces: [[-9.14114830e-06 -4.01975790e-04 8.38779199e-05] [-4.70655069e-04 -2.01308196e-04 -1.51876600e-04] [ 7.40981194e-06 -5.51045244e-04 2.39881357e-04] [-4.67405939e-04 2.03703644e-04 1.12968705e-04] [ 2.53433142e-04 -2.51756526e-04 6.60961981e-05] [-7.55957760e-04 -1.66619766e-05 -7.94556587e-04] [-1.22332736e-04 4.68050500e-05 1.08350874e-03] [-1.32977795e-04 2.73735276e-04 4.11680835e-05] [-1.02921080e-04 2.18467011e-04 3.12837504e-06] [ 1.84452563e-04 5.81407390e-05 1.08957262e-04] [ 2.25698036e-04 -8.28950971e-04 -2.16478581e-04] [ 3.36257810e-04 8.39730754e-04 6.66454299e-05] [ 1.64632199e-04 3.99764455e-04 -9.99469242e-05] [ 7.44149007e-04 2.46871008e-04 -3.40457214e-04] [ 1.62266904e-04 -1.60609039e-04 -1.56472552e-04] [-2.68149768e-04 7.42922055e-04 -2.86356139e-04] [ 1.82221889e-04 2.23096147e-04 -5.65886380e-04] [ 1.68325481e-04 -2.49387552e-04 7.51532566e-05] [ 1.79190096e-04 7.75658871e-05 3.92350642e-04] [ 5.02264847e-05 3.05056762e-05 -1.15436978e-04] [-1.90268927e-04 -2.28491321e-04 -1.17403738e-06] [-5.31448360e-05 1.43849507e-05 3.85259555e-05] [ 3.24211187e-05 -1.46534360e-04 2.73673599e-04] [-1.17729484e-04 -3.38971678e-04 1.42706472e-04]] Final stress: [ 3.48353839e-02 3.50581273e-02 1.42708146e-01 -1.29879819e-04 -3.51080556e-04 1.44813868e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 112 steps. Final forces: [[ 1.59183790e-04 -1.33478397e-04 1.98720578e-04] [ 3.64825044e-04 -1.67653601e-04 8.41336326e-05] [ 6.47491940e-05 -3.69815048e-04 2.19423795e-04] [ 3.51460576e-04 9.98873343e-05 2.13433729e-04] [-1.22822389e-04 -2.59181124e-03 2.50065644e-05] [ 2.18335037e-03 1.37871829e-03 -1.85619122e-05] [-2.56328145e-03 1.35040990e-03 -4.22953851e-05] [ 1.87794437e-04 -3.37817852e-04 -6.91086789e-04] [-6.52273850e-04 -8.46216504e-04 7.14318954e-04] [-4.79244437e-06 4.14334049e-04 3.46627948e-05] [-7.66627587e-04 -3.29441716e-04 -2.67424742e-04] [-4.06472069e-04 -2.66970781e-04 -1.71426233e-04] [ 5.38010277e-04 5.63527288e-04 -3.39990507e-05] [-7.57310805e-04 -7.17015717e-05 -1.78983959e-04] [-3.72100740e-04 -6.11106712e-05 -1.32863350e-04] [ 7.70348380e-04 1.06620864e-03 -9.43356142e-05] [ 2.00246693e-04 1.00624545e-04 -7.58205111e-04] [-5.48940129e-05 -2.57572173e-05 1.53365001e-04] [ 8.44052948e-05 -1.93654702e-05 7.21593782e-04] [ 1.91115494e-05 4.15611890e-04 -2.71994855e-04] [ 2.63577300e-04 6.79758229e-05 8.38462726e-05] [ 2.32770098e-04 -3.66012436e-05 8.45289601e-05] [ 1.45629339e-04 -1.16452366e-07 7.31335707e-05] [ 1.35113005e-04 -1.99439997e-04 5.50093673e-05]] Final stress: [ 3.48335257e-02 3.50572322e-02 1.42707116e-01 -1.29586967e-04 3.51788322e-04 -1.44855664e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 106 steps. Final forces: [[ 2.73934406e-04 2.43261970e-03 9.90664303e-04] [ 1.09071292e-03 8.64376014e-04 1.00796941e-04] [ 2.13322267e-04 2.18178548e-03 8.67215829e-04] [ 8.05313995e-04 1.96240245e-03 4.98133227e-04] [-8.47012079e-04 -1.13890500e-03 -1.94897610e-03] [ 2.18072008e-03 7.67090600e-04 7.99131275e-04] [-2.92071485e-03 1.88563781e-03 1.91387032e-03] [ 2.17633703e-04 -2.67402587e-03 5.51371287e-04] [ 2.18105243e-03 3.33153138e-04 -4.69300032e-04] [-2.06820762e-03 8.74743853e-04 2.20747517e-04] [-3.46200367e-03 -2.96350697e-03 -6.64079865e-04] [ 3.25194958e-03 -3.27590521e-03 -7.44867578e-04] [-1.29010339e-03 8.38142373e-04 -8.96002998e-04] [-3.88376931e-03 -2.51343817e-03 -6.96226844e-04] [ 3.33433196e-03 -2.84849524e-03 -3.54892899e-04] [-6.67229705e-04 1.55857581e-03 -9.63416941e-04] [-1.11655319e-04 -2.02967323e-04 -1.47055546e-05] [-4.96777497e-05 -8.20838845e-05 -1.16216093e-03] [ 2.82898944e-04 -7.84421186e-04 -2.66624238e-04] [ 2.84219186e-05 1.04238174e-04 8.58294358e-04] [ 3.55226350e-04 5.58096798e-04 3.63415912e-04] [ 6.31730666e-04 7.77748373e-04 3.77272318e-04] [ 5.22054875e-05 8.01549209e-04 3.37397531e-04] [ 4.00918995e-04 5.43589080e-04 3.02943158e-04]] Final stress: [3.48295663e-02 3.50569903e-02 1.42708325e-01 1.27869525e-04 3.50892933e-04 1.44778812e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 105 steps. Final forces: [[-1.55325232e-04 7.75244823e-04 -4.75047040e-04] [-1.17845896e-04 7.13727255e-04 4.49239554e-04] [ 6.82341585e-04 5.16512495e-05 -3.72625602e-05] [ 3.58541144e-04 1.60588779e-04 7.89624197e-04] [ 2.53321390e-04 -3.39947623e-04 -5.25139708e-04] [ 5.34223994e-04 1.63456612e-04 3.21922395e-04] [-6.99120159e-04 2.50589812e-04 -9.89627478e-06] [-2.21114253e-04 -3.68554228e-04 2.38196809e-04] [-1.72610732e-04 3.72162404e-04 8.75839669e-04] [-7.39716566e-04 -7.81144688e-05 -6.34356849e-04] [ 8.09799460e-04 -6.20780911e-04 -7.24791676e-05] [-3.87421853e-04 4.28429947e-04 -6.07075910e-04] [-1.13318704e-03 -1.28743477e-03 -1.53510298e-04] [ 7.57157804e-05 4.18844345e-04 -2.97529905e-04] [-5.33980370e-04 -4.07417487e-04 1.19154989e-04] [ 4.82048804e-04 -6.34525737e-04 -4.84396354e-05] [ 1.45962812e-04 4.65034805e-05 -7.09991249e-05] [ 2.67187112e-04 -3.70910569e-04 -4.61998882e-04] [-3.58788041e-06 -1.62238348e-04 -2.37226885e-05] [ 2.61437355e-04 1.78199120e-04 3.25961455e-04] [ 8.74430310e-05 -1.31557014e-04 3.33931139e-04] [-6.99857082e-05 5.16780498e-04 1.59050669e-06] [ 2.24513516e-04 4.56292822e-04 -1.08229785e-04] [ 5.13597112e-05 -1.30989995e-04 7.02271143e-05]] Final stress: [ 3.48360465e-02 3.50603065e-02 1.42707366e-01 1.29770662e-04 -3.53302389e-04 -1.44820251e-03] Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 6.29687657e-04 -4.57931854e-03 2.99069042e-04] [-1.82710199e-03 6.73101195e-03 4.87140484e-04] [-6.29687736e-04 4.57931857e-03 -2.98976659e-04] [ 1.82710367e-03 -6.73101230e-03 -4.86906773e-04] [ 1.55978890e-09 -1.57158082e-07 -5.09473510e-08] [ 1.35145148e-07 7.70904485e-08 -4.96421218e-08] [-1.37703283e-07 8.03637941e-08 -5.25532564e-08] [-5.35365779e-10 1.05084575e-07 -2.95292714e-08] [-9.07309877e-08 -5.20930288e-08 -3.00565858e-08] [ 9.14042656e-08 -5.30966001e-08 -2.86077191e-08] [ 8.86526519e-03 -1.38665182e-04 -5.68918993e-03] [-7.31110973e-03 7.10461370e-03 1.20472622e-03] [-5.95383567e-03 -1.14331404e-02 -2.89545167e-04] [-8.86526437e-03 1.38568610e-04 5.68916199e-03] [ 7.31119268e-03 -7.10456638e-03 -1.20475429e-03] [ 5.95375071e-03 1.14331899e-02 2.89516848e-04] [ 2.16663867e-03 6.61678786e-04 -1.23003980e-03] [-6.10606274e-04 6.67867064e-04 -5.62887198e-04] [-2.16663827e-03 -6.61678819e-04 1.23003968e-03] [ 6.10606293e-04 -6.67867089e-04 5.62884187e-04] [-4.26869797e-03 -8.09120277e-04 -1.14575314e-03] [-4.60982832e-03 1.15662963e-03 -6.50605237e-04] [ 4.26869766e-03 8.09120422e-04 1.14575436e-03] [ 4.60982867e-03 -1.15662979e-03 6.50606725e-04]] Final stress: [-1.47859356e-05 -4.81304372e-05 1.32494464e-04 1.80621466e-04 -7.54311562e-04 6.86474273e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-1.82714461e-03 -6.73134291e-03 4.86379211e-04] [ 6.28632622e-04 4.58082228e-03 3.00713511e-04] [ 1.82714703e-03 6.73134344e-03 -4.86010140e-04] [-6.28632815e-04 -4.58082231e-03 -3.00733349e-04] [-3.14747135e-11 -5.86950027e-09 5.45482548e-11] [ 5.11455363e-09 2.97217041e-09 7.46847584e-11] [-5.06167308e-09 2.90249019e-09 4.28832247e-11] [ 2.74599613e-09 2.74922458e-07 -8.60384221e-08] [-2.40807752e-07 -1.40559128e-07 -8.87288980e-08] [ 2.36421425e-07 -1.34862062e-07 -8.38053453e-08] [-8.86504959e-03 -1.39585779e-04 5.68823897e-03] [ 5.95390672e-03 -1.14334655e-02 2.89206038e-04] [ 7.31148673e-03 7.10483765e-03 -1.20453196e-03] [ 8.86505024e-03 1.39696210e-04 -5.68826886e-03] [-5.95400370e-03 1.14334091e-02 -2.89236517e-04] [-7.31139173e-03 -7.10489199e-03 1.20450200e-03] [-6.10884973e-04 -6.67906990e-04 -5.62900860e-04] [ 2.16656918e-03 -6.61655272e-04 -1.23000779e-03] [ 6.10884875e-04 6.67907011e-04 5.62897567e-04] [-2.16656868e-03 6.61655303e-04 1.23000768e-03] [-4.60995021e-03 -1.15665202e-03 -6.50633933e-04] [-4.26889902e-03 8.09057829e-04 -1.14573764e-03] [ 4.60995069e-03 1.15665229e-03 6.50638164e-04] [ 4.26889884e-03 -8.09057851e-04 1.14573630e-03]] Final stress: [-1.47874229e-05 -4.81280954e-05 1.32493060e-04 -1.80618724e-04 -7.54296801e-04 -6.86469777e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 1.82709290e-03 -6.72995230e-03 4.88289152e-04] [-6.30815579e-04 4.58092000e-03 2.97858272e-04] [-1.82709203e-03 6.72995216e-03 -4.88385069e-04] [ 6.30815113e-04 -4.58091994e-03 -2.97777587e-04] [ 6.73747213e-11 -2.83927414e-08 -1.21234028e-08] [ 2.45982145e-08 1.41692385e-08 -1.23559147e-08] [-2.45966555e-08 1.42487855e-08 -1.17377324e-08] [ 3.73302335e-10 -4.05751968e-08 1.57809873e-08] [ 3.48872443e-08 1.99137391e-08 1.54044075e-08] [-3.55903247e-08 2.07534870e-08 1.62626201e-08] [ 8.86597007e-03 -1.38448267e-04 5.68779948e-03] [-7.31123904e-03 7.10429171e-03 -1.20356369e-03] [-5.95326700e-03 -1.14334869e-02 2.91057423e-04] [-8.86596925e-03 1.38332131e-04 -5.68779823e-03] [ 7.31133927e-03 -7.10423442e-03 1.20356484e-03] [ 5.95316564e-03 1.14335459e-02 -2.91055848e-04] [ 6.10043005e-04 -6.67605585e-04 -5.62883666e-04] [-2.16675922e-03 -6.61518506e-04 -1.23021387e-03] [-6.10043233e-04 6.67605577e-04 5.62885520e-04] [ 2.16675959e-03 6.61518466e-04 1.23021218e-03] [ 4.60996116e-03 -1.15650047e-03 -6.50655773e-04] [ 4.26869836e-03 8.09367635e-04 -1.14588199e-03] [-4.60996094e-03 1.15650041e-03 6.50655465e-04] [-4.26869855e-03 -8.09367635e-04 1.14588217e-03]] Final stress: [-1.47929903e-05 -4.81333278e-05 1.32501172e-04 -1.80603032e-04 7.54344618e-04 6.86482713e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-6.27684434e-04 -4.58151120e-03 3.02191397e-04] [ 1.82711239e-03 6.73155415e-03 4.85278319e-04] [ 6.27684381e-04 4.58151121e-03 -3.02098294e-04] [-1.82711214e-03 -6.73155406e-03 -4.85337196e-04] [ 6.25257315e-10 6.11967632e-08 1.73370375e-08] [-5.35748337e-08 -3.12787889e-08 1.78830947e-08] [ 5.26414501e-08 -3.00190075e-08 1.68781752e-08] [ 4.47350826e-10 8.85032476e-08 -2.58990540e-08] [-7.69840437e-08 -4.47159867e-08 -2.51081624e-08] [ 7.64341486e-08 -4.38820951e-08 -2.63582952e-08] [-8.86471087e-03 -1.40412123e-04 -5.68769072e-03] [ 5.95405668e-03 -1.14334095e-02 -2.88743491e-04] [ 7.31164200e-03 7.10509324e-03 1.20454050e-03] [ 8.86471057e-03 1.40400228e-04 5.68768773e-03] [-5.95404614e-03 1.14334156e-02 2.88740590e-04] [-7.31165212e-03 -7.10508756e-03 -1.20454354e-03] [-2.16646503e-03 6.61655157e-04 -1.22994007e-03] [ 6.11169328e-04 6.67962917e-04 -5.62909824e-04] [ 2.16646502e-03 -6.61655165e-04 1.22994015e-03] [-6.11169406e-04 -6.67962925e-04 5.62909447e-04] [ 4.26899069e-03 -8.08963300e-04 -1.14568238e-03] [ 4.60997660e-03 1.15667355e-03 -6.50639001e-04] [-4.26899052e-03 8.08963414e-04 1.14568446e-03] [-4.60997657e-03 -1.15667349e-03 6.50637193e-04]] Final stress: [-1.47861869e-05 -4.81257967e-05 1.32490294e-04 1.80617813e-04 7.54280768e-04 -6.86466266e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 1.34735491e-02 2.54050038e-03 -2.18186298e-03] [-1.34735746e-02 -2.54050638e-03 -2.18526259e-03] [-1.34735694e-02 -2.54049731e-03 2.18427451e-03] [ 1.34735644e-02 2.54050163e-03 2.18403472e-03] [-2.69477624e-09 4.08785723e-07 1.93700651e-07] [-3.49982427e-07 -1.99617694e-07 1.91687716e-07] [ 3.58847863e-07 -2.07668675e-07 1.89600116e-07] [-2.43492268e-08 1.76336333e-06 -5.38235978e-07] [-1.50810214e-06 -8.55855973e-07 -5.44954492e-07] [ 1.55388140e-06 -9.10248245e-07 -5.31519332e-07] [ 8.55652082e-02 7.21862162e-03 2.62851824e-07] [-3.08718788e-02 2.61824786e-02 2.45917954e-07] [ 1.65142028e-03 -1.63071939e-02 2.60688144e-07] [-8.55652361e-02 -7.21714282e-03 -3.17417508e-07] [ 3.08706230e-02 -2.61831885e-02 -3.05311809e-07] [-1.65012748e-03 1.63064270e-02 -3.20643588e-07] [-2.16863661e-02 1.87431568e-04 -3.16464351e-03] [ 2.16863714e-02 -1.87431267e-04 -3.16465921e-03] [ 2.16863689e-02 -1.87431501e-04 3.16462192e-03] [-2.16863654e-02 1.87431972e-04 3.16468033e-03] [ 3.33701867e-03 -3.02514501e-03 4.85661504e-03] [-3.33702523e-03 3.02514482e-03 4.85657367e-03] [-3.33703044e-03 3.02514528e-03 -4.85658077e-03] [ 3.33702214e-03 -3.02514492e-03 -4.85657747e-03]] Final stress: [-7.16994269e-05 6.71010515e-05 -3.21555086e-04 -2.41492358e-11 3.33404630e-11 2.22085023e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.31738260e-02 2.33185505e-03 -2.21101974e-03] [ 1.31738361e-02 -2.33186365e-03 -2.21318185e-03] [ 1.31738300e-02 -2.33185271e-03 2.21206093e-03] [-1.31738495e-02 2.33186374e-03 2.21396058e-03] [-1.97859567e-08 -1.02161240e-06 -2.65810985e-07] [ 8.91661560e-07 5.30940139e-07 -2.59313047e-07] [-8.55593149e-07 4.87145881e-07 -2.60925656e-07] [ 1.18672091e-08 7.33099161e-07 -2.23621394e-07] [-6.46918021e-07 -3.80482317e-07 -2.21972453e-07] [ 6.26509823e-07 -3.54988783e-07 -2.28540635e-07] [-8.46999129e-02 7.40101795e-03 3.12923113e-07] [-1.43165305e-03 -1.58149394e-02 3.09503046e-07] [ 3.02244576e-02 2.57136346e-02 2.89540693e-07] [ 8.46999216e-02 -7.40038459e-03 -4.37072216e-07] [ 1.43111573e-03 1.58146197e-02 -4.37501895e-07] [-3.02239232e-02 -2.57139452e-02 -4.15582127e-07] [ 2.14149340e-02 1.02608090e-05 -3.05111310e-03] [-2.14149355e-02 -1.02606540e-05 -3.05115104e-03] [-2.14149330e-02 -1.02600441e-05 3.05109825e-03] [ 2.14149333e-02 1.02610528e-05 3.05115556e-03] [-3.35313558e-03 -2.97441748e-03 4.64942831e-03] [ 3.35313313e-03 2.97441650e-03 4.64940620e-03] [ 3.35313934e-03 2.97441714e-03 -4.64942059e-03] [-3.35313985e-03 -2.97441699e-03 -4.64938514e-03]] Final stress: [-6.86758314e-05 5.41506537e-05 -3.20180294e-04 -4.87711077e-11 -3.49129106e-11 -2.21675778e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 3.41361106e-11 1.25941242e-04 -1.67748852e-05] [ 3.78102525e-11 -1.25941224e-04 -1.67738661e-05] [-3.42125569e-11 -1.25941186e-04 1.67778298e-05] [-7.46633311e-12 1.25941283e-04 1.67768724e-05] [ 2.44768759e-11 2.26277386e-10 -3.69203557e-10] [-2.07453180e-10 -1.70720466e-10 -2.83753188e-10] [ 1.32655831e-10 -9.69664349e-11 -3.48150009e-10] [ 4.79194110e-11 5.92540905e-10 -4.89813745e-10] [-7.94609267e-10 -3.72050613e-10 -5.68175729e-10] [ 7.70059350e-10 -3.04208936e-10 -6.01363227e-10] [-1.38271061e-11 -2.01901479e-04 -6.40191291e-10] [ 5.06314590e-05 -2.08856338e-04 -6.46755088e-10] [-5.06314380e-05 -2.08856365e-04 -6.85227728e-10] [ 5.40070211e-11 2.01900016e-04 -3.45555564e-10] [-5.06302214e-05 2.08857017e-04 -3.37878278e-10] [ 5.06301351e-05 2.08857133e-04 -2.52622206e-10] [ 4.08689749e-12 -2.41823715e-04 -2.96932904e-04] [ 9.69202496e-12 2.41823722e-04 -2.96932907e-04] [-1.52822199e-12 2.41823708e-04 2.96932839e-04] [ 5.08623699e-12 -2.41823694e-04 2.96932792e-04] [-5.78292969e-12 3.16093206e-04 5.31966358e-04] [ 1.01742909e-11 -3.16093205e-04 5.31966358e-04] [-4.41150886e-13 -3.16093209e-04 -5.31966442e-04] [ 5.06927833e-13 3.16093212e-04 -5.31966477e-04]] Final stress: [ 2.19080709e-03 1.24725969e-03 1.15094152e-03 -2.36186034e-13 3.25501495e-13 -4.45236174e-14] Minimization converged after 26 steps. Minimization converged after 8 steps. Minimization converged after 25 steps. Minimization converged after 23 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[-2.23115288e-04 -1.78459947e-03 -3.67596907e-04] [ 4.20353804e-05 1.07709728e-03 4.73034525e-04] [ 5.14868831e-07 -1.79830473e-03 -3.56692482e-04] [ 8.62395591e-05 1.14192025e-03 4.41281358e-04] [-5.38734005e-05 4.70165175e-04 -2.17117328e-04] [ 9.68167442e-04 -1.13052714e-03 1.12434258e-03] [-8.15929249e-04 -1.28672475e-03 1.24142346e-03] [ 5.13293717e-05 -1.55075846e-04 -1.11216208e-03] [-4.57433764e-04 1.70096836e-03 -1.38586240e-03] [ 4.65906353e-04 1.73773353e-03 -1.49702262e-03] [ 1.74689366e-04 1.00386782e-03 7.06892001e-04] [ 4.23097189e-04 -6.44141230e-04 3.02598954e-04] [-7.22452863e-04 -2.74834909e-04 1.83825808e-04] [ 2.52978330e-05 1.03073824e-03 6.59575803e-04] [ 5.90547689e-04 -4.19690759e-04 4.25253564e-04] [-5.79521762e-04 -3.91296804e-04 2.21356020e-05] [-6.62314136e-07 -2.89061085e-04 -1.58083073e-04] [-1.32746074e-05 2.28086321e-04 2.43534206e-04] [ 1.32125541e-05 -2.41036393e-04 -1.05286837e-04] [-3.10909820e-06 1.01510108e-04 -1.45654313e-05] [ 1.98042960e-05 -2.75576171e-04 -2.22553801e-04] [-1.68748575e-05 2.50678584e-04 -1.57507906e-05] [ 1.51352250e-05 -2.73638122e-04 -5.33479009e-04] [ 1.02700757e-05 2.21741743e-04 1.62274906e-04]] Final stress: [ 6.72081164e-04 4.78616113e-04 2.78873438e-04 -6.20693390e-04 -7.25704080e-07 5.73836477e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 9.26174254e-05 -3.69351764e-04 6.86395992e-04] [-1.06107002e-04 -1.14897332e-04 5.28371784e-04] [ 3.24670126e-05 -6.17624176e-04 5.71313271e-04] [-2.61739800e-04 1.21084623e-04 6.24748489e-04] [ 1.05876638e-04 -2.31065828e-03 -1.09086858e-05] [ 1.28721955e-03 -5.91849446e-04 -4.55582218e-04] [-1.22270535e-03 -5.10970112e-04 -1.70561263e-04] [-7.80097253e-05 1.26091270e-03 1.86168407e-03] [-3.63646189e-04 -1.17105924e-03 -1.16507492e-03] [ 4.54928472e-04 -1.29870523e-03 -1.17094938e-03] [ 9.08630328e-05 7.11154759e-04 1.11476734e-03] [-8.06491777e-05 1.04171274e-03 -8.84512149e-04] [-3.49080371e-05 1.18094711e-03 -7.60895169e-04] [-1.21375018e-04 7.93438099e-04 7.58132526e-04] [ 1.41516547e-04 1.16571067e-03 -9.32464653e-04] [ 8.31053551e-05 9.59115125e-04 -5.78067557e-04] [ 5.93302001e-06 -3.92650175e-04 5.05527249e-05] [ 8.85209232e-06 -3.10858408e-04 -1.18276832e-05] [-1.97036311e-06 -3.70870572e-04 -1.24675287e-04] [-2.76207126e-06 -2.20691275e-04 8.37943264e-05] [ 8.11855553e-06 1.42710016e-04 -1.02828341e-04] [-1.44159967e-05 3.13562558e-04 8.80644084e-05] [-2.26443440e-05 2.67952628e-04 -4.54284570e-05] [-5.64630007e-07 3.21884988e-04 4.59508301e-05]] Final stress: [6.69409883e-04 4.77510365e-04 2.80106020e-04 6.12344948e-04 6.02441275e-07 2.36114537e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 68 steps. Final forces: [[ 1.02635990e-04 -7.82515437e-04 -6.01428768e-04] [ 9.88797022e-04 -1.50406585e-04 5.38886905e-04] [-8.85511881e-04 -7.25789004e-04 -5.86475746e-04] [-5.30567820e-04 -2.54721613e-04 5.38704814e-04] [ 5.40739270e-04 3.84110073e-04 1.39221825e-03] [ 8.38003281e-04 1.84859346e-04 9.83583815e-04] [-6.11572736e-04 1.55975070e-04 2.31069025e-03] [-1.17458615e-04 1.06108756e-03 -8.99641223e-04] [-9.63491951e-04 2.50970137e-03 -1.83670656e-03] [ 2.07201374e-04 2.43292792e-03 -2.04732296e-04] [ 4.03698308e-05 -3.57717843e-04 1.93618439e-03] [ 1.19725795e-04 -8.12983493e-04 2.07817992e-04] [-1.69949100e-04 -7.17569181e-04 -2.85348116e-03] [-1.23803497e-03 -4.84534848e-04 2.05284726e-03] [ 1.05130697e-03 -8.39194587e-04 -1.13167123e-03] [ 7.09584921e-04 -1.07290310e-03 -1.53737618e-03] [ 1.69883936e-04 -1.01353879e-04 1.59487430e-05] [-5.02087757e-05 2.85270148e-04 -2.97385224e-04] [ 7.75711416e-05 -3.71062939e-04 -3.66236498e-04] [-1.88270394e-04 6.86895357e-04 4.70226442e-04] [ 2.11305241e-04 -4.72144634e-04 -2.29914525e-04] [-1.43852317e-04 4.59059334e-06 1.80982827e-04] [ 2.06899711e-05 -6.37788093e-04 -3.94827034e-04] [-1.78896185e-04 7.52677929e-05 3.11784754e-04]] Final stress: [-1.36009821e-03 -6.59182906e-04 -6.75759056e-04 -5.76751198e-04 6.89218624e-06 2.20076386e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[ 1.27686146e-04 -1.50799631e-05 -3.26856984e-04] [-1.13389672e-04 2.37916072e-04 -1.88738881e-04] [-2.06921216e-04 -2.44284221e-05 -2.87390589e-04] [ 4.16940919e-05 -7.32710203e-05 -1.86219549e-04] [ 7.44524024e-04 -4.84493547e-04 1.05422213e-03] [ 7.52410973e-04 2.49448344e-04 -8.99918804e-05] [-9.26851440e-04 1.44039132e-03 5.21818338e-04] [-1.86877182e-03 -1.93354801e-04 7.57030078e-04] [ 1.49189014e-03 -6.92943075e-04 -2.65038502e-04] [-4.68545997e-04 7.54728190e-04 -1.99950562e-04] [-5.84589676e-04 5.43852761e-04 -9.17573270e-04] [ 1.02734578e-03 1.57127929e-04 7.52402874e-04] [ 9.33332919e-05 -1.29369209e-03 -3.69460623e-04] [ 2.03436414e-04 4.86708955e-04 -5.46414796e-04] [ 5.94403594e-05 -1.41252228e-03 4.90417762e-04] [-5.10570468e-04 5.89078817e-04 -4.44591555e-04] [ 1.60912596e-04 2.12746586e-04 -1.54025622e-04] [-1.09679723e-04 -2.49232392e-04 1.68560932e-05] [ 1.60208125e-04 3.91464336e-05 1.23946872e-04] [-1.12734750e-04 -5.61330640e-06 1.62278050e-05] [ 6.90671237e-05 6.09926531e-05 1.94735703e-05] [-5.25652818e-05 -1.32676897e-04 8.35179328e-05] [ 2.13912446e-04 -2.33542102e-05 4.55327916e-06] [-1.91241471e-04 -1.71476056e-04 1.35786081e-04]] Final stress: [-1.36159911e-03 -6.52288395e-04 -6.73410848e-04 5.83653557e-04 5.01604943e-07 5.07088958e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.43346189e-05 -1.02891905e-04 1.01852801e-04] [-1.50231892e-05 1.03398012e-04 -1.15015483e-04] [ 1.33422879e-05 1.02905614e-04 -6.27352895e-05] [ 1.42282113e-05 -1.02955446e-04 1.08948354e-04] [-3.46129561e-08 -3.01887523e-05 -5.09315786e-06] [ 2.48327060e-05 1.49291087e-05 -4.55156050e-06] [-2.45647636e-05 1.47303516e-05 -4.32110927e-06] [-8.34579402e-07 3.84075976e-05 -9.53196523e-06] [-3.19412227e-05 -1.81888440e-05 -8.89268696e-06] [ 3.36902714e-05 -2.01633138e-05 -9.93240581e-06] [-6.97480270e-07 2.19466755e-04 3.55073846e-05] [-2.30965436e-04 1.37637893e-05 -1.43249721e-06] [ 2.33027420e-04 1.17717593e-05 7.31371829e-05] [-5.67452894e-07 -1.73655444e-04 -3.35854227e-05] [ 1.92345955e-04 -3.52981969e-05 3.19562463e-06] [-1.91964199e-04 -3.61748528e-05 -7.11063748e-05] [ 3.15845995e-05 3.00287846e-04 1.68702193e-04] [ 3.16965105e-05 -3.00227787e-04 1.64958534e-04] [-3.16609916e-05 -3.00175318e-04 -1.69003058e-04] [-3.18266262e-05 3.00194456e-04 -1.63737493e-04] [-7.05929137e-05 -4.14516476e-05 -5.28098812e-04] [-7.05472621e-05 4.14698270e-05 -5.31347617e-04] [ 7.04730233e-05 4.15006973e-05 5.29377763e-04] [ 7.03343633e-05 -4.14543069e-05 5.32705097e-04]] Final stress: [ 1.13236298e-03 6.00601353e-04 6.09352959e-04 3.87659114e-10 -4.27368711e-04 -7.57980672e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 2.06406073e-06 -7.06656543e-06 1.19020925e-05] [ 2.11156232e-06 7.09712041e-06 -2.47387446e-05] [-1.92871646e-06 7.20470910e-06 -2.09880836e-05] [-2.04902363e-06 -7.12386949e-06 6.96446841e-06] [ 3.61519499e-08 8.59031556e-06 3.52490633e-06] [-7.57426425e-06 -4.34910330e-06 3.59448079e-06] [ 7.49427332e-06 -4.26106006e-06 3.48685451e-06] [ 1.02028249e-07 -3.75871896e-06 1.89131933e-06] [ 2.89685317e-06 1.69945912e-06 1.66243656e-06] [-3.12091258e-06 1.94646892e-06 1.85081159e-06] [-4.80838046e-08 1.56093807e-05 7.48970499e-06] [-7.17543428e-07 2.43541965e-05 3.54462396e-06] [ 6.44738879e-07 2.43407483e-05 1.13160695e-05] [ 6.15700280e-08 -1.20606067e-05 -4.08848756e-06] [-2.42690439e-06 -2.61756698e-05 -2.62224982e-07] [ 2.39574539e-06 -2.60861949e-05 -7.99876713e-06] [-3.15929136e-06 3.13050607e-05 5.19348906e-06] [-3.17785235e-06 -3.12880452e-05 4.49783589e-06] [ 3.17516207e-06 -3.12950015e-05 -4.98681514e-06] [ 3.20383984e-06 3.13104846e-05 -4.18301749e-06] [ 1.22730615e-05 -3.55312605e-05 -4.24878927e-05] [ 1.22754760e-05 3.55335304e-05 -4.30765605e-05] [-1.22676301e-05 3.55379635e-05 4.26947596e-05] [-1.22643011e-05 -3.55333421e-05 4.31967406e-05]] Final stress: [ 1.12355435e-03 6.19168236e-04 6.09164283e-04 -1.30578154e-10 4.10044108e-04 6.23914632e-11] Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 188 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 84 steps. Final forces: [[ 2.41887815e-04 2.64116922e-05 3.41044396e-04] [-1.46773600e-04 -2.78289689e-04 -7.35056791e-04] [ 2.36752496e-04 2.83762835e-04 -4.32020572e-04] [-2.68218497e-04 -1.88430771e-05 1.78259304e-04] [ 2.61863248e-04 -1.06524521e-03 -6.89841073e-04] [-1.00049638e-03 1.92774429e-04 1.19547526e-04] [ 8.05691255e-04 5.68083837e-04 -3.90837639e-04] [ 4.59296872e-04 -5.05698554e-04 4.78571805e-04] [-8.17117741e-04 -3.08287415e-04 8.69335137e-04] [ 5.84068001e-05 6.87696542e-04 4.55423566e-04] [ 2.04776713e-04 -7.90823270e-04 1.10449912e-03] [ 7.59498305e-04 5.47360698e-04 -6.44991033e-05] [-9.79463200e-04 4.55010658e-04 -1.68334898e-04] [ 6.88880377e-04 -8.32179279e-04 3.87417334e-04] [ 5.22906247e-05 1.14481547e-03 -7.30492000e-04] [-6.06960293e-04 -2.68250168e-04 -6.15579457e-04] [ 6.81686392e-04 6.24989569e-04 8.40106559e-05] [-6.71255132e-04 -4.45104298e-04 -2.59035630e-05] [ 7.67353114e-04 6.33962497e-04 -3.67905876e-05] [-6.05252816e-04 -4.28666476e-04 3.19573862e-05] [ 2.33799944e-04 7.55927659e-05 -1.15920738e-04] [-2.94404437e-04 -1.78058561e-04 -4.81360184e-05] [ 3.90998827e-04 2.97310466e-04 -2.63950385e-04] [-4.53240684e-04 -4.18325455e-04 2.67296600e-04]] Final stress: [ 3.74561347e-02 3.67167094e-02 1.44870423e-01 -1.19003576e-06 -8.81173089e-08 -7.38624469e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 2.44649058e-03 -4.64990589e-03 5.37608937e-04] [-2.44649958e-03 4.64977608e-03 5.47855197e-04] [-2.44661446e-03 4.64974965e-03 -5.33357446e-04] [ 2.44666799e-03 -4.65064604e-03 -5.46579881e-04] [ 3.38359242e-07 -7.09742054e-07 2.12829143e-07] [ 1.11817760e-06 2.74571292e-07 -3.50717795e-07] [-1.75133836e-06 1.03324127e-06 -7.14352402e-07] [-3.13459782e-07 2.35588322e-07 -7.66248634e-07] [ 9.24292085e-07 3.82814854e-07 -2.48123364e-07] [-3.61809476e-07 -2.95872021e-07 -5.65936581e-07] [ 2.20097219e-02 3.12227011e-03 -2.61072753e-06] [-8.03227200e-03 2.00394625e-02 -2.58265352e-06] [-4.98774259e-03 -8.28021216e-03 -2.47804479e-06] [-2.20096789e-02 -3.12065983e-03 2.07066260e-06] [ 8.03140194e-03 -2.00401485e-02 1.40328429e-06] [ 4.98854219e-03 8.27961175e-03 1.41549815e-06] [-1.53954389e-03 -3.84050230e-03 -3.86707529e-03] [ 1.53953278e-03 3.84048987e-03 -3.86682127e-03] [ 1.53961044e-03 3.84044339e-03 3.86700994e-03] [-1.53959854e-03 -3.84052985e-03 3.86671801e-03] [ 6.85625971e-04 1.23268803e-03 -3.44546523e-03] [-6.85613085e-04 -1.23272956e-03 -3.44517186e-03] [-6.85620801e-04 -1.23273277e-03 3.44529916e-03] [ 6.85635872e-04 1.23265489e-03 3.44519426e-03]] Final stress: [-1.00946986e-03 -9.66454987e-04 -3.39776076e-04 2.20825873e-09 -5.50528588e-10 5.27769820e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-2.44683351e-03 -4.64977754e-03 5.26531808e-04] [ 2.44671889e-03 4.64983879e-03 5.61579070e-04] [ 2.44627055e-03 4.65014523e-03 -5.16125105e-04] [-2.44643180e-03 -4.65007681e-03 -5.61134595e-04] [ 2.72010888e-08 -2.62718232e-07 2.21113907e-07] [ 3.96206937e-07 1.30669994e-07 1.73668413e-07] [-6.38223809e-07 2.96768302e-07 -1.41401143e-07] [-3.61650462e-07 -3.64496362e-06 -1.15225165e-06] [ 2.80195465e-06 2.09192629e-06 -1.25342902e-06] [-1.99995387e-06 1.21735869e-06 -1.85434285e-06] [-2.20096352e-02 3.12073632e-03 -8.09020269e-06] [ 4.98881876e-03 -8.27938834e-03 -8.03065298e-06] [ 8.03133477e-03 2.00397588e-02 -8.33008057e-06] [ 2.20093172e-02 -3.12198637e-03 6.32279887e-06] [-4.98737384e-03 8.28033345e-03 6.26379482e-06] [-8.03226430e-03 -2.00394389e-02 6.05456228e-06] [ 1.53957429e-03 -3.84042891e-03 -3.86740268e-03] [-1.53957651e-03 3.84046674e-03 -3.86662953e-03] [-1.53954391e-03 3.84039902e-03 3.86737612e-03] [ 1.53948457e-03 -3.84039043e-03 3.86625740e-03] [-6.85648586e-04 1.23268366e-03 -3.44590798e-03] [ 6.85622162e-04 -1.23268249e-03 -3.44489624e-03] [ 6.85572739e-04 -1.23269513e-03 3.44525300e-03] [-6.85631811e-04 1.23267394e-03 3.44491515e-03]] Final stress: [-1.00947401e-03 -9.66452243e-04 -3.39776885e-04 8.43738868e-11 1.24577072e-09 -5.27767788e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.55323254e-11 1.14049712e-04 5.42024156e-05] [-8.54255017e-11 -1.14049623e-04 5.42071148e-05] [-1.99385923e-10 -1.14049606e-04 -5.42033040e-05] [-5.15505694e-11 1.14049720e-04 -5.42039759e-05] [-9.50208315e-11 -3.14096193e-10 -4.46811366e-10] [ 3.74056189e-10 2.73405729e-10 -5.19239263e-10] [-1.41973433e-10 3.00166003e-11 -3.35816375e-10] [-1.00211099e-10 -1.81107795e-10 1.64403713e-10] [ 1.10716325e-10 1.84475546e-10 1.84286808e-10] [ 1.46437140e-10 -7.97262256e-11 -3.42750307e-11] [-1.98344174e-10 7.40729255e-04 -6.79248768e-10] [-9.23556877e-05 -3.99034120e-05 -5.99935882e-10] [ 9.23560775e-05 -3.99038662e-05 -7.26430474e-10] [ 7.25066118e-11 -7.40731872e-04 2.71475464e-10] [ 9.23575441e-05 3.99047811e-05 2.87288800e-10] [-9.23576572e-05 3.99049310e-05 3.24675889e-10] [-3.43722273e-12 4.05575575e-04 -4.26702490e-04] [-1.11799459e-11 -4.05575570e-04 -4.26702446e-04] [-1.32684419e-11 -4.05575573e-04 4.26702475e-04] [-1.52535484e-11 4.05575579e-04 4.26702393e-04] [-2.65349409e-11 -3.40803786e-04 3.58576486e-04] [ 4.03719365e-12 3.40803815e-04 3.58576492e-04] [ 2.06486708e-12 3.40803817e-04 -3.58576483e-04] [-2.93449154e-11 -3.40803789e-04 -3.58576567e-04]] Final stress: [ 1.23683680e-03 2.19067284e-03 1.15811994e-03 -4.75235875e-14 4.35437999e-13 -1.07626842e-13] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 4.37798964e-11 -1.36509097e-04 -4.11668556e-07] [-6.69885893e-11 1.36508950e-04 -4.09451699e-07] [-7.80268149e-11 1.36508888e-04 4.09217469e-07] [-9.41306477e-11 -1.36508897e-04 4.05675935e-07] [-1.36343816e-10 1.00473901e-09 5.72081882e-10] [-8.22959909e-10 -3.71607335e-10 5.50009427e-10] [ 1.12674042e-09 -7.07704451e-10 7.72502312e-10] [ 8.83703500e-12 2.99902925e-09 -3.18152282e-10] [-2.33275976e-09 -1.43178358e-09 -1.35198408e-10] [ 2.32112657e-09 -1.41503165e-09 -1.34496615e-10] [-1.04635467e-10 1.01340602e-04 2.12944424e-10] [ 8.86235657e-05 1.22075243e-04 2.41297554e-10] [-8.86233647e-05 1.22075003e-04 1.61515257e-10] [ 2.20237162e-11 -1.01342559e-04 1.16119374e-09] [-8.86213641e-05 -1.22074100e-04 1.23478565e-09] [ 8.86213339e-05 -1.22074057e-04 1.31712318e-09] [-1.17193755e-11 6.61412613e-05 8.70124439e-05] [ 3.74172915e-12 -6.61412744e-05 8.70124861e-05] [-1.95157779e-11 -6.61412525e-05 -8.70122770e-05] [-1.63438707e-12 6.61412504e-05 -8.70123687e-05] [-1.08887899e-11 -1.51881889e-04 -2.44546605e-04] [-8.35877510e-13 1.51881867e-04 -2.44546635e-04] [ 1.16129556e-12 1.51881861e-04 2.44546837e-04] [-1.77667880e-11 -1.51881878e-04 2.44546709e-04]] Final stress: [ 1.20259202e-03 1.67236333e-03 1.64009210e-03 -3.77740993e-13 4.26591815e-13 -5.30198517e-14] Minimization converged after 31 steps. Minimization converged after 27 steps. Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-1.47726589e-08 -1.50914165e-05 -8.10979506e-06] [-3.73239014e-08 -2.98796557e-05 -5.00874107e-06] [-1.59006517e-08 1.50073160e-05 3.59706055e-05] [-5.43262079e-08 2.99641135e-05 3.75295016e-05] [-6.03895735e-08 -2.60446466e-06 -3.31631901e-06] [ 2.35115633e-06 1.37677570e-06 -3.34021265e-06] [-2.21197673e-06 1.22618861e-06 -3.23291926e-06] [-4.04975512e-08 3.92026784e-05 -1.05487605e-05] [-3.42155202e-05 -1.95788992e-05 -1.07435299e-05] [ 3.42925532e-05 -1.96700286e-05 -1.07909511e-05] [-7.73702741e-09 -4.52763180e-05 -3.67196195e-06] [ 1.72056225e-05 -1.07740673e-05 8.10388219e-06] [-1.71848396e-05 -1.07951325e-05 8.11404256e-06] [-2.95240923e-08 -4.56357758e-06 -2.35450254e-06] [ 2.64910924e-05 3.57610884e-05 -1.40001515e-05] [-2.64310167e-05 3.56925758e-05 -1.39703263e-05] [-7.36083178e-09 -2.15654041e-05 2.92290732e-06] [-3.23022081e-09 2.00367765e-05 -4.03218461e-05] [-7.90896471e-09 2.16338814e-05 -2.51890710e-06] [-4.28085689e-09 -2.00891245e-05 3.91607780e-05] [-1.44639078e-09 1.47447872e-05 -6.95924146e-05] [-5.08958731e-09 -3.56881324e-05 -1.90059524e-05] [-4.25614701e-09 -1.48064005e-05 7.04026299e-05] [-3.02657949e-09 3.57364400e-05 1.83229439e-05]] Final stress: [ 6.17982857e-04 1.12358673e-03 6.10201984e-04 -4.09059872e-04 5.25507415e-11 9.71042691e-12] Minimization converged after 60 steps. Minimization converged after 52 steps. Minimization converged after 52 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-6.27452863e-05 4.60731695e-04 -4.05666675e-04] [-5.77229679e-05 -4.50856705e-04 3.92812936e-04] [ 5.92543851e-05 -4.47099808e-04 6.38177868e-04] [ 5.37493765e-05 4.55390645e-04 -2.37558447e-04] [-8.46578597e-06 4.64453103e-05 -1.64627223e-05] [-4.14410067e-05 -1.62359397e-05 -1.52929410e-05] [ 5.69065428e-05 -3.49446532e-05 -6.55421388e-06] [ 3.73408065e-06 -7.91129854e-05 -1.42974193e-05] [ 2.21095714e-05 2.70803717e-05 -3.53662036e-05] [-2.72443098e-05 3.44485115e-05 -3.40954236e-05] [-5.84389936e-07 -3.47752407e-05 -1.88503409e-04] [ 3.10592362e-06 1.70392025e-04 -2.52348490e-04] [-5.75307863e-06 1.71215698e-04 -1.23614435e-04] [-6.11737355e-06 2.50064999e-05 1.11952227e-04] [ 1.74306833e-05 -1.58696414e-04 1.79933703e-04] [-3.79660319e-06 -1.73558860e-04 4.36001495e-05] [ 4.48350655e-05 6.60882505e-04 4.01749382e-04] [ 4.53447834e-05 -6.58402769e-04 4.19930638e-04] [-4.62546337e-05 -6.60158215e-04 -4.08322554e-04] [-4.45996117e-05 6.62079531e-04 -4.28478522e-04] [ 5.48819396e-05 1.02561388e-04 -1.06794694e-03] [ 5.39663372e-05 -1.02137575e-04 -1.05218920e-03] [-5.57901928e-05 -1.02602664e-04 1.05544335e-03] [-5.48034487e-05 1.02347649e-04 1.04309734e-03]] Final stress: [-5.86978380e-04 -1.15042495e-03 -5.41071788e-04 2.01344221e-08 -4.64278718e-04 6.14915287e-09] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-5.40276430e-04 -3.65108176e-04 -9.55257747e-04] [ 5.40467919e-04 3.65296444e-04 -1.03231879e-03] [ 5.40946020e-04 3.65119970e-04 8.73899380e-04] [-5.40215633e-04 -3.65230517e-04 9.64970288e-04] [ 3.57662772e-07 3.57320295e-05 1.42197227e-05] [-3.11836081e-05 -1.82611014e-05 1.44428772e-05] [ 3.06916697e-05 -1.75648423e-05 1.35839899e-05] [ 3.84017208e-07 -5.33267710e-05 1.84384063e-05] [ 4.54771412e-05 2.61391343e-05 1.80009687e-05] [-4.66990443e-05 2.72861462e-05 1.81209816e-05] [-2.87751503e-03 -1.83380935e-03 2.32398586e-05] [ 5.54049927e-04 -2.32867011e-04 2.32393552e-05] [ 8.03998651e-04 1.62524213e-03 2.35304976e-05] [ 2.87773778e-03 1.83215486e-03 -6.94274151e-06] [-5.53014587e-04 2.33392223e-04 -6.97785299e-06] [-8.05551134e-04 -1.62416470e-03 -7.14768664e-06] [ 6.96471269e-05 -6.84036360e-05 -1.07114195e-04] [-6.95106328e-05 6.83887285e-05 -1.09201290e-04] [-6.94725107e-05 6.83412985e-05 1.08437461e-04] [ 6.94452985e-05 -6.82896142e-05 1.10377137e-04] [-1.55418260e-04 1.84075398e-04 -2.16594339e-04] [ 1.55644418e-04 -1.84160079e-04 -2.17491230e-04] [ 1.55756806e-04 -1.84218090e-04 2.16495763e-04] [-1.55747563e-04 1.84235522e-04 2.18049188e-04]] Final stress: [ 3.93488557e-04 7.14410816e-04 2.58594508e-04 -2.30518080e-09 4.70212005e-09 3.56623727e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 5.47824673e-04 -4.91486483e-04 -1.15109624e-03] [-5.47604723e-04 4.91620794e-04 -1.19413382e-03] [-5.47998698e-04 4.91322298e-04 1.01523594e-03] [ 5.47745353e-04 -4.91429500e-04 1.10398941e-03] [-2.71683710e-07 3.17145383e-05 1.65976645e-05] [-2.75690669e-05 -1.57600889e-05 1.62953191e-05] [ 2.77258824e-05 -1.61635596e-05 1.67814977e-05] [ 2.76752279e-07 -6.72876031e-05 2.76125426e-05] [ 5.83332872e-05 3.36140247e-05 2.68426374e-05] [-5.82863535e-05 3.39063348e-05 2.76977898e-05] [ 3.05520076e-03 -2.03219484e-03 2.62131049e-05] [-7.77693175e-04 1.73503324e-03 2.65871208e-05] [-6.27096901e-04 -2.60218000e-04 2.62429413e-05] [-3.05511166e-03 2.02303042e-03 2.56146857e-06] [ 7.85556507e-04 -1.73054851e-03 2.50930747e-06] [ 6.19090506e-04 2.64892054e-04 2.58220395e-06] [-6.40596667e-05 -5.63511068e-05 -1.57968460e-04] [ 6.40390655e-05 5.63594869e-05 -1.59659605e-04] [ 6.39069173e-05 5.63125624e-05 1.60498811e-04] [-6.38041717e-05 -5.62527720e-05 1.61964602e-04] [ 1.46904822e-04 1.83853031e-04 -2.23487630e-04] [-1.47091309e-04 -1.83950591e-04 -2.24043351e-04] [-1.47179607e-04 -1.83995382e-04 2.24405255e-04] [ 1.47162489e-04 1.83979660e-04 2.25771496e-04]] Final stress: [ 3.93552701e-04 7.13429279e-04 2.62899417e-04 -1.76902842e-09 -3.52629607e-09 -3.56014502e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.63093896e-03 -1.55190788e-03 3.81071984e-04] [ 2.63055295e-03 1.55202749e-03 4.28025170e-04] [ 2.63056559e-03 1.55175366e-03 -3.75833722e-04] [-2.63139285e-03 -1.55190215e-03 -4.21159792e-04] [-6.46675364e-07 -1.09547528e-05 -2.94394135e-06] [ 1.00960636e-05 6.20560297e-06 -3.43785879e-06] [-8.67023041e-06 4.61926438e-06 -2.25763294e-06] [-4.04012711e-07 -4.21039619e-07 -1.75866273e-07] [ 1.48605496e-06 7.99140043e-07 3.64218762e-07] [-6.45121240e-07 -1.61482935e-07 -2.23567675e-07] [ 8.29191137e-03 5.31792998e-04 -8.96031572e-06] [-3.25061248e-03 8.62526117e-03 -8.83909627e-06] [-3.98053879e-03 -1.18461694e-02 -8.86646745e-06] [-8.29226566e-03 -5.15784614e-04 7.77612164e-06] [ 3.23716139e-03 -8.63289554e-03 7.58940486e-06] [ 3.99465191e-03 1.18377617e-02 7.86921253e-06] [-2.45087116e-03 9.84405200e-04 -6.76158380e-04] [ 2.45066494e-03 -9.84495582e-04 -6.74773744e-04] [ 2.45067432e-03 -9.84429439e-04 6.75793161e-04] [-2.45076071e-03 9.84411752e-04 6.74998837e-04] [-8.35582443e-04 -9.25519200e-04 1.36402760e-03] [ 8.35518030e-04 9.25531134e-04 1.36488749e-03] [ 8.35550210e-04 9.25531295e-04 -1.36412378e-03] [-8.35503725e-04 -9.25459392e-04 -1.36464903e-03]] Final stress: [-9.90847914e-04 -1.26093510e-03 -7.89896061e-04 -9.04290557e-10 -1.80638435e-09 4.72420072e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.67846609e-03 -1.59006995e-03 4.20938067e-04] [-2.67869090e-03 1.59016624e-03 4.52138306e-04] [-2.67876565e-03 1.59012467e-03 -4.01537769e-04] [ 2.67924416e-03 -1.59025142e-03 -4.25253476e-04] [ 2.86011352e-07 -2.33798311e-06 -3.29538248e-06] [ 1.29751757e-06 7.60588508e-07 -2.94308291e-06] [-1.97305347e-06 1.48211060e-06 -3.54661807e-06] [-2.86259249e-07 1.17856720e-06 -3.25123808e-06] [-5.71110309e-07 -2.33545714e-07 -3.03184163e-06] [ 1.19734018e-06 -9.37054698e-07 -3.53389873e-06] [-8.43252299e-03 5.03835528e-04 -8.87111399e-06] [ 3.90177462e-03 -1.18428132e-02 -8.97989036e-06] [ 3.20833747e-03 8.69641459e-03 -8.87869468e-06] [ 8.43260072e-03 -5.19941118e-04 1.12318859e-06] [-3.88782378e-03 1.18507734e-02 1.19697073e-06] [-3.22257241e-03 -8.68818543e-03 6.40948067e-07] [ 2.49485263e-03 9.93456033e-04 -7.15087000e-04] [-2.49485880e-03 -9.93447063e-04 -7.14767006e-04] [-2.49477156e-03 -9.93426855e-04 7.14683261e-04] [ 2.49473139e-03 9.93474284e-04 7.13705098e-04] [ 8.63264402e-04 -9.43678287e-04 1.35021460e-03] [-8.63220221e-04 9.43658999e-04 1.35070069e-03] [-8.63272126e-04 9.43674942e-04 -1.35101130e-03] [ 8.63276495e-04 -9.43678034e-04 -1.35135281e-03]] Final stress: [-9.94778741e-04 -1.26491175e-03 -7.91443090e-04 -4.12272817e-10 -1.42015748e-10 -4.75187365e-04] Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.06784470e-08 1.03715575e-04 -5.12083306e-04] [ 9.09766687e-09 3.23450541e-04 4.27878917e-04] [-2.18333383e-09 -1.03681520e-04 5.08624547e-04] [-3.77401027e-10 -3.23505831e-04 -4.28333527e-04] [-8.92266046e-09 6.41052115e-07 1.71049412e-07] [-4.40254053e-07 -2.85949583e-07 1.08000838e-07] [ 4.51709882e-07 -3.02847099e-07 1.09604926e-07] [ 2.78955806e-08 -2.96091205e-06 8.92749086e-07] [ 2.46750155e-06 1.43270758e-06 8.59274587e-07] [-2.51522325e-06 1.49221428e-06 8.83579351e-07] [ 7.55054297e-10 2.22649015e-04 -2.53041334e-05] [ 1.72729793e-05 2.61276328e-04 4.41026674e-06] [-1.72747754e-05 2.61278172e-04 4.38746055e-06] [ 5.36740058e-09 -2.22857704e-04 2.56315463e-05] [-1.70854018e-05 -2.61174489e-04 -4.10689597e-06] [ 1.70751062e-05 -2.61162131e-04 -4.10553123e-06] [-1.01090913e-10 2.32129331e-04 -9.94701101e-04] [ 3.24068650e-09 5.39027690e-04 -9.42236479e-04] [-1.08383180e-09 -2.32139304e-04 9.94714825e-04] [ 2.25827115e-09 -5.39021697e-04 9.42249308e-04] [ 4.14871693e-10 8.95853849e-04 -3.90939208e-05] [ 9.39684063e-10 -1.93153387e-04 1.43744651e-05] [ 4.65801692e-10 -8.95849701e-04 3.90466974e-05] [-8.74788020e-11 1.93148998e-04 -1.43773975e-05]] Final stress: [ 5.33460213e-04 5.71120904e-04 1.14298476e-03 -4.49339328e-04 6.32454792e-11 -1.63987122e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-1.52859856e-08 -3.23821425e-04 4.13295435e-04] [-6.13898187e-09 -9.77712236e-05 -4.93124373e-04] [-1.85264802e-08 3.23805741e-04 -4.14344936e-04] [-6.73172129e-09 9.77523945e-05 4.93536455e-04] [-1.45951957e-08 -6.72954716e-07 -1.56838766e-07] [ 6.44175915e-07 3.63403995e-07 -1.94378930e-07] [-6.14948867e-07 3.29527355e-07 -1.75121699e-07] [-2.81206679e-08 -8.12936716e-07 2.80487671e-07] [ 7.67753171e-07 4.47835144e-07 3.17966072e-07] [-7.06633637e-07 3.79926815e-07 2.73505389e-07] [-6.03049971e-09 2.22058486e-04 1.59644006e-05] [ 1.88193389e-05 2.60120110e-04 -1.01924199e-05] [-1.88054259e-05 2.60105057e-04 -1.01994748e-05] [-2.25732677e-09 -2.21458450e-04 -1.58793625e-05] [-1.93089454e-05 -2.60405233e-04 1.02831549e-05] [ 1.93160686e-05 -2.60411642e-04 1.02802380e-05] [-1.36530090e-09 -5.36310255e-04 -9.33941525e-04] [-3.31793426e-09 -2.24450942e-04 -9.85026607e-04] [-1.57050195e-09 5.36307115e-04 9.33936993e-04] [-3.44003498e-09 2.24447359e-04 9.85046555e-04] [-1.34085187e-09 1.94456173e-04 1.58857615e-05] [-5.69419283e-10 -8.87933429e-04 -3.68050072e-05] [-9.96673622e-10 -1.94457996e-04 -1.58916596e-05] [-1.09512671e-09 8.87933359e-04 3.68307521e-05]] Final stress: [ 5.34056030e-04 5.71329244e-04 1.14259710e-03 4.48791384e-04 1.09810300e-11 -1.77751505e-12] Minimization converged after 49 steps. Minimization converged after 51 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.04565928e-04 7.75482800e-04 3.76760596e-05] [ 1.04592299e-04 -7.75512338e-04 3.53064766e-05] [-1.04558536e-04 -7.75477037e-04 -3.77857591e-05] [-1.04557827e-04 7.75515027e-04 -3.56411418e-05] [-1.87108115e-08 5.23084224e-08 4.79039381e-08] [-1.35050621e-08 -8.51751047e-09 4.84628180e-08] [ 2.76661002e-08 -3.83491839e-08 3.70089408e-08] [ 4.05291387e-08 -4.80700595e-08 2.78843920e-08] [-4.04911987e-08 -2.70994407e-08 -5.94498906e-09] [-2.84581313e-08 5.95593511e-08 2.80351375e-08] [ 1.45820207e-08 -8.76759469e-04 4.60000325e-07] [-4.06032654e-04 2.74307521e-05 3.49739046e-04] [ 4.05994855e-04 2.74692661e-05 -3.48868648e-04] [ 2.48578280e-09 8.76916804e-04 -3.91224510e-07] [ 4.05880506e-04 -2.75303979e-05 -3.49627219e-04] [-4.05880183e-04 -2.75274994e-05 3.48922491e-04] [-2.56430055e-04 6.03607527e-04 -5.63862538e-04] [-2.56427148e-04 -6.03609973e-04 -5.63913340e-04] [ 2.56428302e-04 -6.03609399e-04 5.63868011e-04] [ 2.56434036e-04 6.03613967e-04 5.63921871e-04] [-2.47374294e-04 -4.73056905e-04 -2.49600733e-04] [-2.47375461e-04 4.73054950e-04 -2.49637060e-04] [ 2.47376416e-04 4.73057063e-04 2.49605120e-04] [ 2.47379716e-04 -4.73054969e-04 2.49645236e-04]] Final stress: [ 5.68899109e-04 5.51924130e-04 1.12921184e-03 -2.26463494e-10 4.44336553e-04 1.56045969e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 6.83685870e-05 1.00896334e-04 2.40667455e-05] [ 6.83161869e-05 -1.00882842e-04 1.78816433e-05] [-6.83262007e-05 -1.00859651e-04 -2.76218916e-05] [-6.83021520e-05 1.00873916e-04 -1.96675231e-05] [ 1.16675039e-08 -9.33617923e-07 5.77875114e-08] [ 7.98712935e-07 4.54423211e-07 6.47624775e-08] [-8.28320748e-07 4.84868616e-07 3.73081865e-08] [ 3.86522614e-08 -3.07844229e-06 9.95043561e-07] [ 2.54141283e-06 1.47553208e-06 9.30209796e-07] [-2.62588476e-06 1.56894565e-06 9.74291677e-07] [-5.30168454e-09 -2.77563434e-05 1.62078904e-06] [-1.15360843e-04 -1.43911624e-04 -7.93375934e-05] [ 1.15400031e-04 -1.43940428e-04 8.25584022e-05] [ 1.91143999e-08 2.99331882e-05 -9.13595807e-07] [ 1.13447275e-04 1.42805538e-04 8.00228779e-05] [-1.13508103e-04 1.42862640e-04 -8.18676661e-05] [ 1.08821873e-04 1.63774632e-04 2.69583839e-04] [ 1.08833034e-04 -1.63771525e-04 2.69449988e-04] [-1.08823677e-04 -1.63775323e-04 -2.69556318e-04] [-1.08822311e-04 1.63779958e-04 -2.69365137e-04] [-6.52757439e-05 -2.22622095e-04 -4.31919509e-05] [-6.52727721e-05 2.22621183e-04 -4.32357163e-05] [ 6.52815546e-05 2.22622771e-04 4.31607965e-05] [ 6.52732079e-05 -2.22622039e-04 4.33529075e-05]] Final stress: [-5.43102962e-04 -5.60984425e-04 -1.04737633e-03 -4.68602094e-11 -4.67403073e-04 -3.73886861e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-6.64070742e-05 9.80516223e-05 2.20469337e-05] [-6.63881298e-05 -9.80279173e-05 1.72163093e-05] [ 6.64153221e-05 -9.80141968e-05 -2.96599430e-05] [ 6.63490716e-05 9.80916932e-05 -1.67789638e-05] [-1.05161690e-08 -1.94978324e-06 -2.14681561e-07] [ 1.59066702e-06 9.63873335e-07 -1.69605651e-07] [-1.55804733e-06 9.33316315e-07 -1.31045001e-07] [-4.27250415e-08 -1.88508607e-06 1.16419482e-06] [ 1.55254153e-06 9.66653094e-07 1.12439174e-06] [-1.47971298e-06 8.75165249e-07 1.10139792e-06] [ 2.27016533e-09 -3.29113943e-05 2.22731971e-06] [-1.14230797e-04 -1.42795535e-04 8.48259723e-05] [ 1.14181815e-04 -1.42764625e-04 -8.04010707e-05] [-1.37683325e-08 2.72929651e-05 -9.81006288e-07] [ 1.19029565e-04 1.45595560e-04 -8.35843734e-05] [-1.18979779e-04 1.45550879e-04 8.16959861e-05] [-1.09374738e-04 1.63348405e-04 2.68488627e-04] [-1.09375798e-04 -1.63342573e-04 2.68190634e-04] [ 1.09366147e-04 -1.63339057e-04 -2.68276277e-04] [ 1.09377439e-04 1.63351523e-04 -2.68166906e-04] [ 6.55331040e-05 -2.22348331e-04 -4.32626977e-05] [ 6.55202143e-05 2.22350566e-04 -4.33764577e-05] [-6.55275394e-05 2.22352907e-04 4.33698273e-05] [-6.55295306e-05 -2.22346630e-04 4.35514334e-05]] Final stress: [-5.43170299e-04 -5.60950066e-04 -1.04730574e-03 -2.09586864e-10 4.67359716e-04 4.13326987e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.39685737e-03 1.75826453e-03 1.02295958e-03] [ 2.39691940e-03 -1.75831501e-03 1.06996682e-03] [ 2.39673643e-03 -1.75827239e-03 -1.03137656e-03] [-2.39711847e-03 1.75837839e-03 -1.06875407e-03] [-2.30291896e-08 8.75686607e-06 2.16171864e-06] [-7.32093658e-06 -4.31551274e-06 2.09896631e-06] [ 7.42569327e-06 -4.40148534e-06 2.11637818e-06] [-2.13131244e-07 1.74214801e-05 -2.41625184e-06] [-1.51494120e-05 -8.49993942e-06 -2.40965746e-06] [ 1.55456008e-05 -8.97326578e-06 -2.42360919e-06] [ 8.48068266e-03 1.34976345e-03 -6.45795937e-06] [-4.02905438e-03 3.48305709e-03 -6.42476966e-06] [-4.04550958e-03 -8.75978988e-03 -6.51091165e-06] [-8.48042092e-03 -1.39084560e-03 8.61388306e-06] [ 4.06445459e-03 -3.46270267e-03 8.68461326e-06] [ 4.01004000e-03 8.78043029e-03 8.92410609e-06] [-1.76767754e-04 4.10581794e-04 -1.69292994e-03] [ 1.76778095e-04 -4.10579478e-04 -1.69255684e-03] [ 1.76844352e-04 -4.10560521e-04 1.69382057e-03] [-1.76722148e-04 4.10618575e-04 1.69216538e-03] [-3.07442758e-04 -3.51583678e-04 -1.77244520e-03] [ 3.07243733e-04 3.51564253e-04 -1.77236857e-03] [ 3.07264433e-04 3.51572324e-04 1.77338703e-03] [-3.07335088e-04 -3.51569619e-04 1.77217529e-03]] Final stress: [ 1.33369489e-04 3.15054691e-04 9.15124640e-04 -3.09940000e-10 -2.19192596e-09 3.65196101e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-5.47997247e-03 -1.14869773e-02 3.41277715e-03] [ 5.48014795e-03 1.14870359e-02 3.42749756e-03] [ 5.48003022e-03 1.14869599e-02 -3.41051108e-03] [-5.47975296e-03 -1.14868807e-02 -3.41073762e-03] [ 4.81449080e-07 -1.24953742e-05 -4.32207634e-06] [ 1.05203483e-05 5.68652518e-06 -3.79449151e-06] [-1.14331426e-05 6.77365305e-06 -4.59959842e-06] [-9.35158222e-08 -4.42622160e-06 3.92214331e-07] [ 3.73468541e-06 2.28262507e-06 3.06985061e-07] [-3.60017978e-06 2.09601799e-06 3.33849425e-07] [-3.78528444e-02 5.54582464e-03 -2.51979559e-06] [ 9.95212411e-03 -1.24514215e-02 -2.47331139e-06] [ 1.15151365e-02 3.06909052e-04 -2.41092160e-06] [ 3.78530299e-02 -5.54228097e-03 1.58333745e-07] [-9.95557856e-03 1.24494281e-02 3.09645708e-07] [-1.15119777e-02 -3.08551946e-04 2.61020499e-07] [ 3.19177404e-03 2.48332170e-03 -1.13871680e-04] [-3.19169726e-03 -2.48333427e-03 -1.13621961e-04] [-3.19163347e-03 -2.48333776e-03 1.13611141e-04] [ 3.19168926e-03 2.48333926e-03 1.13501605e-04] [ 2.51210729e-03 -6.49210257e-04 1.64169562e-03] [-2.51213598e-03 6.49232932e-04 1.64202626e-03] [-2.51215438e-03 6.49226822e-04 -1.64206449e-03] [ 2.51209828e-03 -6.49200797e-04 -1.64194436e-03]] Final stress: [ 8.52086602e-05 3.60667455e-04 6.35077362e-04 -2.08215865e-10 3.30125296e-10 -4.85266311e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 5.47619871e-02 -1.19056070e-01 4.11596182e-01] [-5.47720117e-02 1.19056651e-01 4.10884461e-01] [-5.47835970e-02 1.19059490e-01 -4.10536734e-01] [ 5.47622519e-02 -1.19052750e-01 -4.11538617e-01] [-3.07056580e-06 7.21763700e-05 8.34475703e-05] [-5.32380928e-05 -3.00180552e-05 6.25623931e-05] [ 6.29923770e-05 -3.85496363e-05 8.37218701e-05] [-1.31821213e-05 7.05274422e-04 -2.48032564e-04] [-5.90108992e-04 -3.32954614e-04 -1.58140830e-04] [ 6.22332173e-04 -3.65952400e-04 -2.55631485e-04] [ 3.37079506e-01 -2.88289463e-02 -2.25542635e-05] [-3.49327788e-01 5.93154076e-01 -2.15003582e-05] [-1.74945259e-01 -9.24723033e-01 -2.90206424e-05] [-3.37083650e-01 2.96833009e-02 2.16187750e-05] [ 3.48595967e-01 -5.93570037e-01 2.99163941e-05] [ 1.75715807e-01 9.24285098e-01 2.72150292e-05] [ 4.17111536e-01 2.60714815e-01 -2.72095109e-01] [-4.17131450e-01 -2.60726410e-01 -2.72084198e-01] [-4.17125872e-01 -2.60722805e-01 2.72088378e-01] [ 4.17105626e-01 2.60712551e-01 2.72091448e-01] [ 6.51779203e-02 -8.94292462e-03 -1.18910180e-01] [-6.51723993e-02 8.94462491e-03 -1.18917610e-01] [-6.51701137e-02 8.94571107e-03 1.18928711e-01] [ 6.51758138e-02 -8.94331843e-03 1.18919667e-01]] Final stress: [ 9.64077549e-03 1.15358039e-02 9.44319078e-03 -4.02936896e-08 3.41936049e-09 -1.93973256e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 83 steps. Final forces: [[ 0.01650278 0.00562398 -0.0438679 ] [-0.02121608 0.11256914 -0.03646275] [ 0.01481673 -0.12174867 -0.0003926 ] [-0.02468333 -0.01391454 0.02488137] [ 0.00711198 0.03125105 0.00733819] [-0.02678253 -0.0318405 0.00557474] [ 0.0434735 -0.03077127 0.00327499] [-0.00585682 -0.04265888 0.01114647] [ 0.03778461 0.0386074 0.01278721] [-0.05077033 0.03864555 0.00576988] [-0.00465913 0.00389126 0.0076987 ] [-0.00479076 -0.00356908 -0.02868928] [ 0.01092348 0.00846256 0.01416906] [ 0.01466384 0.00871996 0.00902279] [ 0.00705789 0.00728789 -0.01712592] [-0.0015622 0.00076707 0.01667041] [ 0.01821891 -0.00793129 -0.00282025] [-0.02742996 0.0316949 0.00184595] [ 0.02197628 -0.03629766 0.0007244 ] [-0.01789025 0.00818644 0.00084806] [ 0.00714114 -0.01695064 0.01145299] [-0.02624582 0.02355193 0.00086311] [ 0.02438659 -0.02431538 -0.01123829] [-0.01217052 0.01073878 0.00652868]] Final stress: [ 3.56438948e-02 3.56669960e-02 1.43857297e-01 4.65870553e-04 2.44728526e-05 -7.29142520e-04] Minimization converged after 49 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 42 steps. Final forces: [[ 7.56624164e-04 4.21822831e-04 -1.42259107e-03] [ 3.25858101e-04 -1.22284769e-03 -4.40883257e-03] [-7.66222167e-04 -4.11883915e-04 -1.97498516e-03] [-4.50537628e-04 1.21233366e-03 -3.85712514e-03] [-1.11268750e-04 5.11754285e-03 1.77749908e-03] [-4.35282058e-03 -2.43878999e-03 1.63291687e-03] [ 4.54469691e-03 -2.67965309e-03 1.84518667e-03] [ 3.30741075e-05 -2.83906523e-03 9.09988345e-04] [ 2.42917069e-03 1.38765765e-03 8.99348547e-04] [-2.46485628e-03 1.44640564e-03 9.22618189e-04] [-9.86019205e-03 4.56590059e-03 3.56458948e-04] [ 3.62775369e-03 -5.90362469e-03 1.25719140e-03] [ 6.08516446e-03 1.17786217e-02 -4.88599783e-04] [ 9.81367591e-03 -1.80151783e-03 8.27050461e-04] [-5.99757506e-03 4.58825350e-03 -1.03304019e-04] [-3.59345393e-03 -1.32210461e-02 1.67178919e-03] [-1.18862470e-03 -1.84041651e-03 -2.06125770e-03] [-4.56907082e-04 4.22952010e-04 -4.04125078e-04] [ 1.15569015e-03 1.83579109e-03 2.10664503e-03] [ 4.75460731e-04 -4.22979242e-04 5.29717861e-04] [-1.25424997e-04 2.00354617e-03 5.52698026e-04] [-4.24034577e-04 -1.88275971e-03 5.01427451e-04] [ 1.05507321e-04 -1.99487498e-03 -5.45862431e-04] [ 4.39241576e-04 1.87863129e-03 -5.23853105e-04]] Final stress: [-0.00017596 -0.00035165 -0.00012987 -0.00064775 -0.00056922 0.00012415] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.96129871e-06 -4.56044695e-06 -3.26134237e-06] [ 9.79929476e-06 5.10189423e-06 -4.33358561e-08] [-8.20735436e-06 -4.97920449e-06 -6.12371054e-06] [ 1.61405583e-06 4.17629409e-06 -2.12294907e-06] [-6.33806334e-06 -6.00892659e-06 1.07830777e-05] [ 8.74799612e-07 2.04701437e-06 2.10709870e-06] [-6.84558620e-06 5.77400363e-06 -7.68411582e-06] [ 1.62796827e-06 4.03658021e-06 1.17106760e-05] [-9.09945282e-06 -5.44733301e-06 -6.01343853e-08] [ 6.83395674e-06 -3.72151937e-06 -5.46511735e-06] [-4.47635529e-06 -1.04805915e-05 4.06109231e-06] [ 2.98825601e-06 2.12716415e-05 1.19101079e-05] [-3.11146861e-06 -2.96846304e-06 4.55814438e-06] [-4.97080610e-06 3.78606963e-06 -2.23181912e-06] [ 1.04484472e-05 1.39431804e-05 6.47037243e-06] [ 1.70648048e-08 -1.37598007e-05 4.97668876e-06] [ 3.71271588e-07 1.73358813e-06 -1.02692783e-05] [ 6.06541503e-06 -5.45317395e-06 -2.85101833e-06] [ 4.27435679e-06 -8.21544261e-07 -1.22657065e-05] [ 7.08932628e-06 3.35076363e-06 3.24646646e-06] [ 9.74206046e-06 1.16416006e-06 9.99981383e-06] [-1.13773628e-05 -4.13778279e-06 -1.42797682e-05] [-2.29723365e-07 1.59410500e-06 5.29585388e-06] [-1.00513993e-05 -5.64050819e-06 -8.46109661e-06]] Final stress: [ 0.03327615 0.03234646 0.1348193 0.00034308 -0.00036878 -0.00080504] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 41 steps. Final forces: [[ 0.00540465 -0.02718855 -0.02199671] [ 0.01206329 0.02333494 -0.05033105] [-0.00588549 0.02793618 -0.02149587] [-0.01213397 -0.0236329 -0.0140257 ] [ 0.00032502 0.0596743 0.01843638] [-0.05151973 -0.02995674 0.01783501] [ 0.05137978 -0.02950125 0.01813427] [-0.00020246 -0.00802138 0.00605431] [ 0.00650343 0.00402204 0.00556569] [-0.00608684 0.00354063 0.00510537] [ 0.04211544 -0.01439926 -0.00023792] [-0.01410274 0.08704906 0.00764125] [-0.04380477 -0.0283514 0.0090805 ] [-0.04186697 -0.02676903 0.01231278] [ 0.04942675 -0.06653568 0.00395371] [ 0.00851373 0.04873933 0.00205059] [ 0.00945507 -0.01039111 0.00629512] [-0.01207613 0.00887597 -0.00852343] [-0.00919406 0.0103718 -0.00481906] [ 0.01200389 -0.00876645 0.00872047] [-0.00422651 0.00547023 -0.00468627] [ 0.00754214 -0.0141572 -0.00329629] [ 0.00416953 -0.00539939 0.00564191] [-0.00780306 0.01405586 0.00258493]] Final stress: [ 0.00059532 -0.00054072 0.00013238 0.00103404 -0.00086127 -0.00036762] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 42 steps. Final forces: [[ 3.24004856e-03 -1.69935794e-03 -7.23362532e-03] [ 3.27576342e-03 -1.28308840e-03 -7.67378615e-03] [-3.02086084e-03 1.79780079e-03 -7.68957215e-03] [-3.23423945e-03 1.28393216e-03 -2.40620820e-03] [-7.57122941e-05 8.21650819e-03 2.68933196e-03] [-7.10887148e-03 -4.05119850e-03 2.72508895e-03] [ 7.16933325e-03 -4.17267382e-03 2.74046275e-03] [ 1.59679870e-04 -6.05940961e-03 2.68081110e-03] [ 5.05364848e-03 2.83318216e-03 2.40508674e-03] [-5.33569298e-03 3.18326389e-03 2.71556252e-03] [-2.20678020e-02 -2.73328418e-03 4.35692912e-03] [ 1.07734307e-02 -3.55886195e-03 4.05521999e-03] [ 7.20466472e-03 2.16353933e-02 -3.91641788e-03] [ 2.21097290e-02 -5.73526943e-03 -1.48715382e-03] [-3.58527308e-03 7.65981550e-03 -1.27397979e-03] [-1.46086608e-02 -1.73359904e-02 6.74544979e-03] [-2.10873380e-03 -4.76692702e-03 7.06575116e-04] [-3.85367260e-04 -7.45495477e-04 -2.88993740e-03] [ 2.05597279e-03 4.76629337e-03 -3.50687600e-04] [ 4.38778370e-04 7.69033371e-04 2.98000884e-03] [ 1.53123550e-03 6.69568837e-04 -2.16898536e-03] [-1.67973074e-03 -5.29854047e-03 -1.12261487e-03] [-1.53059773e-03 -6.52980078e-04 2.29626177e-03] [ 1.72925779e-03 5.27828567e-03 1.11617986e-03]] Final stress: [-1.94787489e-04 -4.30298024e-04 -8.27118445e-05 7.27030044e-04 7.18255192e-04 1.23948451e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.34062235e-03 4.19518642e-03 -7.18835857e-04] [ 3.51939993e-03 7.83116130e-04 -3.77052160e-03] [-1.54162286e-04 1.74508431e-03 9.72427607e-04] [-9.26798869e-04 -3.37923596e-03 2.35027790e-03] [-1.31510433e-03 -1.34440020e-03 1.10353907e-03] [ 6.27092168e-04 4.31019899e-03 1.48087791e-03] [-1.00677846e-03 1.03019780e-03 -5.50752911e-04] [ 3.67736353e-03 2.75974671e-03 -4.36791141e-04] [ 7.64230200e-05 -6.88630184e-04 1.89532294e-03] [-2.21622474e-03 1.31146439e-03 4.00370791e-05] [ 4.08132381e-04 -2.54453908e-03 1.32586524e-03] [-7.83155897e-04 -4.21058121e-03 -7.19181731e-05] [-2.45903606e-04 5.25566396e-03 1.69362772e-03] [-5.90859504e-03 1.06202513e-03 -1.95594222e-04] [ 1.44164807e-03 2.91663762e-03 -9.73812386e-04] [-9.01633337e-04 -3.95753402e-03 4.56290237e-03] [-8.70001867e-04 -1.32406758e-03 -5.12889971e-04] [ 2.76473906e-03 -4.11135176e-03 -3.47998353e-03] [-1.20935298e-03 -1.63745897e-03 1.18523175e-03] [ 7.83827986e-04 -1.14528593e-03 -2.33559484e-03] [-5.09145182e-04 -1.54863149e-03 -5.86764049e-04] [ 5.85479079e-04 -1.55810717e-03 -1.29109548e-03] [ 3.33418218e-03 3.04223121e-03 -1.22809274e-03] [-2.51205317e-03 -9.61729112e-04 -4.57462677e-04]] Final stress: [ 0.03271807 0.03333677 0.13516628 -0.00051783 -0.00046118 0.00126042] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 101 steps. Final forces: [[-7.16742414e-04 -7.09554934e-04 -6.56370323e-04] [-1.28809504e-04 -4.95977133e-04 -6.61108262e-04] [-3.31026907e-04 7.13355616e-05 -4.31511140e-04] [ 2.26460332e-04 -3.15307991e-04 -6.47322325e-04] [-3.48364616e-04 -8.41714265e-04 1.71974395e-04] [-3.53125992e-04 8.70195943e-04 -1.45382067e-03] [-1.68575981e-03 -9.95921949e-05 2.07113914e-03] [ 1.23317423e-03 -9.57157304e-04 -5.58891881e-04] [-4.64719808e-04 -3.83250025e-05 -1.08207721e-04] [ 1.41027918e-04 4.26888378e-04 1.49104037e-03] [ 6.29750539e-04 1.17592472e-03 4.83170690e-04] [-3.56435154e-04 8.23814455e-04 -8.25848005e-05] [ 6.40273401e-04 -1.69067543e-03 -4.27727962e-04] [ 2.41540945e-04 1.98975795e-03 6.05796010e-04] [-3.47796713e-04 1.40835651e-03 1.00181056e-04] [ 2.73594010e-04 -1.99614722e-03 2.76849569e-04] [ 5.40316392e-04 -1.01575825e-04 3.24542984e-04] [ 5.11166536e-04 7.77943876e-04 2.01088218e-04] [-1.53183634e-04 8.84646115e-04 -5.89738367e-04] [ 6.59781882e-04 -3.43208838e-04 -5.77569984e-04] [-7.20499235e-04 -3.10572990e-04 3.78633349e-04] [ 6.07404648e-04 2.77143034e-05 2.53416572e-04] [-2.36373698e-04 6.38007657e-05 -1.55951765e-04] [ 1.38346649e-04 -6.20569442e-04 -7.02714939e-06]] Final stress: [ 0.0348788 0.03514744 0.14269507 -0.00032384 -0.00036841 -0.00055879] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 109 steps. Final forces: [[-2.87239574e-04 2.80713706e-05 -8.50070746e-05] [ 2.74510771e-05 -7.90019391e-04 1.00331527e-03] [-3.72920126e-04 -9.94033343e-04 -1.93693164e-04] [ 5.21036588e-04 -6.06686177e-04 1.71551367e-03] [-1.27500216e-04 1.01201210e-04 -1.42179843e-03] [-5.30041430e-04 2.24495073e-03 1.40928494e-03] [ 1.48400898e-03 -1.45896829e-04 -1.36429090e-03] [ 8.90450744e-04 -5.89441480e-04 -7.02328382e-04] [ 1.17639129e-03 -7.80504085e-04 -1.99717970e-03] [ 2.01736353e-03 5.25400065e-04 2.61921781e-03] [-3.27393830e-03 1.92769607e-03 3.29604297e-04] [ 1.23711088e-03 -3.46566445e-04 -6.51998128e-04] [ 6.80275939e-04 -2.12648998e-03 -4.66595773e-04] [-2.00783292e-03 3.57067759e-03 3.89908533e-04] [ 2.15078982e-03 -4.07084084e-04 -1.39999309e-04] [ 7.95216296e-05 5.76456346e-04 2.24964024e-04] [ 1.52798679e-04 -1.52408164e-03 -2.39868802e-04] [-7.71131768e-04 1.03320704e-03 1.21745100e-03] [ 1.00629572e-03 8.27491385e-04 -5.60636798e-05] [-1.91050711e-03 -1.36943876e-03 -1.02023120e-03] [-2.26236710e-04 -4.33369907e-04 -7.09896266e-04] [-1.63663136e-04 1.64432461e-04 1.55508039e-04] [-7.52779717e-04 6.27983127e-04 5.46441419e-04] [-9.99703871e-04 -1.51395527e-03 -5.62258194e-04]] Final stress: [ 0.03487491 0.03515179 0.14269474 0.00032419 -0.00036798 0.00055837] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 104 steps. Final forces: [[ 0.00769217 0.02060328 -0.03973005] [ 0.02401242 -0.02115631 0.02558191] [ 0.01686103 0.00931481 -0.03410451] [ 0.02021777 -0.00597939 0.03408327] [ 0.00429824 0.0605961 0.00539403] [-0.05563031 -0.02901355 -0.00013542] [ 0.04598307 -0.03092794 -0.02447455] [ 0.01523439 0.00042107 0.0230836 ] [ 0.01338524 -0.02327462 -0.02688108] [ 0.00207559 0.01647627 0.04393187] [-0.05286884 -0.03872713 -0.00755253] [ 0.03071809 0.01463064 -0.00035817] [-0.02494122 0.02490539 -0.00245758] [-0.06096187 -0.04029227 -0.00297997] [ 0.02132326 -0.00076573 0.0010986 ] [-0.00834052 0.03354558 -0.00158583] [ 0.00842252 -0.01282666 0.01179227] [-0.01626404 0.01237882 0.00299879] [ 0.00627262 0.01380776 -0.00938012] [-0.01100539 -0.00787984 -0.00608958] [ 0.01487469 0.00458654 -0.00280253] [ 0.00035574 0.00118065 -0.00918806] [-0.00350368 0.00491763 0.0094236 ] [ 0.00178903 -0.00652111 0.01033203]] Final stress: [ 0.03504168 0.03527177 0.14242237 0.00034074 0.0003341 -0.00057446] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-9.20312959e-04 -8.63225948e-04 -1.76682254e-03] [-9.20307417e-04 8.63225680e-04 -1.76631174e-03] [ 9.20312141e-04 8.63226505e-04 1.76672092e-03] [ 9.20308575e-04 -8.63225899e-04 1.76638131e-03] [-1.31264340e-10 3.82079884e-09 -6.34856606e-09] [-3.06407148e-09 -1.76374360e-09 -6.36699241e-09] [ 3.02925030e-09 -1.88932503e-09 -6.71330441e-09] [ 2.58577153e-10 -7.88854593e-08 2.26748873e-08] [ 6.78232324e-08 3.91685717e-08 2.27475705e-08] [-6.79540695e-08 3.95596018e-08 2.15118363e-08] [ 1.35732997e-09 2.17603012e-03 -7.77571364e-08] [-6.77687904e-04 1.87476007e-03 -4.04824487e-05] [ 6.77681839e-04 1.87476507e-03 4.03261240e-05] [-1.00329717e-09 -2.17613248e-03 7.45410103e-08] [ 6.77775741e-04 -1.87470941e-03 4.04795116e-05] [-6.77770484e-04 -1.87471355e-03 -4.03305567e-05] [ 9.24708188e-04 -7.32566133e-04 7.08399450e-04] [ 9.24707307e-04 7.32566249e-04 7.08407745e-04] [-9.24707874e-04 7.32566024e-04 -7.08398577e-04] [-9.24707536e-04 -7.32566252e-04 -7.08409959e-04] [-1.44605286e-03 -9.58256809e-04 5.97185851e-04] [-1.44605322e-03 9.58256984e-04 5.97193257e-04] [ 1.44605264e-03 9.58256674e-04 -5.97187999e-04] [ 1.44605351e-03 -9.58256908e-04 -5.97194630e-04]] Final stress: [ 1.36309509e-04 -1.13803615e-04 7.35527487e-05 7.36768478e-12 -9.99114496e-04 3.31155323e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 9.20479443e-04 -8.63225619e-04 -1.76611567e-03] [ 9.20476066e-04 8.63225395e-04 -1.76580897e-03] [-9.20479885e-04 8.63226524e-04 1.76593995e-03] [-9.20478905e-04 -8.63225993e-04 1.76583382e-03] [-1.13610258e-09 1.50247711e-07 2.39438187e-08] [-1.29669971e-07 -7.38038471e-08 2.33492122e-08] [ 1.32337382e-07 -7.66530403e-08 2.37439388e-08] [-6.44781387e-10 -1.47508963e-07 3.85884418e-08] [ 1.28517712e-07 7.45969972e-08 3.76552192e-08] [-1.26946233e-07 7.29434997e-08 3.81875227e-08] [-1.09165660e-09 2.17599574e-03 -3.96319921e-08] [-6.77618845e-04 1.87550725e-03 4.05103835e-05] [ 6.77622968e-04 1.87550365e-03 -4.05915381e-05] [-4.74066897e-11 -2.17622762e-03 3.41020787e-08] [ 6.77821461e-04 -1.87538985e-03 -4.05178042e-05] [-6.77822661e-04 -1.87538922e-03 4.05850666e-05] [-9.24935512e-04 -7.32520102e-04 7.09070100e-04] [-9.24934528e-04 7.32520068e-04 7.09071309e-04] [ 9.24934556e-04 7.32519949e-04 -7.09068371e-04] [ 9.24934943e-04 -7.32520122e-04 -7.09076718e-04] [ 1.44635601e-03 -9.58412677e-04 5.97092602e-04] [ 1.44635575e-03 9.58412825e-04 5.97094729e-04] [-1.44635567e-03 9.58412339e-04 -5.97097071e-04] [-1.44635651e-03 -9.58412374e-04 -5.97101758e-04]] Final stress: [ 1.36326215e-04 -1.13837018e-04 7.35179249e-05 2.64487063e-12 9.99174868e-04 -1.55480552e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.61605845e-03 9.52500106e-03 -3.11983162e-03] [-1.54408262e-03 -3.07229451e-02 7.58925752e-03] [ 1.61612850e-03 -9.52503696e-03 3.10475535e-03] [ 1.54399233e-03 3.07230285e-02 -7.63196238e-03] [-1.95374590e-07 3.10477727e-05 9.72935195e-06] [-2.69139826e-05 -1.54002413e-05 9.70824255e-06] [ 2.72194602e-05 -1.58002013e-05 1.00955873e-05] [ 5.80495888e-08 -1.54368041e-05 4.42606958e-06] [ 1.33424680e-05 7.66286181e-06 4.50072637e-06] [-1.35274020e-05 7.83717377e-06 4.37130603e-06] [ 2.97623082e-02 -2.09764972e-03 8.87214634e-03] [-2.25884388e-02 3.50080164e-02 8.78236210e-03] [-2.69631689e-02 -1.19162481e-02 -7.32177649e-03] [-2.97623738e-02 2.10971797e-03 -8.86713535e-03] [ 2.25780720e-02 -3.50139431e-02 -8.77736962e-03] [ 2.69736846e-02 1.19101321e-02 7.32666321e-03] [ 8.07607221e-03 7.55738112e-04 -3.71470945e-04] [-1.07956734e-02 3.61825590e-03 3.01513796e-03] [-8.07611915e-03 -7.55743771e-04 3.71565531e-04] [ 1.07956401e-02 -3.61824468e-03 -3.01468575e-03] [-1.89971801e-02 2.53281565e-03 -6.70861068e-03] [-1.38622993e-02 -7.78141481e-04 -2.79295462e-03] [ 1.89972663e-02 -2.53285055e-03 6.70850192e-03] [ 1.38622471e-02 7.78187254e-04 2.79257623e-03]] Final stress: [ 1.94178262e-05 -1.26615351e-04 5.32357964e-05 9.23441376e-05 -1.40716886e-04 7.27950280e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.54903420e-03 3.07832859e-02 7.42161777e-03] [-1.67659141e-03 -9.56415387e-03 -3.31733078e-03] [ 1.54891627e-03 -3.07834031e-02 -7.47922438e-03] [ 1.67658100e-03 9.56414775e-03 3.32832691e-03] [-1.67365322e-08 -5.39258284e-06 -1.94496510e-06] [ 4.72691826e-06 2.73737678e-06 -1.92508596e-06] [-4.66170776e-06 2.68117150e-06 -1.97553318e-06] [-2.70081925e-07 -4.27975130e-05 1.33042476e-05] [ 3.75183155e-05 2.17785498e-05 1.38051136e-05] [-3.70976574e-05 2.12268394e-05 1.32734514e-05] [-2.97012738e-02 -1.93387186e-03 -8.90162708e-03] [ 2.66951609e-02 -1.20053367e-02 7.24553061e-03] [ 2.28157096e-02 3.49705033e-02 -8.65785693e-03] [ 2.97012385e-02 1.91542749e-03 8.90568775e-03] [-2.66791539e-02 1.20146490e-02 -7.24161329e-03] [-2.28315805e-02 -3.49614074e-02 8.66190136e-03] [-1.08112701e-02 -3.60820869e-03 3.00430155e-03] [ 8.04448333e-03 -7.51147611e-04 -3.69892822e-04] [ 1.08112610e-02 3.60820234e-03 -3.00381097e-03] [-8.04455427e-03 7.51154790e-04 3.69846507e-04] [-1.38514907e-02 7.84760451e-04 -2.78498597e-03] [-1.89757666e-02 -2.53633081e-03 -6.69216784e-03] [ 1.38514181e-02 -7.84824775e-04 2.78427890e-03] [ 1.89757477e-02 2.53631995e-03 6.69248149e-03]] Final stress: [ 2.01724653e-05 -1.26406935e-04 5.22714374e-05 -9.18648496e-05 -1.43518109e-04 -7.29925937e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.55184072e-03 3.07752650e-02 7.50832180e-03] [ 1.64799222e-03 -9.55257533e-03 -3.26519412e-03] [-1.55181147e-03 -3.07753301e-02 -7.53157500e-03] [-1.64804871e-03 9.55261204e-03 3.23119409e-03] [-6.93701972e-08 2.20566158e-05 7.24671836e-06] [-1.90746072e-05 -1.09652639e-05 7.36946530e-06] [ 1.93288004e-05 -1.11918509e-05 7.16554576e-06] [ 1.56817424e-07 -2.40445152e-05 6.81265371e-06] [ 2.08331857e-05 1.19173285e-05 6.78523076e-06] [-2.10636430e-05 1.22305296e-05 7.07180965e-06] [ 2.97429864e-02 -1.98214750e-03 -8.88866896e-03] [-2.27380470e-02 3.49851913e-02 -8.70925876e-03] [-2.68105309e-02 -1.19755765e-02 7.28583512e-03] [-2.97430544e-02 1.99698552e-03 8.89360299e-03] [ 2.27251960e-02 -3.49925648e-02 8.71414081e-03] [ 2.68234271e-02 1.19681161e-02 -7.28091155e-03] [ 1.08104824e-02 -3.61523584e-03 3.01191624e-03] [-8.06297260e-03 -7.53575273e-04 -3.70592566e-04] [-1.08104535e-02 3.61523244e-03 -3.01187906e-03] [ 8.06294510e-03 7.53589880e-04 3.71097261e-04] [ 1.38609876e-02 7.83184161e-04 -2.79072327e-03] [ 1.89956225e-02 -2.53656747e-03 -6.70432708e-03] [-1.38609483e-02 -7.83217760e-04 2.79037596e-03] [-1.89957244e-02 2.53661141e-03 6.70419467e-03]] Final stress: [ 1.98372729e-05 -1.26554088e-04 5.26397469e-05 -9.20927774e-05 1.42228245e-04 7.26915208e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.62187696e-03 9.53371941e-03 -3.19140056e-03] [ 1.54045059e-03 -3.07417369e-02 7.59980650e-03] [-1.62206388e-03 -9.53382492e-03 3.11046489e-03] [-1.54053534e-03 3.07416774e-02 -7.56422732e-03] [-1.26813230e-07 -2.08165828e-05 -7.00172309e-06] [ 1.82573204e-05 1.05956104e-05 -7.26023241e-06] [-1.80487028e-05 1.03311765e-05 -6.99331566e-06] [-1.94584233e-07 -5.74908847e-05 1.82662904e-05] [ 5.03829890e-05 2.91803144e-05 1.80574119e-05] [-4.97038290e-05 2.85647301e-05 1.85706227e-05] [-2.97555323e-02 -2.08988400e-03 8.88197062e-03] [ 2.69258457e-02 -1.19225403e-02 -7.30981759e-03] [ 2.26235159e-02 3.50156758e-02 8.76074930e-03] [ 2.97554908e-02 2.05393993e-03 -8.87810167e-03] [-2.68946981e-02 1.19406215e-02 7.31379459e-03] [-2.26545561e-02 -3.49978552e-02 -8.75692635e-03] [-8.07072066e-03 7.54785286e-04 -3.70934865e-04] [ 1.08009530e-02 3.61697141e-03 3.01369490e-03] [ 8.07061239e-03 -7.54792699e-04 3.71682552e-04] [-1.08008923e-02 -3.61696445e-03 -3.01401878e-03] [ 1.89974840e-02 2.53446563e-03 -6.70770751e-03] [ 1.38626990e-02 -7.80621670e-04 -2.79180577e-03] [-1.89977597e-02 -2.53458684e-03 6.70672866e-03] [-1.38627365e-02 7.80586298e-04 2.79240935e-03]] Final stress: [ 1.95667942e-05 -1.26598270e-04 5.30308164e-05 9.22347860e-05 1.41365446e-04 -7.27721614e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 81 steps. Final forces: [[ 1.39367394e-03 3.80378937e-04 3.23851933e-03] [-1.95423545e-04 -5.41938438e-04 -3.00748700e-03] [-1.40069552e-03 -4.12235508e-04 1.18098454e-03] [ 2.30718754e-04 8.48592808e-04 -1.73524579e-03] [ 5.72099642e-05 2.54132877e-04 -1.08095379e-03] [ 6.40123386e-04 -1.38152287e-04 -2.71246419e-03] [-5.13808581e-04 -3.27991904e-04 -2.62221328e-03] [ 2.46414975e-05 1.18437522e-03 3.14621519e-03] [ 2.55442121e-03 -9.31581334e-04 1.34671346e-03] [-2.75754231e-03 -6.03922340e-04 1.55942379e-03] [ 1.24441109e-03 5.49784155e-03 -1.76793662e-03] [ 4.04548170e-05 -1.91563487e-03 2.63933669e-03] [ 2.07190472e-03 -1.42130304e-03 4.35975414e-04] [-1.50000270e-03 -5.95737011e-04 -6.28020772e-04] [-4.60989518e-03 -1.61476681e-03 1.58071557e-03] [ 2.79266259e-03 6.54167024e-04 -2.23573527e-03] [ 2.43224460e-04 -2.33144792e-03 7.97644816e-05] [ 1.29970421e-03 1.97836129e-03 9.96553489e-06] [-1.50582197e-04 -2.30193286e-03 -1.52170120e-04] [-1.29726213e-03 2.22048953e-03 -3.80367155e-05] [ 2.59440849e-04 -1.89809063e-03 3.38180930e-04] [ 2.90841039e-04 1.86844760e-03 -1.48603806e-04] [-3.73057871e-04 7.92531772e-05 1.50907552e-04] [-3.45162490e-04 6.86949343e-05 4.22164862e-04]] Final stress: [ 3.61659061e-02 3.61546944e-02 1.44658665e-01 -4.04889498e-07 3.21799560e-06 1.48814837e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 78 steps. Final forces: [[ 7.30967432e-04 -1.09244116e-03 -2.01767609e-03] [-1.27184711e-04 -1.33873512e-03 2.37667205e-03] [-2.02314831e-04 1.59764585e-03 -2.95367639e-03] [-7.86044751e-04 1.14064628e-03 3.20527294e-03] [-3.67971123e-03 -3.37307831e-04 7.70660763e-04] [-2.09807772e-03 3.41594086e-03 2.30741843e-03] [ 6.55498741e-03 -3.52085176e-03 1.61940015e-03] [ 1.09077040e-03 -3.71773564e-04 -2.02871706e-03] [-9.49244217e-03 -1.45200939e-03 -8.16879837e-04] [ 8.09341805e-03 7.60236008e-04 -2.38963065e-03] [ 1.35018076e-03 2.05694629e-04 3.05071528e-03] [-1.51924041e-04 2.02059532e-03 -2.53945222e-04] [-6.70332278e-04 -2.01900812e-03 -1.75477802e-03] [ 1.13868299e-03 -1.41178039e-04 9.00293317e-04] [-2.62631769e-04 1.77483863e-03 -1.32739086e-03] [-1.02784328e-03 -1.77471019e-03 -1.00230939e-03] [ 1.61833080e-03 2.08512440e-03 9.29897937e-06] [-1.43608397e-03 -4.84717191e-04 -1.23304815e-05] [ 1.06618682e-03 1.16276446e-03 -1.37089623e-04] [-1.96678991e-03 -1.24716695e-03 1.03663360e-04] [ 8.86646230e-04 4.75590347e-04 5.61738052e-04] [-4.71964663e-04 -5.50209540e-04 -5.18778338e-04] [ 7.39673674e-04 4.68824976e-04 2.38885621e-04] [-8.96499245e-04 -7.77792901e-04 6.91830157e-05]] Final stress: [ 3.61660626e-02 3.61507711e-02 1.44658643e-01 -9.11063451e-06 2.39713045e-06 -1.47760117e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 3.36535105e-10 7.17484106e-04 8.33811624e-04] [-2.23743508e-09 -7.17483077e-04 8.33893027e-04] [ 5.83256105e-10 -7.17483289e-04 -8.33580564e-04] [-1.20986637e-09 7.17485897e-04 -8.33740427e-04] [-2.44685307e-09 -1.49519133e-07 -4.40739982e-08] [ 1.29971247e-07 7.68953728e-08 -4.48784507e-08] [-1.24258400e-07 7.07637941e-08 -4.03885137e-08] [ 6.19142281e-10 1.32379743e-07 -4.68569974e-08] [-1.15609150e-07 -6.70002228e-08 -4.83326010e-08] [ 1.14332186e-07 -6.55425230e-08 -4.74082674e-08] [-5.53504576e-10 -2.47145225e-03 -3.96690012e-08] [-7.98204879e-04 5.94379012e-04 -4.07811149e-08] [ 7.98206113e-04 5.94377655e-04 -3.90883358e-08] [ 4.58518001e-10 2.47153745e-03 2.64070153e-09] [ 7.98125188e-04 -5.94422651e-04 3.84701712e-09] [-7.98125811e-04 -5.94421747e-04 4.16227736e-09] [-3.39006545e-10 -1.68202471e-04 6.20008491e-05] [ 8.11994361e-11 1.68202312e-04 6.20049248e-05] [-2.92758706e-10 1.68202361e-04 -6.20043330e-05] [ 1.47903023e-10 -1.68202238e-04 -6.20059194e-05] [-9.05269193e-11 3.61213084e-04 -8.83839831e-04] [-3.85665739e-11 -3.61212674e-04 -8.83836795e-04] [ 5.57580009e-11 -3.61212979e-04 8.83839627e-04] [-1.20389310e-10 3.61213520e-04 8.83838644e-04]] Final stress: [ 1.29214931e-03 7.96637033e-04 7.16922370e-04 -7.81663964e-12 -3.61985828e-12 -4.26487408e-13] Minimization converged after 26 steps. Minimization converged after 6 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.09108858e-12 -2.50341979e-05 -1.16911814e-05] [-2.23528317e-12 2.50342015e-05 -1.16917351e-05] [-4.39150848e-12 2.50342021e-05 1.16914705e-05] [ 1.19093624e-12 -2.50342016e-05 1.16915991e-05] [ 8.14802327e-14 1.11916032e-11 1.66530123e-11] [-1.01721687e-11 -5.60829161e-12 1.65754910e-11] [ 1.09309783e-11 -6.10528295e-12 1.76149373e-11] [ 5.31331468e-12 2.49627430e-10 -6.56715793e-11] [-2.14720131e-10 -1.30206734e-10 -6.74865719e-11] [ 2.14772089e-10 -1.24184940e-10 -7.68211779e-11] [-2.36499709e-12 1.04573936e-04 5.92765708e-11] [-3.97585356e-05 5.74364137e-05 6.04495127e-11] [ 3.97585414e-05 5.74364072e-05 5.96480993e-11] [ 3.61322083e-13 -1.04573764e-04 -6.01130732e-11] [ 3.97584008e-05 -5.74364955e-05 -5.95986366e-11] [-3.97584009e-05 -5.74364948e-05 -6.36155005e-11] [ 1.00364161e-13 1.59285995e-04 -3.25136744e-06] [ 5.66047209e-13 -1.59285995e-04 -3.25137257e-06] [ 1.55375712e-13 -1.59285995e-04 3.25136582e-06] [ 7.40435491e-13 1.59285994e-04 3.25137608e-06] [-1.01924025e-12 -1.37078104e-04 -5.04305767e-06] [-2.89534293e-14 1.37078105e-04 -5.04306600e-06] [-6.27431212e-13 1.37078105e-04 5.04306420e-06] [-3.40616424e-13 -1.37078105e-04 5.04306757e-06]] Final stress: [-2.89006216e-04 3.16341603e-04 1.04329713e-05 4.70675252e-15 -6.92242030e-15 -9.02555765e-16] Minimization converged after 7 steps. Minimization converged after 29 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 2.68627620e-11 -7.42446782e-05 -4.07686689e-05] [ 7.82380156e-13 7.42447328e-05 -4.07682402e-05] [ 7.39078746e-11 7.42447956e-05 4.07698046e-05] [ 1.62742042e-11 -7.42447542e-05 4.07689393e-05] [ 3.97011246e-11 -3.81638665e-10 -1.73437820e-10] [ 2.58281604e-10 1.37286217e-10 -1.38433237e-10] [-3.42252560e-10 2.34097075e-10 -1.94918887e-10] [ 9.72583314e-11 -4.69075889e-10 3.75022235e-12] [ 1.77938664e-10 7.62329089e-11 -1.74415926e-10] [-3.86019439e-10 3.10530490e-10 -2.54491810e-11] [ 9.09006204e-12 -8.69024582e-05 -2.52049660e-10] [-4.60034751e-05 6.94514338e-05 -3.25603019e-10] [ 4.60034484e-05 6.94514614e-05 -2.66609632e-10] [-4.98460162e-11 8.69035907e-05 -1.40205591e-11] [ 4.60024961e-05 -6.94519775e-05 -6.61798605e-11] [-4.60024233e-05 -6.94520720e-05 -7.55009122e-11] [ 2.09016138e-12 2.05463928e-05 3.44800997e-05] [ 1.13349885e-11 -2.05463873e-05 3.44801290e-05] [ 5.28360689e-12 -2.05463947e-05 -3.44801454e-05] [ 1.36483325e-11 2.05463990e-05 -3.44801452e-05] [ 2.91811020e-12 -7.00436697e-05 -3.90192424e-05] [-4.23499297e-12 7.00436743e-05 -3.90192120e-05] [-2.40303155e-12 7.00436762e-05 3.90191881e-05] [ 3.28748140e-12 -7.00436722e-05 3.90191963e-05]] Final stress: [-3.17137169e-04 -1.70867819e-05 3.18735413e-04 3.83384519e-14 -1.82930300e-13 3.04304910e-14] Minimization converged after 25 steps. Minimization converged after 51 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-4.15701662e-06 4.38376432e-05 6.19017437e-05] [ 9.48202748e-08 -6.43288447e-05 -5.49634184e-05] [ 2.28550170e-06 -4.03184942e-05 3.71152229e-05] [-7.28090891e-06 4.43560319e-05 3.55359081e-05] [-1.17960646e-05 -5.47409335e-04 -9.19797284e-05] [ 5.16715804e-04 2.93909878e-04 -1.13134853e-04] [-4.93029237e-04 2.66579752e-04 -9.76738987e-05] [-2.76101762e-06 5.76235473e-05 1.19632724e-05] [-8.90858320e-05 -3.28088818e-05 -2.03359548e-06] [ 9.55074867e-05 -3.96897344e-05 -6.97179994e-06] [ 1.42451118e-05 3.74681672e-04 6.06942845e-05] [-3.50011887e-04 -2.31207756e-04 2.85647817e-05] [ 3.25844081e-04 -2.00854984e-04 2.76738202e-05] [-5.79029960e-06 5.00477025e-04 -2.24805719e-06] [-3.43812444e-04 -2.03093272e-04 2.70398731e-05] [ 3.55402248e-04 -2.16464363e-04 2.71326604e-05] [-1.44514787e-06 -7.97808871e-07 1.00317793e-04] [-2.44485997e-07 1.71614374e-06 5.46620523e-05] [-1.28383169e-06 -2.05971061e-06 -1.05758967e-04] [-4.65937552e-07 3.09281525e-06 -3.30090381e-05] [ 1.46067009e-06 -4.18942903e-05 -1.99880280e-04] [-8.89669023e-07 4.34976729e-05 -1.38024934e-04] [-8.17122430e-07 3.96229356e-05 2.08724069e-04] [ 1.31517833e-06 -4.84676434e-05 1.64353089e-04]] Final stress: [-6.71351315e-04 -3.82677649e-04 -3.37352934e-04 -2.48027356e-04 2.97497459e-09 8.96826528e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 4.45714369e-06 1.80057386e-05 -2.12926298e-04] [-6.84306546e-06 -3.27894450e-06 -9.51816125e-05] [ 8.32751692e-06 -2.88953642e-05 -1.32499542e-04] [-1.47446447e-05 -2.85769420e-06 -1.24379958e-04] [-2.06364999e-05 4.84708812e-04 1.17054841e-04] [-3.93542289e-04 -2.16413492e-04 9.88152612e-05] [ 4.37823700e-04 -2.65706482e-04 1.30386543e-04] [ 1.06218522e-05 1.42733807e-04 1.27961856e-07] [-1.14435751e-04 -7.94986619e-05 3.00955529e-06] [ 9.09771001e-05 -5.36778991e-05 2.02541468e-05] [ 9.03731606e-06 -4.17282787e-04 -4.12248037e-06] [ 3.29458922e-04 1.68855790e-04 3.02099274e-05] [-3.44868828e-04 1.88162276e-04 3.33744651e-05] [-7.93419382e-06 -3.27578041e-04 6.56539115e-05] [ 3.45153903e-04 2.07648731e-04 2.66485363e-05] [-3.30215399e-04 1.89864312e-04 3.42284099e-05] [-2.57810317e-06 -2.50567814e-05 1.54342247e-05] [ 1.59037680e-06 6.80332851e-06 5.04588402e-05] [-2.60886402e-06 2.40116027e-05 -6.94623754e-07] [ 1.24840436e-06 -8.00900860e-06 -5.67274168e-05] [ 1.28192410e-06 -4.93149896e-05 -8.66703226e-05] [-1.38136342e-06 2.97595000e-05 -1.38677607e-04] [-6.64084238e-07 4.82906637e-05 1.01046565e-04] [ 4.74925812e-07 -3.12744162e-05 1.25176672e-04]] Final stress: [-6.73076599e-04 -3.78600643e-04 -3.35869839e-04 2.50640963e-04 1.13614696e-08 7.55635378e-09] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 5.48048088e-05 -2.63289268e-05 7.63009129e-05] [ 5.51612167e-05 2.58797772e-05 -1.17407173e-04] [-5.45341064e-05 2.57460688e-05 2.19209309e-05] [-5.49595114e-05 -2.62404973e-05 7.57102317e-05] [-7.51496306e-10 -9.79831344e-07 3.60076113e-06] [ 1.05428781e-06 5.59805061e-07 3.43665019e-06] [-1.09361680e-06 5.81214706e-07 3.36610675e-06] [ 4.36576514e-07 6.11103558e-05 -2.00116200e-05] [-5.19511088e-05 -3.07915653e-05 -1.96038240e-05] [ 5.10799004e-05 -2.97824596e-05 -1.92197210e-05] [ 2.03893951e-07 -6.75531678e-05 2.05658457e-05] [-1.19854819e-04 -4.28933198e-06 5.82632363e-05] [ 1.19186778e-04 -3.66797864e-06 -1.70705087e-05] [-7.98497038e-08 1.54772462e-04 -2.36759334e-05] [ 4.57549401e-05 -3.92050297e-05 -6.13731919e-05] [-4.53447109e-05 -3.95339459e-05 1.38406377e-05] [-2.54046945e-05 1.51691545e-05 5.06887610e-06] [-2.54720843e-05 -1.52177894e-05 3.54152253e-06] [ 2.54700261e-05 -1.51906556e-05 -6.43191695e-06] [ 2.55050802e-05 1.51134459e-05 -2.23799283e-06] [ 2.04715886e-05 4.64504756e-05 1.55210610e-05] [ 2.04655997e-05 -4.65224016e-05 1.31509125e-05] [-2.05089832e-05 -4.65347745e-05 -1.45312808e-05] [-2.03904605e-05 4.64555956e-05 -1.27245226e-05]] Final stress: [7.04090902e-04 3.98054415e-04 3.77606399e-04 4.12547845e-10 2.54097826e-04 3.78367323e-10] Minimization converged after 37 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 8.49374072e-04 -1.11680842e-03 4.05725480e-05] [-8.49374129e-04 1.11680843e-03 4.05776820e-05] [-8.49374133e-04 1.11680846e-03 -4.05705072e-05] [ 8.49374094e-04 -1.11680855e-03 -4.05782560e-05] [-3.65421267e-11 2.58715122e-09 4.65407601e-10] [-2.13106285e-09 -1.21414467e-09 3.64458325e-10] [ 2.20483459e-09 -1.30131550e-09 4.00189076e-10] [-4.41909935e-11 -1.55446100e-09 -1.55873092e-11] [ 1.47141888e-09 8.40916003e-10 3.83079124e-11] [-1.37310308e-09 7.21297799e-10 -5.13017441e-11] [ 4.11374505e-05 -6.35047618e-05 -1.50210578e-09] [ 1.31673006e-04 -9.16592319e-04 -1.52512768e-09] [-5.45051752e-04 -6.64324872e-04 -1.52240151e-09] [-4.11374931e-05 6.35063510e-05 8.57488507e-10] [-1.31674280e-04 9.16591587e-04 7.56755005e-10] [ 5.45053106e-04 6.64324040e-04 7.32557172e-10] [-6.67608781e-04 -3.91359386e-04 9.53468899e-05] [ 6.67608768e-04 3.91359385e-04 9.53470593e-05] [ 6.67608775e-04 3.91359380e-04 -9.53469980e-05] [-6.67608781e-04 -3.91359388e-04 -9.53471240e-05] [ 1.47473989e-04 -1.31751089e-06 7.61709906e-04] [-1.47473997e-04 1.31750573e-06 7.61710015e-04] [-1.47473992e-04 1.31751180e-06 -7.61710053e-04] [ 1.47473987e-04 -1.31751830e-06 -7.61710161e-04]] Final stress: [ 6.86996281e-04 4.16888390e-04 3.37408364e-04 2.42773054e-13 -1.41673076e-13 2.79827347e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-8.31059218e-04 -1.11366392e-03 3.16909590e-05] [ 8.31059244e-04 1.11366393e-03 3.17000443e-05] [ 8.31059079e-04 1.11366399e-03 -3.16948420e-05] [-8.31059195e-04 -1.11366406e-03 -3.16986766e-05] [ 2.17604068e-11 2.37437181e-10 -2.82482926e-11] [ 4.74410372e-11 -8.64834038e-11 -1.45618684e-10] [-1.02276410e-10 -2.26331731e-11 -1.89227384e-10] [-7.78425603e-11 -2.88566815e-09 9.54101131e-10] [ 2.50115784e-09 1.51530821e-09 9.68155445e-10] [-2.30258412e-09 1.31797129e-09 8.11172247e-10] [-5.51160784e-05 -7.17464879e-05 -1.12058661e-09] [ 5.69843678e-04 -6.39833209e-04 -1.05891315e-09] [-1.36187834e-04 -9.20547032e-04 -1.18912737e-09] [ 5.51160512e-05 7.17445619e-05 1.24415481e-09] [-5.69841917e-04 6.39834212e-04 1.15379169e-09] [ 1.36186125e-04 9.20547982e-04 1.18427480e-09] [ 6.60924264e-04 -3.86532672e-04 8.91718066e-05] [-6.60924260e-04 3.86532666e-04 8.91719312e-05] [-6.60924255e-04 3.86532646e-04 -8.91717873e-05] [ 6.60924241e-04 -3.86532657e-04 -8.91719616e-05] [-1.49393370e-04 -1.29514493e-06 7.61061223e-04] [ 1.49393368e-04 1.29514074e-06 7.61061345e-04] [ 1.49393359e-04 1.29514577e-06 -7.61061266e-04] [-1.49393369e-04 -1.29515000e-06 -7.61061359e-04]] Final stress: [ 6.87255266e-04 4.16792908e-04 3.38019088e-04 1.88324334e-13 4.89765284e-13 -2.80190226e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 77 steps. Final forces: [[-6.99537128e-03 1.50177792e-03 -1.12244604e-03] [-7.11128451e-03 4.55167992e-03 1.29755537e-03] [ 6.64498892e-03 -5.14412905e-03 2.53270827e-03] [ 7.28075861e-03 -1.16429839e-03 -2.35520069e-03] [-6.84475582e-03 -5.97989723e-03 -3.19050470e-03] [-3.67532430e-04 7.52202660e-03 -6.01822423e-05] [ 7.74544604e-03 -4.54348115e-03 -3.64421520e-03] [ 3.67775209e-03 -1.04007226e-02 2.64622658e-04] [ 4.74472221e-03 2.76820398e-03 3.10025498e-03] [-6.75178514e-03 8.20074527e-03 -1.06956719e-03] [ 8.56782675e-03 -4.87251287e-03 7.65095275e-04] [-2.35897295e-03 1.01646361e-02 -1.02283040e-04] [-6.72874555e-03 -3.79351953e-03 6.58884370e-03] [ 8.43264998e-03 -3.25863260e-03 -4.55578368e-03] [-4.52563557e-06 1.01347010e-02 2.47332138e-03] [-1.06945466e-02 -5.42807169e-03 2.67222280e-03] [ 1.89752378e-03 3.85858484e-03 1.00157793e-03] [-5.29559140e-03 2.91537400e-03 -2.26379383e-04] [ 4.92840563e-03 -2.78845938e-03 -2.07775879e-04] [-2.75985400e-03 -2.56021092e-03 1.50287642e-04] [ 7.57336756e-04 -1.42925813e-03 -6.34089186e-04] [-1.83744564e-03 -8.94393471e-04 -1.59093257e-03] [ 2.60056738e-03 -3.19152625e-04 -2.49283484e-03] [ 4.72432845e-04 9.59009990e-04 4.05704622e-04]] Final stress: [ 3.53515530e-02 3.58244604e-02 1.44524995e-01 3.33877045e-05 -4.94316844e-05 4.64254248e-04] Minimization converged after 197 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-8.93066177e-12 -6.43189613e-05 1.26614754e-06] [ 4.91514456e-11 6.43188114e-05 1.27756617e-06] [-1.64043054e-11 6.43188307e-05 -1.27396868e-06] [ 8.12745704e-11 -6.43190385e-05 -1.27988589e-06] [ 4.36027078e-11 -1.73054765e-09 1.95976957e-10] [ 1.62733291e-09 8.74903643e-10 8.01549105e-11] [-1.77211634e-09 1.00569320e-09 -6.14928664e-11] [-5.85667711e-11 -7.58302088e-10 9.84083259e-10] [ 8.60957861e-10 5.02078379e-10 1.15348353e-09] [-7.57783170e-10 3.73374720e-10 1.09532055e-09] [ 1.80104820e-11 6.77976719e-05 -5.75284375e-10] [ 4.47796258e-05 6.11338642e-05 -5.80242033e-10] [-4.47796595e-05 6.11339047e-05 -5.99907813e-10] [ 5.33873501e-11 -6.78003141e-05 2.59595679e-09] [-4.47770412e-05 -6.11325447e-05 2.54433569e-09] [ 4.47769350e-05 -6.11324204e-05 2.49769985e-09] [ 5.30350763e-12 5.28482155e-05 6.08050249e-05] [-9.39659461e-12 -5.28482175e-05 6.08051829e-05] [ 5.98537886e-12 -5.28482266e-05 -6.08047920e-05] [-7.84403098e-12 5.28482177e-05 -6.08050411e-05] [ 2.17220686e-12 -8.31236886e-05 -1.68039439e-04] [ 1.03540914e-11 8.31236600e-05 -1.68039277e-04] [ 6.77469298e-12 8.31236591e-05 1.68039641e-04] [ 6.63769040e-12 -8.31236906e-05 1.68039512e-04]] Final stress: [ 7.57435653e-04 1.05347352e-03 1.03154636e-03 1.91217532e-13 -7.22210831e-14 -7.04350586e-15] Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-5.30078759e-12 4.47781427e-05 -8.69859633e-05] [-1.17039892e-11 -4.47782126e-05 -8.69831766e-05] [ 2.28575234e-11 -4.47783473e-05 8.69843216e-05] [-1.62519997e-12 4.47783038e-05 8.69815639e-05] [ 2.15166378e-11 -5.19445154e-10 1.08462683e-10] [ 2.96471542e-10 1.92734065e-10 2.25688773e-10] [-3.17240401e-10 2.29043173e-10 2.27734470e-10] [ 2.49736728e-12 3.37532224e-11 6.54379884e-11] [ 3.81413123e-10 6.58332278e-11 2.67012967e-10] [-4.05735556e-10 8.65058580e-11 2.98751808e-10] [ 2.58087995e-12 4.07666855e-05 -2.15339245e-10] [ 1.24355528e-04 -5.19276808e-05 -1.92099393e-10] [-1.24355534e-04 -5.19276758e-05 -1.63929038e-10] [-2.93728930e-11 -4.07670720e-05 7.52851583e-10] [-1.24354951e-04 5.19279365e-05 8.23378998e-10] [ 1.24355000e-04 5.19278787e-05 8.10147254e-10] [ 1.49241730e-12 -2.30871879e-05 4.43688639e-05] [-1.59483537e-13 2.30871726e-05 4.43689076e-05] [ 3.37874173e-12 2.30871993e-05 -4.43687881e-05] [ 1.19726451e-12 -2.30872118e-05 -4.43688696e-05] [ 1.42974521e-12 6.85559033e-05 -3.59942071e-05] [-4.63964964e-12 -6.85559133e-05 -3.59941312e-05] [-1.29884582e-12 -6.85559219e-05 3.59942450e-05] [-5.79036818e-13 6.85559129e-05 3.59942258e-05]] Final stress: [-1.70253296e-05 -3.16727141e-04 3.18373780e-04 -8.20475344e-14 -1.08033330e-13 1.55428170e-14] Minimization converged after 32 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-3.65271052e-08 1.87986309e-05 1.46584262e-05] [ 1.17126974e-08 -7.07838435e-06 -1.34901563e-05] [-1.98906223e-08 -1.87080839e-05 -1.43890443e-05] [ 1.30342981e-08 7.09092683e-06 1.44707079e-05] [ 1.33589329e-08 4.87568497e-07 4.73831998e-08] [-4.18294449e-07 -2.58514882e-07 5.58054044e-08] [ 3.84069089e-07 -2.23542820e-07 2.66839853e-08] [-3.26676791e-08 9.60512663e-08 -6.79523531e-08] [-3.36646353e-07 -6.11337322e-08 -1.61862573e-07] [ 4.16764727e-07 -1.45237419e-07 -2.27018847e-07] [ 4.84003954e-09 -1.67685847e-05 1.91888081e-05] [-2.35999761e-06 -9.08967619e-06 7.55814874e-06] [ 2.35342520e-06 -9.08077460e-06 7.54680739e-06] [-1.78329755e-08 1.39967358e-05 -1.94642320e-05] [ 4.71630000e-06 1.04752729e-05 -7.80885562e-06] [-4.68260345e-06 1.04355552e-05 -7.83978629e-06] [ 1.90145855e-09 6.78568143e-06 5.33297907e-05] [-4.92745628e-09 3.21539280e-05 3.14229760e-05] [ 2.90639618e-09 -6.78566883e-06 -5.33049470e-05] [-4.30430949e-09 -3.21299730e-05 -3.14997492e-05] [-9.19195720e-10 -5.08629429e-05 -1.12461921e-05] [-1.66829557e-09 5.42769288e-05 4.37074008e-06] [-3.16342582e-09 5.08668813e-05 1.12271539e-05] [ 1.13008275e-09 -5.42716435e-05 -4.40363510e-06]] Final stress: [ 3.98712592e-04 7.04666702e-04 3.76064321e-04 -2.53817200e-04 -5.14065965e-11 1.01176338e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.13179551e-08 7.23401615e-06 -1.28404358e-05] [ 3.76009814e-08 -1.88557647e-05 1.48431907e-05] [-1.19184155e-08 -7.22228858e-06 1.47775968e-05] [-1.62081195e-08 1.88487049e-05 -1.43110411e-05] [ 5.72362115e-08 2.36003081e-07 -3.93848422e-08] [-1.65955003e-07 -1.65096258e-07 -4.50191958e-08] [ 6.00321484e-08 -3.79283130e-08 -1.06765307e-07] [-2.33246258e-08 1.19543837e-06 -4.12966333e-07] [-1.08406374e-06 -5.82326517e-07 -4.20255148e-07] [ 1.12078267e-06 -6.30745991e-07 -4.35619346e-07] [ 1.23775598e-08 -1.52540197e-05 -1.88451062e-05] [-3.94243063e-06 -9.65884281e-06 -7.18854914e-06] [ 3.91724010e-06 -9.62976968e-06 -7.21545716e-06] [-3.04920811e-08 1.55674259e-05 1.85232985e-05] [ 3.58710788e-06 9.50756874e-06 6.87180195e-06] [-3.53491984e-06 9.44275242e-06 6.92882801e-06] [ 7.54370452e-09 -3.22302903e-05 3.14943393e-05] [-1.23205834e-10 -6.82197158e-06 5.31593296e-05] [ 4.40285042e-09 3.22226385e-05 -3.15288351e-05] [-3.90711583e-09 6.82673190e-06 -5.31735782e-05] [ 2.24905500e-09 -5.42381546e-05 4.30640255e-06] [-2.13858206e-09 5.07138521e-05 -1.12142499e-05] [-3.84426755e-09 5.42420725e-05 -4.29907767e-06] [ 1.43452233e-09 -5.07100057e-05 1.11715531e-05]] Final stress: [3.98711685e-04 7.04665795e-04 3.76067296e-04 2.53821650e-04 2.20906751e-10 1.81163825e-11] Minimization converged after 53 steps. Minimization converged after 54 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 48 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 1.48215551e-05 -1.54722291e-03 -1.13015064e-04] [-1.48215644e-05 1.54722279e-03 -1.12977697e-04] [-1.48215884e-05 1.54722266e-03 1.12986243e-04] [ 1.48217198e-05 -1.54722272e-03 1.12982163e-04] [ 9.95568825e-11 4.47842224e-09 3.12134041e-10] [-3.97763947e-09 -2.37018963e-09 4.36687103e-10] [ 3.72852871e-09 -2.11822349e-09 2.09701728e-10] [-7.15737637e-11 -2.38148989e-08 6.82405032e-09] [ 2.09623063e-08 1.20744492e-08 7.09403503e-09] [-2.08625776e-08 1.19235812e-08 6.91344329e-09] [-9.12008150e-04 2.82173722e-05 -3.22467909e-09] [-9.23759146e-05 1.43711460e-05 -3.16826241e-09] [-9.66464616e-04 -4.83969642e-04 -3.10568101e-09] [ 9.12008212e-04 -2.82313385e-05 4.18641462e-09] [ 9.23880864e-05 -1.43641860e-05 4.37267624e-09] [ 9.66452338e-04 4.83976705e-04 4.25721357e-09] [-6.35426765e-04 1.92935435e-04 1.86479155e-04] [ 6.35426745e-04 -1.92935439e-04 1.86479417e-04] [ 6.35426800e-04 -1.92935434e-04 -1.86478954e-04] [-6.35426788e-04 1.92935425e-04 -1.86479653e-04] [ 1.67866539e-04 -1.98437806e-04 7.15830657e-04] [-1.67866523e-04 1.98437789e-04 7.15831175e-04] [-1.67866484e-04 1.98437766e-04 -7.15831191e-04] [ 1.67866519e-04 -1.98437786e-04 -7.15831358e-04]] Final stress: [ 4.07729955e-04 6.69162375e-04 3.22054418e-04 7.16150520e-14 -8.63131459e-13 2.53744775e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.46730620e-05 -1.54806584e-03 -1.13039928e-04] [ 1.46729131e-05 1.54806581e-03 -1.13029292e-04] [ 1.46730003e-05 1.54806584e-03 1.13061413e-04] [-1.46729269e-05 -1.54806579e-03 1.13015229e-04] [-8.34209173e-11 1.46547371e-08 3.76752940e-09] [-1.26919169e-08 -7.24060852e-09 3.68096206e-09] [ 1.28233620e-08 -7.42210587e-09 3.79499948e-09] [ 3.78745538e-11 7.39414041e-09 -3.64303454e-09] [-6.76185519e-09 -3.76398368e-09 -3.65079611e-09] [ 6.71003547e-09 -3.70625886e-09 -3.70814249e-09] [ 9.12225818e-04 2.78793539e-05 -6.18565607e-09] [ 9.66806861e-04 -4.84181120e-04 -6.19357375e-09] [ 9.23480573e-05 1.42283512e-05 -6.16257241e-09] [-9.12225868e-04 -2.78666185e-05 3.95421968e-09] [-9.66817939e-04 4.84174806e-04 4.12241333e-09] [-9.23368816e-05 -1.42347712e-05 3.94349629e-09] [ 6.35593171e-04 1.92984316e-04 1.86481827e-04] [-6.35593182e-04 -1.92984294e-04 1.86482680e-04] [-6.35593197e-04 -1.92984309e-04 -1.86482255e-04] [ 6.35593181e-04 1.92984325e-04 -1.86482718e-04] [-1.67873812e-04 -1.98490806e-04 7.15931730e-04] [ 1.67873829e-04 1.98490820e-04 7.15931990e-04] [ 1.67873808e-04 1.98490808e-04 -7.15931858e-04] [-1.67873805e-04 -1.98490803e-04 -7.15932538e-04]] Final stress: [ 4.07725557e-04 6.69156197e-04 3.22047255e-04 4.19288218e-14 -2.48426009e-14 -2.53737441e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 83 steps. Final forces: [[-6.65046429e-04 5.44227257e-04 -2.07358812e-05] [-9.55792460e-05 -8.54162973e-04 1.09177149e-03] [-3.25845872e-04 8.44166579e-04 -7.03910365e-04] [ 9.02823619e-04 -5.38861665e-04 1.68200486e-03] [-3.12065184e-04 1.20467068e-03 3.91617290e-04] [-1.33798020e-03 -1.52092602e-05 -9.60896215e-05] [ 1.12739494e-03 -2.73288428e-04 -1.18557335e-03] [ 2.25932694e-04 -1.91576893e-03 7.15479106e-04] [ 1.85597180e-03 4.16439402e-04 3.71839606e-05] [-1.74530620e-03 6.43619087e-04 -7.23474772e-04] [-2.12260668e-04 -6.93180332e-04 -1.67726056e-03] [ 7.58170903e-04 5.64939804e-04 1.00172060e-03] [-2.22222952e-04 2.67368551e-04 -1.65866855e-04] [ 3.37141383e-04 -1.10668449e-03 -6.19893717e-04] [ 4.14267013e-04 4.37367399e-04 5.03124768e-04] [-1.10548779e-03 4.96730813e-04 5.64232878e-04] [ 6.71277802e-04 -9.83476343e-04 -8.17995165e-05] [-6.17446352e-04 4.92854726e-04 4.09856034e-05] [ 5.61264431e-04 -4.10602680e-04 9.21585427e-05] [-7.22604859e-04 9.43011183e-04 -5.98679028e-05] [ 1.78687451e-04 2.28383861e-04 -2.79101316e-04] [ 1.85888431e-04 5.84650621e-05 -2.52589767e-04] [ 1.65008413e-04 -8.92407429e-05 7.74553682e-05] [-2.19831180e-05 -2.61768558e-04 -3.31570840e-04]] Final stress: [ 3.58190654e-02 3.53540578e-02 1.44532687e-01 -1.65511665e-06 -2.53143129e-06 4.63043091e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 87 steps. Final forces: [[ 0.00121229 -0.01006245 0.07853931] [ 0.00414568 -0.02257912 -0.05690196] [-0.0068432 0.0121767 0.03284486] [-0.00141753 0.00500076 -0.00853548] [-0.00032107 0.0344998 0.01254173] [-0.03125866 -0.01535133 -0.0058722 ] [ 0.0292809 -0.01203811 0.00887459] [-0.00265399 -0.07983401 -0.00347176] [ 0.06826265 0.03512775 -0.03016158] [-0.06724908 0.03256797 -0.01470566] [ 0.01895471 0.00855416 -0.02818044] [-0.00828551 0.01265343 -0.00511258] [-0.00733906 -0.01288733 0.02382887] [ 0.02182837 0.0011245 -0.00658921] [-0.01700335 0.01867929 0.03366649] [-0.00792561 -0.01929536 0.01283378] [-0.01822931 -0.0196329 0.00043986] [ 0.01451271 0.00306176 0.00371641] [-0.01600928 -0.00472191 0.00301833] [ 0.01408234 0.01906337 -0.00254801] [-0.01168175 0.00674491 -0.00126513] [-0.00089126 0.00663642 -0.0200657 ] [ 0.00766567 0.00036598 -0.02468553] [ 0.01716335 0.00014569 -0.00220899]] Final stress: [ 3.57740685e-02 3.53216277e-02 1.44442895e-01 -8.87666206e-05 5.30430107e-05 -4.67674200e-04] Minimization converged after 6 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 62 steps. Final forces: [[ 4.27518636e-05 3.53003417e-04 3.58623243e-04] [-1.25060209e-04 -9.59636050e-04 -2.74629109e-04] [-2.68995920e-04 3.81390665e-04 3.38401125e-04] [ 9.80595340e-05 -1.01189017e-03 -2.40527437e-04] [-1.18866087e-04 9.99288416e-04 -4.83778823e-04] [ 9.22990567e-05 3.67009917e-04 9.47609830e-05] [ 2.00716193e-04 1.25904941e-04 3.29621644e-04] [ 1.56833132e-04 -6.28559119e-04 -5.02594792e-04] [-4.56872854e-04 -6.79691173e-04 -2.37597397e-04] [ 5.84459600e-05 1.07279028e-04 5.13131368e-06] [-5.36863474e-04 1.80029220e-03 -3.25387466e-04] [ 1.53414465e-03 2.76803838e-04 4.45028274e-04] [-5.00413053e-04 -1.24162914e-03 4.17633108e-05] [-5.00720479e-05 1.72550211e-03 -2.19086836e-04] [ 9.96779314e-04 -8.97106325e-04 4.55809781e-04] [-1.05535858e-03 -2.42406431e-04 1.47606586e-04] [ 1.23996829e-05 6.36249629e-05 3.58387767e-04] [ 1.97759748e-05 -8.09534849e-05 -3.38064901e-04] [ 7.25836367e-06 -6.34878236e-05 -3.33836712e-04] [ 1.35023115e-05 5.85892432e-05 3.37250657e-04] [-4.70945850e-05 -2.30332652e-05 -9.61987923e-05] [-5.79527019e-06 -2.31593595e-04 1.64638844e-04] [ 2.37608049e-05 -3.10777701e-05 1.65850936e-04] [-9.13347634e-05 -1.67624385e-04 -1.91172200e-04]] Final stress: [-4.33691981e-05 2.29610155e-04 4.13160182e-04 -3.69127713e-04 2.01311047e-07 6.96201986e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[ 3.85022973e-04 5.52009516e-04 -1.07340303e-05] [ 5.43035679e-05 -6.83745247e-04 1.87453831e-05] [ 3.66626550e-04 8.17635476e-04 7.74074612e-05] [-1.90272468e-05 -4.83509685e-04 -9.02596458e-05] [-2.57656010e-04 9.26776131e-04 -5.92484314e-05] [ 3.36011219e-04 6.31730735e-04 1.06223763e-04] [-1.58987868e-05 1.04611904e-03 3.56737921e-04] [ 1.29981828e-03 -2.18610171e-04 -1.14555916e-03] [-9.28378898e-04 -6.93675270e-04 -9.47055548e-04] [-1.18786189e-03 1.07865935e-03 3.19058137e-04] [ 5.27787891e-04 -4.96082513e-04 6.60483614e-05] [-5.36544648e-04 -4.50328351e-04 3.71522853e-04] [-1.98973858e-04 -3.98145049e-04 3.82988222e-04] [ 8.36864576e-05 -7.04652556e-04 -2.96982092e-04] [-2.70091272e-04 -7.11487683e-04 3.32760996e-04] [ 4.86525658e-05 -2.31000314e-04 4.43995739e-04] [-7.83622215e-06 1.73254606e-04 -2.36482798e-04] [ 1.14502877e-04 -3.05134741e-06 3.17950719e-04] [ 2.13441454e-06 6.42741238e-05 2.37850689e-04] [ 1.01573888e-04 1.27625387e-04 -2.48739658e-04] [ 3.41311556e-05 -6.74874261e-06 5.18876349e-05] [ 1.44637224e-05 -1.98358012e-04 -5.66017844e-05] [ 1.38736055e-05 1.78062800e-05 -1.69767366e-04] [ 3.96796636e-05 -1.56495703e-04 1.78252633e-04]] Final stress: [-4.33106762e-05 2.30414554e-04 4.13026796e-04 3.69292646e-04 3.00209183e-07 1.49193749e-06] Minimization converged after 49 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.58334312e-05 3.59380436e-05 2.62374939e-06] [ 1.58653450e-05 -3.59178280e-05 -5.09888992e-07] [-1.58908063e-05 -3.59188512e-05 -2.59604017e-06] [-1.58434046e-05 3.59205870e-05 -2.17756575e-07] [ 9.94241946e-09 6.10671245e-07 1.77821434e-07] [-5.42608146e-07 -3.19665818e-07 1.90734398e-07] [ 5.14823957e-07 -2.92159669e-07 1.67358327e-07] [-3.59369218e-08 -2.03559763e-07 4.54639509e-08] [ 1.78899196e-07 1.38281975e-07 5.86910465e-08] [-9.35726028e-08 4.75436138e-08 -9.35813263e-09] [-8.35289926e-09 -1.04952642e-04 5.03940386e-07] [-1.17250497e-05 -6.69733574e-05 -2.69601126e-05] [ 1.17484001e-05 -6.69964945e-05 2.79801689e-05] [-4.65234162e-09 1.05282923e-04 -4.71208061e-07] [ 1.14312380e-05 6.68191155e-05 2.70085250e-05] [-1.14271764e-05 6.68114559e-05 -2.79733767e-05] [ 5.40118341e-05 9.41573256e-05 -1.18562286e-04] [ 5.40063311e-05 -9.41551755e-05 -1.18620313e-04] [-5.40080387e-05 -9.41578293e-05 1.18556063e-04] [-5.40159667e-05 9.41585951e-05 1.18624975e-04] [ 4.01346570e-05 -1.13615975e-04 -2.39964116e-05] [ 4.01371778e-05 1.13617704e-04 -2.40470411e-05] [-4.01384216e-05 1.13617662e-04 2.39916649e-05] [-4.01380930e-05 -1.13616371e-04 2.40346372e-05]] Final stress: [ 3.70156133e-04 3.65855726e-04 6.92624290e-04 4.55244421e-11 -2.54359103e-04 -7.83425846e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-1.58613227e-05 3.35229022e-05 1.61086170e-06] [-1.58563237e-05 -3.35209497e-05 -3.30041066e-07] [ 1.58401288e-05 -3.35409229e-05 -2.82091802e-06] [ 1.58316845e-05 3.35294316e-05 -3.87772187e-07] [-3.09530940e-08 -1.69822375e-06 -2.13994584e-07] [ 1.48660007e-06 8.81041265e-07 -2.26425944e-07] [-1.42300064e-06 8.08605350e-07 -1.79668159e-07] [-9.51707743e-09 -1.20566860e-06 3.89177217e-07] [ 1.09009748e-06 6.22721954e-07 4.14341931e-07] [-1.06512675e-06 5.97341391e-07 3.96897740e-07] [-3.36922062e-09 -1.01760700e-04 5.78528920e-07] [-1.13795651e-05 -6.83361462e-05 2.78267078e-05] [ 1.13815874e-05 -6.83413134e-05 -2.66457248e-05] [-7.97732280e-09 1.04299865e-04 -1.96297236e-07] [ 9.21637038e-06 6.70836068e-05 -2.74291015e-05] [-9.19608315e-06 6.70627647e-05 2.70352576e-05] [-5.41132916e-05 9.35556234e-05 -1.18200391e-04] [-5.41140244e-05 -9.35558141e-05 -1.18216775e-04] [ 5.41089964e-05 -9.35538467e-05 1.18204852e-04] [ 5.41101551e-05 9.35526621e-05 1.18289250e-04] [-4.01110749e-05 -1.13591329e-04 -2.39946125e-05] [-4.01106948e-05 1.13589989e-04 -2.39733078e-05] [ 4.01071117e-05 1.13589525e-04 2.39868013e-05] [ 4.01095926e-05 -1.13591167e-04 2.40823543e-05]] Final stress: [3.70184970e-04 3.65844685e-04 6.92605411e-04 3.26160385e-11 2.54347309e-04 6.89284631e-12] Minimization converged after 45 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 6.24797337e-05 -5.34517936e-05 -1.55798258e-04] [-6.24794727e-05 5.34518627e-05 -1.55501756e-04] [-6.24795797e-05 5.34518667e-05 1.55597149e-04] [ 6.24798434e-05 -5.34518018e-05 1.55881681e-04] [ 8.80508565e-10 -2.95153589e-07 -9.05508251e-08] [ 2.54833416e-07 1.46679159e-07 -9.03539333e-08] [-2.56073487e-07 1.48412096e-07 -9.06009861e-08] [ 3.80808099e-10 -1.37095397e-07 4.44835888e-08] [ 1.18313516e-07 6.81436567e-08 4.43673059e-08] [-1.18835249e-07 6.88844775e-08 4.44415324e-08] [-1.26327010e-04 -1.30065361e-05 -8.01670866e-09] [ 1.43371862e-05 4.82975346e-05 -8.01649945e-09] [-6.66319579e-05 -8.35445490e-05 -8.02265370e-09] [ 1.26327253e-04 1.28746351e-05 -5.87255163e-09] [-1.42232399e-05 -4.82318557e-05 -5.87047754e-09] [ 6.65176424e-05 8.36107267e-05 -5.88836719e-09] [-1.14691398e-04 -4.51886834e-06 1.23674320e-04] [ 1.14691395e-04 4.51888128e-06 1.23672364e-04] [ 1.14691391e-04 4.51888099e-06 -1.23672810e-04] [-1.14691391e-04 -4.51886845e-06 -1.23675041e-04] [ 1.53397559e-04 -5.05222920e-06 -2.31880002e-04] [-1.53397506e-04 5.05223659e-06 -2.31875200e-04] [-1.53397533e-04 5.05223687e-06 2.31876428e-04] [ 1.53397586e-04 -5.05222962e-06 2.31881027e-04]] Final stress: [ 3.69794874e-04 3.69453413e-04 6.74272413e-04 1.24213005e-14 -3.60170469e-14 3.00485384e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-4.15313933e-05 -3.86672919e-05 -1.44470530e-04] [ 4.15312423e-05 3.86672482e-05 -1.44293946e-04] [ 4.15314314e-05 3.86672276e-05 1.44536841e-04] [-4.15316203e-05 -3.86672527e-05 1.44747865e-04] [-8.36665234e-10 -3.02020646e-07 -9.86860260e-08] [ 2.62151028e-07 1.51831858e-07 -9.87869826e-08] [-2.60986369e-07 1.50194227e-07 -9.85973851e-08] [ 3.09282846e-10 1.05885310e-07 -2.81397322e-08] [-9.17654791e-08 -5.32066329e-08 -2.80938683e-08] [ 9.13633737e-08 -5.26175505e-08 -2.80420268e-08] [ 1.61501304e-04 -1.20786974e-05 -1.99990621e-08] [ 8.96298383e-05 -9.20784341e-05 -1.99853661e-08] [-2.14380070e-05 7.11611000e-05 -2.00079848e-08] [-1.61501843e-04 1.18772614e-05 -2.61749600e-08] [-8.94549976e-05 9.21796787e-05 -2.61517679e-08] [ 2.12638745e-05 -7.10608879e-05 -2.61587503e-08] [ 1.01248526e-04 -3.63782094e-06 1.08638292e-04] [-1.01248551e-04 3.63781426e-06 1.08634777e-04] [-1.01248516e-04 3.63782076e-06 -1.08637639e-04] [ 1.01248494e-04 -3.63782585e-06 -1.08640363e-04] [-1.49183279e-04 -5.49432569e-06 -2.46647947e-04] [ 1.49183270e-04 5.49432213e-06 -2.46646848e-04] [ 1.49183332e-04 5.49432098e-06 2.46648318e-04] [-1.49183341e-04 -5.49432389e-06 2.46650004e-04]] Final stress: [ 3.69232393e-04 3.68885083e-04 6.75385589e-04 -5.23740529e-14 2.68104537e-14 -2.99937166e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.43014060e-04 -1.18384886e-04 2.63832104e-05] [-1.43013863e-04 1.18384937e-04 2.65465840e-05] [-1.43013911e-04 1.18384962e-04 -2.65415780e-05] [ 1.43014000e-04 -1.18384982e-04 -2.63510083e-05] [ 1.57337296e-10 -6.48850416e-08 -2.89384986e-08] [ 5.61078615e-08 3.22949835e-08 -2.89653543e-08] [-5.63513051e-08 3.26186992e-08 -2.89860699e-08] [ 9.30117875e-11 -4.84693550e-08 2.16991602e-08] [ 4.18030123e-08 2.41098594e-08 2.16230406e-08] [-4.19552190e-08 2.43058139e-08 2.16429684e-08] [-8.83445105e-05 -1.45785449e-04 9.23697023e-11] [-2.22333535e-04 1.22154320e-05 1.09267414e-10] [-5.19803784e-05 3.03005051e-05 7.22178334e-11] [ 8.83452668e-05 1.45521629e-04 -4.73834294e-09] [ 2.22561476e-04 -1.20842455e-05 -4.85662126e-09] [ 5.17514745e-05 -3.01678857e-05 -4.75745205e-09] [-9.27681156e-05 -2.21194882e-05 -1.09125509e-04] [ 9.27681638e-05 2.21194934e-05 -1.09129910e-04] [ 9.27681550e-05 2.21194829e-05 1.09129230e-04] [-9.27681217e-05 -2.21194839e-05 1.09125456e-04] [ 1.13982786e-04 1.03428088e-05 1.90487162e-04] [-1.13982791e-04 -1.03428044e-05 1.90486978e-04] [-1.13982796e-04 -1.03428031e-05 -1.90487440e-04] [ 1.13982785e-04 1.03428048e-05 -1.90487170e-04]] Final stress: [-3.43217126e-04 -3.45037631e-04 -6.58773036e-04 2.00931614e-13 3.72322566e-13 2.96901373e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.75160117e-05 -6.71805428e-05 -4.03900048e-06] [ 6.75158675e-05 6.71805390e-05 -3.84897386e-06] [ 6.75159892e-05 6.71804809e-05 3.97819974e-06] [-6.75160986e-05 -6.71804902e-05 4.14710498e-06] [-3.68680329e-10 -1.39692979e-07 -5.22307413e-08] [ 1.21131600e-07 7.01875735e-08 -5.22175141e-08] [-1.20608598e-07 6.94598875e-08 -5.21397469e-08] [ 2.34303855e-10 5.25305544e-08 -6.65402555e-09] [-4.55210787e-08 -2.64621155e-08 -6.62794331e-09] [ 4.52032937e-08 -2.60070762e-08 -6.53594828e-09] [ 1.01553525e-04 -2.80963704e-05 -1.20499806e-08] [ 9.69154913e-05 -3.33192566e-05 -1.20268920e-08] [ 1.04510897e-04 -1.06389390e-05 -1.20307669e-08] [-1.01554377e-04 2.77961802e-05 -8.26179322e-09] [-9.66550028e-05 3.34701517e-05 -8.23260346e-09] [-1.04770308e-04 1.07882316e-05 -8.25880251e-09] [ 8.92520358e-05 -4.38716199e-06 -9.93442392e-05] [-8.92520779e-05 4.38716173e-06 -9.93486368e-05] [-8.92520694e-05 4.38717266e-06 9.93478106e-05] [ 8.92520264e-05 -4.38717337e-06 9.93429266e-05] [-1.23982274e-04 -2.16669175e-06 2.07064170e-04] [ 1.23982295e-04 2.16669221e-06 2.07063838e-04] [ 1.23982324e-04 2.16668965e-06 -2.07062624e-04] [-1.23982302e-04 -2.16668939e-06 -2.07063309e-04]] Final stress: [-3.43215764e-04 -3.43589707e-04 -6.59303163e-04 1.45605599e-14 -5.34545302e-14 -2.99628011e-04] Minimization converged after 52 steps. Minimization converged after 50 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[ 2.65891658e-04 -4.41448055e-03 3.50229598e-03] [-1.69695603e-03 4.57270308e-03 -8.04943307e-04] [-2.33403653e-04 4.49539308e-03 -8.52772925e-04] [ 1.60084897e-03 -4.55970917e-03 2.32179290e-03] [-1.25419304e-04 3.51044489e-03 5.36623867e-04] [-2.90252467e-03 -1.60634074e-03 4.09380848e-04] [ 3.14807822e-03 -1.89618320e-03 6.16673341e-04] [-1.19033969e-05 2.54355284e-03 -8.92417560e-04] [-2.42573159e-03 -1.31379523e-03 -1.00349354e-03] [ 2.42079878e-03 -1.32272859e-03 -1.00211730e-03] [-8.92223144e-03 -6.43693486e-03 1.35940110e-03] [ 5.33805253e-03 -5.33982058e-03 1.39089018e-03] [-5.11333202e-04 4.83843171e-03 9.69728228e-04] [ 8.89243109e-03 -1.09614764e-03 -2.17609795e-03] [ 1.13804258e-03 9.09924038e-03 -2.24305801e-03] [-5.96765798e-03 -1.10051560e-03 -1.77729446e-03] [ 7.86451236e-04 2.17345659e-03 7.76890414e-04] [-7.80214800e-04 -2.21288582e-03 8.81438627e-04] [-8.18972625e-04 -2.16295082e-03 -7.24078443e-04] [ 7.62112442e-04 2.23571037e-03 -1.09396650e-03] [-3.08732305e-04 5.06586794e-04 4.64166894e-04] [ 3.51884121e-04 -3.60318827e-04 5.95299250e-04] [ 3.20821013e-04 -5.12698528e-04 -4.67156015e-04] [-3.20331665e-04 3.59990400e-04 -7.87185608e-04]] Final stress: [-2.92144868e-04 -1.52956950e-04 -2.39426107e-04 -4.32586571e-04 -3.28020589e-04 4.78431222e-05] Minimization converged after 198 steps. Minimization converged after 188 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-6.01575853e-05 -8.49942776e-05 2.59220337e-04] [-1.31399472e-04 5.24369026e-05 -5.43768036e-05] [ 3.24167743e-04 6.97419097e-05 2.59438502e-04] [-3.20101233e-05 1.17142592e-04 -5.10790316e-05] [-4.65691076e-05 -3.10192055e-04 5.57913173e-04] [ 4.86621339e-04 -8.23615895e-05 2.57803803e-04] [-2.09388841e-04 6.61724271e-04 -2.18332494e-04] [ 1.01971090e-04 6.04056464e-04 4.33643218e-04] [ 3.13504162e-05 2.95280250e-04 1.27843494e-04] [ 1.03322336e-04 -1.07625455e-04 -6.75849743e-06] [-3.56014192e-06 -3.90985346e-04 1.39613974e-04] [-9.20604627e-05 -3.24996624e-04 -1.59252515e-04] [-2.40962251e-04 -1.04581674e-04 2.38751091e-05] [-4.44860731e-05 -2.38345299e-04 1.96832366e-04] [-2.54654212e-04 5.18187813e-05 -1.39627905e-04] [ 1.58716200e-04 -2.32910522e-05 -4.49305639e-05] [-2.05067328e-05 3.59221491e-04 -1.85511009e-04] [ 1.24641646e-04 -1.51823428e-04 1.05777374e-05] [ 2.11360815e-04 1.28653869e-04 -2.23916455e-04] [ 2.66206391e-04 -2.73535475e-04 1.09080443e-05] [-6.55611002e-05 -9.86134204e-05 -2.24745466e-04] [-1.14884883e-04 2.61216254e-05 -2.95320363e-04] [-2.59524354e-04 -1.25126053e-04 -3.23263526e-04] [-2.32632637e-04 -4.97264057e-05 -3.50555127e-04]] Final stress: [ 0.0327768 0.03332818 0.13520009 -0.00108076 -0.00071579 0.00047143] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 9.41878648e-04 -2.18367095e-03 1.34091932e-03] [ 3.92947401e-04 1.68457530e-03 1.34125256e-03] [-9.41878312e-04 2.18367220e-03 -1.34132744e-03] [-3.92949214e-04 -1.68458110e-03 -1.34377890e-03] [-3.49358146e-09 1.34870635e-06 4.81422072e-07] [-1.16005134e-06 -6.69399529e-07 4.74044147e-07] [ 1.16489939e-06 -6.76234319e-07 4.74881887e-07] [ 3.31447565e-09 -1.01269350e-06 2.45467245e-07] [ 8.76510172e-07 5.03419543e-07 2.47773048e-07] [-8.80905937e-07 5.09771845e-07 2.48733573e-07] [-1.38016163e-03 -3.03377834e-03 -7.12861205e-04] [ 1.32847709e-03 -8.01212681e-04 8.91054175e-04] [-1.11510476e-05 1.49306321e-03 -3.41118115e-04] [ 1.38015572e-03 3.03579136e-03 7.13116590e-04] [-1.33021337e-03 8.00213140e-04 -8.90801836e-04] [ 1.28947548e-05 -1.49407384e-03 3.41369907e-04] [ 1.22016283e-04 1.14488501e-04 5.24178128e-05] [-8.19677777e-05 1.92500075e-04 5.49217027e-05] [-1.22016425e-04 -1.14490636e-04 -5.24355154e-05] [ 8.19672347e-05 -1.92498927e-04 -5.48773823e-05] [ 1.65636361e-04 3.94302336e-04 3.25419024e-05] [-1.82141850e-04 1.84528767e-04 2.37925493e-05] [-1.65635840e-04 -3.94301267e-04 -3.25603482e-05] [ 1.82141702e-04 -1.84530715e-04 -2.37981007e-05]] Final stress: [ 6.35365950e-06 2.17126152e-05 2.44781490e-05 -2.23259313e-04 1.14601909e-05 2.99196484e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-9.46886248e-04 -2.20248486e-03 1.34438867e-03] [-3.97347433e-04 1.69952793e-03 1.35052715e-03] [ 9.46885318e-04 2.20248430e-03 -1.34554806e-03] [ 3.97348961e-04 -1.69953234e-03 -1.35257583e-03] [ 3.34313182e-09 1.23681333e-06 4.21309263e-07] [-1.06860565e-06 -6.20372651e-07 4.15669611e-07] [ 1.06397264e-06 -6.13824240e-07 4.14787014e-07] [-4.10838193e-09 -1.34791889e-06 3.72117128e-07] [ 1.17293927e-06 6.78456010e-07 3.77027148e-07] [-1.16746164e-06 6.70563933e-07 3.75942652e-07] [ 1.38375065e-03 -3.05705178e-03 -7.18256822e-04] [ 2.04657814e-05 1.50584231e-03 -3.44368552e-04] [-1.34330208e-03 -8.08733971e-04 8.95855841e-04] [-1.38374712e-03 3.05821471e-03 7.18534179e-04] [-2.14713593e-05 -1.50642547e-03 3.44644057e-04] [ 1.34430332e-03 8.08157402e-04 -8.95579936e-04] [-1.22035492e-04 1.15161906e-04 5.29612558e-05] [ 8.19328274e-05 1.93761366e-04 5.55879635e-05] [ 1.22035502e-04 -1.15163331e-04 -5.29646704e-05] [-8.19324070e-05 -1.93760962e-04 -5.55555917e-05] [-1.66252205e-04 3.96951718e-04 3.26650014e-05] [ 1.82956662e-04 1.87402557e-04 2.39169864e-05] [ 1.66251674e-04 -3.96951285e-04 -3.26858241e-05] [-1.82956432e-04 -1.87403923e-04 -2.39226726e-05]] Final stress: [ 6.30706222e-06 2.17526583e-05 2.45269075e-05 -2.23011952e-04 -1.14756594e-05 -2.99224120e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-4.15974922e-04 -1.67015352e-03 1.30807536e-03] [-9.51951261e-04 2.15762778e-03 1.33344543e-03] [ 4.15977264e-04 1.67015910e-03 -1.31113837e-03] [ 9.51952762e-04 -2.15763057e-03 -1.33176394e-03] [ 3.37256946e-09 -1.16928188e-06 -3.70742357e-07] [ 1.01316902e-06 5.81990441e-07 -3.74602285e-07] [-1.01781171e-06 5.88576040e-07 -3.75539533e-07] [ 6.54179269e-09 -2.28298084e-06 7.20730644e-07] [ 1.96485491e-06 1.13312556e-06 7.09767560e-07] [-1.97376282e-06 1.14582590e-06 7.11502124e-07] [-1.37851959e-03 -2.99206819e-03 6.91383915e-04] [ 1.26525528e-03 -8.06156870e-04 -9.04414863e-04] [ 3.79307993e-05 1.47335273e-03 3.62829740e-04] [ 1.37852183e-03 2.99091505e-03 -6.91262285e-04] [-1.26425964e-03 8.06730743e-04 9.04533695e-04] [-3.89296935e-05 -1.47277470e-03 -3.62711382e-04] [ 8.18588358e-05 -1.84621399e-04 5.42215353e-05] [-1.25018885e-04 -1.06561326e-04 5.22739389e-05] [-8.18586915e-05 1.84620400e-04 -5.41974250e-05] [ 1.25018816e-04 1.06562793e-04 -5.22853948e-05] [ 1.80610001e-04 -1.84137916e-04 2.37781447e-05] [-1.65454188e-04 -3.97777483e-04 3.29567918e-05] [-1.80609488e-04 1.84139406e-04 -2.38208107e-05] [ 1.65454403e-04 3.97776714e-04 -3.29251937e-05]] Final stress: [ 6.51658718e-06 2.16924983e-05 2.41960515e-05 2.23960159e-04 -1.16230055e-05 2.99124676e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 3.87500048e-04 -1.66661532e-03 1.33236357e-03] [ 9.34199786e-04 2.16379090e-03 1.32044648e-03] [-3.87502824e-04 1.66662242e-03 -1.33600235e-03] [-9.34201458e-04 -2.16379479e-03 -1.31860735e-03] [-2.67189774e-09 -9.83576010e-07 -3.43345453e-07] [ 8.56509719e-07 4.95106741e-07 -3.47821508e-07] [-8.52746577e-07 4.89852342e-07 -3.47079069e-07] [-6.82503712e-09 -2.43870510e-06 7.97739197e-07] [ 2.10815007e-06 1.22374633e-06 7.87501470e-07] [-2.09878686e-06 1.21044590e-06 7.85704549e-07] [ 1.36721637e-03 -3.01773777e-03 7.11683103e-04] [ 2.34449702e-05 1.49114487e-03 3.38979401e-04] [-1.32784239e-03 -7.93137600e-04 -8.81353810e-04] [-1.36722129e-03 3.01570950e-03 -7.11524979e-04] [-2.16866890e-05 -1.49012687e-03 -3.38826064e-04] [ 1.32609078e-03 7.94146367e-04 8.81507770e-04] [-8.06390758e-05 -1.92223432e-04 5.45748068e-05] [ 1.20273690e-04 -1.14901558e-04 5.17710235e-05] [ 8.06387340e-05 1.92221816e-04 -5.45353830e-05] [-1.20273747e-04 1.14903794e-04 -5.17941407e-05] [-1.82504421e-04 -1.80594923e-04 2.35888595e-05] [ 1.66021723e-04 -3.89465112e-04 3.20406806e-05] [ 1.82503962e-04 1.80597062e-04 -2.36283671e-05] [-1.66021800e-04 3.89463778e-04 -3.20159412e-05]] Final stress: [ 6.37519155e-06 2.16537017e-05 2.45275027e-05 2.23480585e-04 1.14256894e-05 -2.99244576e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-5.05874147e-05 -1.86805539e-04 -2.25516671e-05] [-5.05751705e-05 1.86803939e-04 -2.03665434e-05] [ 5.05827240e-05 1.86806293e-04 2.10274333e-05] [ 5.05792723e-05 -1.86803572e-04 2.06839839e-05] [ 1.76931627e-09 3.77714323e-07 3.66873816e-08] [-3.29066760e-07 -1.90981057e-07 3.61305502e-08] [ 3.25412333e-07 -1.86812004e-07 3.56515505e-08] [-3.51334285e-09 -1.15100894e-06 3.39996815e-07] [ 9.99570418e-07 5.80207105e-07 3.44474031e-07] [-9.92884577e-07 5.72324277e-07 3.32656858e-07] [ 2.44645482e-09 5.13881300e-04 -2.03772479e-07] [-1.07571746e-04 6.95186982e-04 -1.40558059e-05] [ 1.07561364e-04 6.95195723e-04 1.36443467e-05] [-1.74295794e-09 -5.15024508e-04 2.47007743e-07] [ 1.08556251e-04 -6.94616984e-04 1.40996020e-05] [-1.08546847e-04 -6.94624333e-04 -1.36024719e-05] [ 2.00332446e-04 -2.27058308e-04 6.97808626e-04] [ 2.00328979e-04 2.27058335e-04 6.97820203e-04] [-2.00330255e-04 2.27057834e-04 -6.97793767e-04] [-2.00331444e-04 -2.27058226e-04 -6.97840341e-04] [-3.21626008e-04 -3.49514742e-04 4.78998832e-04] [-3.21625398e-04 3.49514849e-04 4.79023476e-04] [ 3.21624220e-04 3.49513300e-04 -4.79023589e-04] [ 3.21627034e-04 -3.49513787e-04 -4.79041149e-04]] Final stress: [ 8.17112111e-05 -2.53408977e-05 6.25305240e-06 7.37069803e-12 -5.74123283e-04 7.67616095e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 4.81100707e-05 -1.87160764e-04 -2.31638471e-05] [ 4.80917966e-05 1.87158293e-04 -2.00658480e-05] [-4.81024181e-05 1.87161987e-04 2.09319607e-05] [-4.80964583e-05 -1.87158364e-04 2.01097627e-05] [ 6.48240771e-11 6.57128896e-07 1.13734133e-07] [-5.69711369e-07 -3.28703578e-07 1.14032004e-07] [ 5.70486556e-07 -3.29066138e-07 1.11494023e-07] [ 3.17300176e-09 -1.77469266e-06 5.23512732e-07] [ 1.53191063e-06 8.84293935e-07 5.11753178e-07] [-1.53936970e-06 8.92246430e-07 5.29560401e-07] [-3.95523786e-09 5.13223224e-04 -2.92388125e-07] [-1.06902666e-04 6.96257771e-04 1.22345029e-05] [ 1.06918343e-04 6.96244213e-04 -1.28256550e-05] [ 2.35093767e-09 -5.14433233e-04 4.06912740e-07] [ 1.07948119e-04 -6.95652128e-04 -1.21244671e-05] [-1.07962813e-04 -6.95640992e-04 1.29416804e-05] [-2.00242911e-04 -2.27961987e-04 6.96519344e-04] [-2.00238822e-04 2.27962247e-04 6.96545925e-04] [ 2.00240969e-04 2.27961416e-04 -6.96500819e-04] [ 2.00241527e-04 -2.27961857e-04 -6.96564406e-04] [ 3.21488379e-04 -3.49103044e-04 4.79384768e-04] [ 3.21488178e-04 3.49103001e-04 4.79424912e-04] [-3.21486328e-04 3.49100635e-04 -4.79420572e-04] [-3.21489915e-04 -3.49101626e-04 -4.79445852e-04]] Final stress: [ 8.17157675e-05 -2.53385440e-05 6.33190970e-06 1.31030087e-11 5.74104198e-04 -1.18732334e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-8.72315947e-05 4.50617845e-04 -4.32302187e-04] [-1.49978743e-05 -1.01982415e-03 1.67302281e-05] [ 8.72427907e-05 -4.50617805e-04 4.36975105e-04] [ 1.49653860e-05 1.01982512e-03 -2.69028969e-05] [-2.03125960e-08 5.39404298e-06 1.90996363e-06] [-4.65473936e-06 -2.67555546e-06 1.89334729e-06] [ 4.69128956e-06 -2.72010616e-06 1.92959564e-06] [ 6.26839305e-11 9.60949293e-07 -5.52115986e-07] [-8.33828055e-07 -4.81458127e-07 -5.56793639e-07] [ 8.31057708e-07 -4.79779735e-07 -5.47663495e-07] [ 1.13898666e-03 2.53107783e-04 9.44478010e-04] [-1.18074410e-03 1.35575608e-03 2.74252136e-04] [-4.15067951e-04 -8.11226583e-04 1.87460527e-04] [-1.13901238e-03 -2.44015824e-04 -9.44004451e-04] [ 1.17288907e-03 -1.36027567e-03 -2.73788785e-04] [ 4.22962290e-04 8.06654098e-04 -1.86977540e-04] [ 1.41763248e-04 -4.52567192e-05 6.38895493e-05] [-5.55039889e-05 -7.39867909e-05 -7.27375474e-05] [-1.41773379e-04 4.52569721e-05 -6.40050396e-05] [ 5.55096307e-05 7.39869419e-05 7.29024624e-05] [-3.83736280e-05 -7.56364110e-05 -5.28334655e-05] [-3.77457083e-04 8.21617656e-06 7.20294315e-05] [ 3.83805713e-05 7.56364703e-05 5.28422134e-05] [ 3.77448813e-04 -8.21562536e-06 -7.20840847e-05]] Final stress: [ 2.12211329e-05 6.94279549e-06 1.99846810e-05 1.64793503e-06 -2.58921169e-04 2.97003893e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-1.83627806e-05 1.07150987e-03 1.64141518e-05] [-9.13140899e-05 -4.84905983e-04 -4.66849856e-04] [ 1.83634787e-05 -1.07151038e-03 -1.86073636e-05] [ 9.13008686e-05 4.84906257e-04 4.58593670e-04] [ 6.25090483e-09 4.32484518e-06 1.54212776e-06] [-3.74741475e-06 -2.16722553e-06 1.53050430e-06] [ 3.74472336e-06 -2.15845632e-06 1.55405044e-06] [-1.66783325e-08 -4.11105706e-06 1.04089870e-06] [ 3.57336702e-06 2.07261015e-06 1.05188580e-06] [-3.54899424e-06 2.03926714e-06 1.03133705e-06] [-1.13505527e-03 2.64321413e-04 -9.52495458e-04] [ 4.37784038e-04 -8.06605928e-04 -1.78677113e-04] [ 1.20187539e-03 1.38789057e-03 -2.78192781e-04] [ 1.13507370e-03 -2.57656826e-04 9.53392949e-04] [-4.43562589e-04 8.03259340e-04 1.79567611e-04] [-1.19610941e-03 -1.39120861e-03 2.79097079e-04] [-7.10469972e-05 7.32840348e-05 -7.42082933e-05] [ 1.54762864e-04 4.45715015e-05 6.45559236e-05] [ 7.10403723e-05 -7.32840015e-05 7.41523123e-05] [-1.54756942e-04 -4.45711971e-05 -6.44060394e-05] [-3.89509612e-04 -8.35200797e-06 7.31129285e-05] [-5.78435435e-05 7.31846488e-05 -5.43846182e-05] [ 3.89511025e-04 8.35158762e-06 -7.31891900e-05] [ 5.78382357e-05 -7.31842685e-05 5.43732840e-05]] Final stress: [ 2.13575760e-05 6.73380282e-06 2.00251889e-05 -1.75324180e-06 -2.58537310e-04 -2.96314383e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 1.39408681e-04 2.79009802e-04 4.42291335e-04] [-1.11099018e-04 -5.79704936e-05 -5.75322654e-05] [-1.39360133e-04 -2.79011719e-04 -4.59504979e-04] [ 1.11086168e-04 5.79704860e-05 6.51822835e-05] [ 5.47877751e-09 -3.64940877e-06 -1.34448732e-06] [ 3.15965926e-06 1.82112425e-06 -1.35444906e-06] [-3.16189787e-06 1.82873538e-06 -1.33417720e-06] [ 4.37945437e-08 -1.13794099e-05 3.70893062e-06] [ 9.82087570e-06 5.64454382e-06 3.67564010e-06] [-9.89409206e-06 5.73736685e-06 3.74625978e-06] [ 5.30398546e-04 -8.73529948e-05 -3.43484219e-04] [-2.10250989e-04 8.99465318e-04 -1.46533470e-04] [-7.02957208e-04 -5.27096710e-04 -3.26051566e-05] [-5.30373700e-04 7.75523910e-05 3.44304427e-04] [ 2.18717845e-04 -8.94591995e-04 1.47341877e-04] [ 6.94446778e-04 5.32024587e-04 3.34377259e-05] [ 1.29053433e-06 2.77830110e-05 -4.20748126e-05] [-1.56086860e-04 1.22663756e-05 2.28556452e-05] [-1.29724416e-06 -2.77831006e-05 4.22686850e-05] [ 1.56098571e-04 -1.22666384e-05 -2.29638702e-05] [ 3.35466062e-04 -6.08093232e-05 4.02221560e-05] [ 5.48222204e-05 8.66760819e-05 -3.02784130e-05] [-3.35455034e-04 6.08082840e-05 -4.03992290e-05] [-5.48290389e-05 -8.66763134e-05 3.03745619e-05]] Final stress: [ 1.83812792e-05 8.64520520e-06 2.28161519e-05 -6.05021238e-06 2.60595410e-04 2.96931296e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.81386826e-05 2.30154448e-04 -1.67853419e-04] [ 7.08794334e-05 -4.53930753e-04 6.20045617e-05] [-1.81304177e-05 -2.30154560e-04 1.61181788e-04] [-7.08881005e-05 4.53930554e-04 -5.95280102e-05] [-3.69821441e-09 -1.01468985e-06 -3.99213313e-07] [ 8.82463287e-07 5.11626987e-07 -4.03097167e-07] [-8.75436698e-07 5.03300738e-07 -3.95744700e-07] [-7.64748968e-09 -4.40594266e-06 1.43722570e-06] [ 3.81864428e-06 2.20915355e-06 1.42657848e-06] [-3.81344028e-06 2.19732195e-06 1.44769147e-06] [-6.43232199e-04 9.43614307e-05 4.27521469e-04] [ 3.27501055e-04 -5.10425626e-04 1.13244894e-04] [ 6.53929825e-04 8.23437909e-04 1.83370078e-04] [ 6.43223768e-04 -9.81036999e-05 -4.27161549e-04] [-3.24256468e-04 5.12303818e-04 -1.12890042e-04] [-6.57167390e-04 -8.21573770e-04 -1.83005308e-04] [-1.00084331e-04 -1.27783876e-05 2.23242049e-05] [-2.01223265e-05 -3.66904505e-05 -5.01439471e-05] [ 1.00080683e-04 1.27782787e-05 -2.22476980e-05] [ 2.01265398e-05 3.66904601e-05 5.01049394e-05] [ 3.08401585e-05 -7.21074868e-05 -2.92840454e-05] [ 3.54403602e-04 3.96161802e-05 3.71663066e-05] [-3.08374958e-05 7.21071639e-05 2.92181717e-05] [-3.54405904e-04 -3.96162801e-05 -3.71358354e-05]] Final stress: [ 1.92527239e-05 8.24029786e-06 2.14115055e-05 5.37121367e-06 2.59822280e-04 -2.98986867e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 7.92230396e-04 -2.16092276e-03 1.96999993e-02] [-7.91430676e-04 2.16065999e-03 2.03786232e-02] [-7.92816673e-04 2.15957382e-03 -2.02843571e-02] [ 7.89464081e-04 -2.15978718e-03 -2.05134721e-02] [-1.67391156e-06 3.54155375e-04 7.99221521e-05] [-3.03635172e-04 -1.74786083e-04 7.88259953e-05] [ 3.08460953e-04 -1.79506190e-04 7.68629034e-05] [ 1.20053704e-07 -3.91552773e-04 1.21536016e-04] [ 3.38020538e-04 1.95124768e-04 1.21950392e-04] [-3.40974286e-04 1.96918022e-04 1.17949677e-04] [ 7.87242459e-02 -1.15447846e-02 -5.98400034e-05] [-3.00651157e-02 3.20263397e-02 -6.03009350e-05] [-3.82605778e-02 -6.56627445e-02 -6.17125454e-05] [-7.87203855e-02 1.10809310e-02 1.02820830e-04] [ 3.04657259e-02 -3.17981048e-02 1.04623577e-04] [ 3.78565902e-02 6.58960440e-02 1.05191025e-04] [ 8.27362375e-04 1.90214982e-02 -1.11738187e-02] [-8.27439707e-04 -1.90207380e-02 -1.11696484e-02] [-8.25712279e-04 -1.90205318e-02 1.11833094e-02] [ 8.27497702e-04 1.90225703e-02 1.11649875e-02] [-1.04095072e-02 -5.59693670e-03 1.32256046e-02] [ 1.04084535e-02 5.59646166e-03 1.32292789e-02] [ 1.04126583e-02 5.59704692e-03 -1.32304829e-02] [-1.04115611e-02 -5.59692840e-03 -1.32378527e-02]] Final stress: [-1.32210388e-03 1.02842856e-03 -3.34354356e-04 -1.58748161e-09 -2.85868182e-08 3.53589186e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.04955361e-03 -3.54208980e-02 -3.06794170e-02] [ 1.03869530e-03 3.54150996e-02 -2.85742147e-02] [ 1.04519789e-03 3.54158443e-02 2.92248406e-02] [-1.03949206e-03 -3.54178568e-02 2.93117900e-02] [ 8.80753444e-07 -4.91893021e-04 -1.65261351e-04] [ 4.26770232e-04 2.46230308e-04 -1.59344555e-04] [-4.24364695e-04 2.45922024e-04 -1.61206177e-04] [-2.27568304e-06 -1.22610805e-03 3.65945573e-04] [ 1.06630359e-03 6.18280718e-04 3.52244206e-04] [-1.05297941e-03 6.07973870e-04 3.52789205e-04] [-1.43929987e-01 1.96129721e-03 -1.55803159e-04] [ 7.65837837e-03 -1.23179351e-01 -1.68968015e-04] [ 8.53199727e-02 7.74954642e-03 -1.62781983e-04] [ 1.43936959e-01 -2.33332743e-03 1.99917974e-04] [-7.33368790e-03 1.23367585e-01 2.15734895e-04] [-8.56479992e-02 -7.56543375e-03 2.09007207e-04] [-4.00704056e-03 3.76355262e-02 -2.83744519e-02] [ 4.01025187e-03 -3.76346723e-02 -2.83489272e-02] [ 4.00720165e-03 -3.76330789e-02 2.83776305e-02] [-4.00894911e-03 3.76381026e-02 2.83523151e-02] [ 1.65135319e-02 -9.02213347e-03 2.73779817e-02] [-1.65177889e-02 9.02176272e-03 2.74048605e-02] [-1.65238167e-02 9.02311029e-03 -2.74007338e-02] [ 1.65137912e-02 -9.02152789e-03 -2.73939476e-02]] Final stress: [-2.02954261e-03 2.12676603e-03 -4.64992094e-04 -4.36013408e-08 6.15433635e-08 -6.24357640e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.92691335e-10 3.05531206e-05 -5.21339567e-05] [-5.76306404e-11 -3.05532947e-05 -5.21242474e-05] [ 2.00274719e-10 -3.05531847e-05 5.21298704e-05] [-6.39541198e-11 3.05532932e-05 5.21320361e-05] [-1.97209950e-11 -5.71301995e-09 -2.17668111e-09] [ 4.46510892e-09 2.79598499e-09 -2.01150846e-09] [-4.42981307e-09 2.73996675e-09 -1.97553843e-09] [-1.80974776e-10 -9.47124090e-09 2.15456419e-09] [ 8.33719771e-09 4.95477326e-09 2.29218322e-09] [-7.97391558e-09 4.53533722e-09 2.06958280e-09] [ 2.94530011e-10 -1.16727042e-05 -1.12174000e-09] [ 2.22751885e-05 -8.35128274e-05 -1.50398308e-09] [-2.22757193e-05 -8.35121847e-05 -1.11436546e-09] [-2.06346162e-10 1.16801655e-05 4.65677902e-11] [-2.22809218e-05 8.35091276e-05 1.44798992e-10] [ 2.22813165e-05 8.35086626e-05 1.13322523e-10] [-2.30119535e-11 -1.36393981e-04 -1.19288500e-04] [-1.81551441e-11 1.36393992e-04 -1.19288285e-04] [-4.93383112e-13 1.36394019e-04 1.19288247e-04] [-6.23789909e-12 -1.36393981e-04 1.19288289e-04] [ 2.20617968e-11 1.08068541e-04 1.32906566e-04] [-2.32444588e-11 -1.08068578e-04 1.32906818e-04] [-2.71596923e-11 -1.08068579e-04 -1.32906940e-04] [ 4.03483358e-11 1.08068552e-04 -1.32906815e-04]] Final stress: [ 8.66646821e-04 4.98430880e-04 4.58699083e-04 -8.35678617e-13 -1.11416833e-12 1.92611557e-13] Minimization converged after 27 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 4.96041735e-10 4.29174456e-04 2.71521373e-04] [ 9.66996103e-11 -4.29175092e-04 2.71565473e-04] [ 3.01208368e-10 -4.29174414e-04 -2.71515349e-04] [ 5.13436238e-11 4.29173361e-04 -2.71559115e-04] [-5.04437149e-10 2.79375645e-09 -6.62189414e-10] [-1.79482021e-09 -5.84763335e-10 -1.77736315e-09] [ 2.31314112e-09 -1.37757894e-09 -1.83602256e-09] [-7.09268487e-10 -2.91818569e-09 -1.17935495e-09] [ 4.40863035e-09 2.37482167e-09 -5.70484882e-10] [-4.06841855e-09 1.39804895e-09 -2.22013068e-11] [ 3.70488473e-10 2.58383391e-04 -8.19470114e-09] [-3.92597563e-04 -7.04676318e-05 -9.15669900e-09] [ 3.92596903e-04 -7.04668387e-05 -9.08361185e-09] [ 7.19055926e-11 -2.58378128e-04 8.07469043e-09] [ 3.92592438e-04 7.04645823e-05 6.60427545e-09] [-3.92592779e-04 7.04648838e-05 6.93991643e-09] [-6.46031284e-11 1.17791964e-04 6.79032856e-04] [-7.73954789e-11 -1.17792004e-04 6.79033997e-04] [-7.57712781e-11 -1.17792006e-04 -6.79033137e-04] [-8.79321338e-11 1.17791986e-04 -6.79034085e-04] [ 1.02898468e-10 3.16707485e-05 -8.09730795e-04] [ 4.12755979e-11 -3.16708663e-05 -8.09730108e-04] [ 6.44535698e-11 -3.16707837e-05 8.09730245e-04] [ 6.57860433e-11 3.16707056e-05 8.09729509e-04]] Final stress: [ 1.12043958e-04 -1.53720916e-04 -4.06899108e-05 -1.79306679e-13 7.18069408e-13 3.53841092e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.66597333e-12 3.32006229e-05 -7.35945776e-04] [ 2.63084183e-12 -3.32006137e-05 -7.35948596e-04] [ 2.69840557e-11 -3.32006470e-05 7.35947786e-04] [ 1.97442063e-12 3.32006271e-05 7.35947606e-04] [ 6.02808748e-12 3.80213916e-10 1.68390579e-10] [-3.11398685e-10 -1.92529541e-10 1.64232516e-10] [ 3.03407022e-10 -1.82470761e-10 1.60745167e-10] [ 1.10747921e-11 1.41782497e-09 -4.69437933e-10] [-1.22604660e-09 -7.14147075e-10 -4.57848204e-10] [ 1.17826210e-09 -6.74650669e-10 -4.06995677e-10] [ 1.72199477e-11 -2.02991821e-04 1.88045214e-10] [ 2.25024564e-04 1.89121822e-04 2.05832560e-10] [-2.25024598e-04 1.89121860e-04 2.17270709e-10] [-2.74362200e-11 2.02992937e-04 -2.67536113e-10] [-2.25025640e-04 -1.89122386e-04 -2.65327799e-10] [ 2.25025679e-04 -1.89122440e-04 -2.75188363e-10] [ 1.74638082e-13 1.19514030e-04 3.61540371e-05] [ 7.74436071e-13 -1.19514030e-04 3.61540250e-05] [ 1.37506673e-12 -1.19514031e-04 -3.61540571e-05] [ 1.31508693e-12 1.19514029e-04 -3.61540083e-05] [ 3.95544708e-12 -9.52436705e-05 -2.64951648e-05] [-3.34028896e-12 9.52436743e-05 -2.64952013e-05] [-5.63002065e-13 9.52436721e-05 2.64951895e-05] [ 1.79811721e-12 -9.52436691e-05 2.64951976e-05]] Final stress: [-1.71322410e-04 1.98390187e-04 1.19978238e-05 7.51004337e-14 -5.51327084e-14 2.50688470e-14] Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 2.18763951e-10 -2.74919927e-05 -2.06219708e-06] [-3.30072054e-10 2.74916575e-05 -2.10188801e-06] [-5.64372773e-11 2.74911728e-05 2.14806843e-06] [-2.02892148e-10 -2.74913144e-05 2.11066297e-06] [-6.01091208e-10 -1.73779598e-08 -4.08373169e-09] [ 1.46809860e-08 9.18662686e-09 -4.02896688e-09] [-1.34112675e-08 7.75436937e-09 -3.14130771e-09] [ 2.10414571e-10 8.35702072e-08 -2.35227431e-08] [-7.07844566e-08 -4.16171076e-08 -2.27147166e-08] [ 7.04278710e-08 -4.11602681e-08 -2.25280920e-08] [-1.78322968e-10 9.31830558e-05 -2.59115214e-09] [-6.16431721e-05 -1.17729413e-04 -2.52917167e-09] [ 6.16435412e-05 -1.17729834e-04 -2.53444764e-09] [ 3.95194599e-10 -9.31697488e-05 -3.13069837e-09] [ 6.16321470e-05 1.17722676e-04 -2.96691457e-09] [-6.16328064e-05 1.17723516e-04 -2.81139784e-09] [-6.66121325e-11 -4.28684035e-05 1.75326527e-05] [ 2.83106871e-11 4.28683740e-05 1.75328792e-05] [-7.85583265e-11 4.28684947e-05 -1.75329848e-05] [ 2.73074341e-11 -4.28685071e-05 -1.75327034e-05] [-2.28745911e-11 4.79639599e-05 -1.14874606e-04] [ 3.10567414e-11 -4.79640074e-05 -1.14875485e-04] [ 3.90414558e-11 -4.79640455e-05 1.14876512e-04] [-3.61256580e-11 4.79640045e-05 1.14875671e-04]] Final stress: [ 6.63404613e-04 4.79485602e-04 6.50060296e-04 -5.55593013e-13 4.22117356e-13 -2.53120895e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-9.45981626e-11 5.58044677e-08 -4.25083047e-04] [-4.35572872e-10 -5.51486270e-08 -4.25055572e-04] [-6.51304698e-10 -5.59757360e-08 4.25087808e-04] [ 1.02631664e-09 5.58961340e-08 4.25052222e-04] [-5.88052630e-10 5.33607969e-09 9.55208690e-10] [-5.14283890e-09 -2.41289667e-09 1.60547667e-09] [ 5.15495985e-09 -3.08940590e-09 7.22506777e-10] [-9.82826736e-10 -2.55694443e-09 -9.25119203e-10] [ 5.30507449e-09 2.81415447e-09 6.09234441e-10] [-3.45883533e-09 5.94592930e-10 -5.11094653e-10] [-1.72889281e-09 -2.43342699e-04 -6.33100723e-09] [ 2.81412405e-04 -4.04489158e-05 -6.05612406e-09] [-2.81409426e-04 -4.04526095e-05 -5.70498093e-09] [ 1.07111237e-09 2.43342143e-04 5.21828193e-09] [-2.81416770e-04 4.04490423e-05 5.30377688e-09] [ 2.81414701e-04 4.04514877e-05 4.67248716e-09] [-7.97705790e-11 -1.00697975e-04 1.62017526e-04] [-1.52084345e-10 1.00697923e-04 1.62018235e-04] [-6.72915057e-11 1.00698031e-04 -1.62017666e-04] [-8.45722936e-11 -1.00698137e-04 -1.62018363e-04] [-2.07797834e-10 1.77001850e-05 -6.34613539e-05] [ 1.89911330e-10 -1.76999539e-05 -6.34607329e-05] [ 1.23535337e-10 -1.76999646e-05 6.34609248e-05] [-1.05111475e-10 1.77001815e-05 6.34604594e-05]] Final stress: [ 2.04509749e-04 4.81339064e-05 -1.90211029e-04 1.84522951e-12 -2.58892708e-12 -1.23428777e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 2.65998612e-11 -3.07658925e-05 -1.53489542e-05] [-4.03881383e-12 3.07659261e-05 -1.53465075e-05] [-1.29734792e-10 3.07658740e-05 1.53509669e-05] [ 1.11309295e-11 -3.07658992e-05 1.53491683e-05] [ 2.90050568e-12 -4.14960177e-10 -3.71492670e-10] [ 4.58514449e-10 2.09768418e-10 -3.72716219e-10] [-4.95233410e-10 2.32612707e-10 -4.19348611e-10] [ 6.46951452e-11 1.31024080e-11 -3.05841574e-10] [ 1.05494724e-10 -3.67749164e-11 -2.37448394e-10] [-1.96101413e-10 9.32378619e-11 -2.13500932e-10] [-2.37184106e-10 -1.99435089e-05 -8.17935119e-10] [-1.88000091e-05 3.78019971e-05 -7.09315470e-10] [ 1.88004325e-05 3.78014817e-05 -8.55219425e-10] [-3.33814643e-11 1.99427505e-05 -1.15794023e-11] [ 1.88005377e-05 -3.78013840e-05 -3.57094357e-11] [-1.88004967e-05 -3.78014452e-05 -2.74927013e-11] [ 7.83356713e-12 2.22853323e-05 1.69329270e-05] [ 7.28450633e-12 -2.22853434e-05 1.69329633e-05] [-4.94937424e-13 -2.22853452e-05 -1.69329877e-05] [ 3.15039661e-12 2.22853288e-05 -1.69330509e-05] [-2.51599852e-11 -4.52332621e-05 -2.34805395e-05] [-2.59896976e-13 4.52332786e-05 -2.34804928e-05] [-4.55391147e-12 4.52332746e-05 2.34804543e-05] [-2.58295607e-11 -4.52332603e-05 2.34804304e-05]] Final stress: [-1.91821521e-04 -5.60940036e-06 2.03719230e-04 1.67410313e-13 4.12023683e-13 -7.21345636e-14] Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 3.39357115e-06 -2.04169836e-04 3.37078072e-04] [-9.13210521e-05 5.92140502e-04 -5.31257408e-04] [ 6.14808859e-05 -3.83372993e-04 5.27021689e-04] [-5.94340176e-05 7.52185900e-04 -2.68012069e-04] [-1.48042229e-04 2.00276121e-04 1.26738696e-03] [ 9.72317557e-05 -8.08833647e-04 2.74392393e-04] [ 1.66340141e-04 -1.03964996e-03 4.44556767e-04] [ 1.12386861e-04 1.12609701e-03 -2.08647706e-04] [-6.85668465e-04 3.40049964e-04 9.73063826e-05] [ 4.25199800e-04 6.76557666e-04 2.82377202e-04] [ 3.23764912e-06 6.50636669e-04 9.44306512e-04] [-2.06623643e-04 -8.24694337e-04 -9.63423785e-04] [ 2.41158891e-04 -8.43141722e-04 -9.03926781e-04] [-1.33043595e-04 3.64603538e-04 7.62872004e-04] [-2.70398154e-04 -2.55721766e-04 -9.19992257e-04] [ 4.99185011e-04 -4.52549597e-04 -9.57004966e-04] [-1.57570597e-05 -1.35605763e-04 -3.64162102e-04] [ 1.30581375e-05 1.53142347e-04 6.40267197e-05] [-1.05961095e-05 -5.80608638e-05 2.64211117e-04] [ 1.59048932e-05 3.47542196e-04 -1.21055558e-04] [ 2.23940461e-06 -2.42120118e-04 3.40203306e-04] [-1.46089510e-05 1.19100042e-04 -5.31654387e-05] [-8.00688589e-06 -2.15009496e-04 -3.01580477e-04] [ 2.68316112e-06 1.40598139e-04 -1.35105744e-05]] Final stress: [ 4.82048356e-05 1.25093433e-04 -3.28574052e-05 -2.42873053e-04 -2.56013383e-07 1.89448182e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-0.02026983 -0.04289329 -0.02454505] [-0.00375417 0.03082205 -0.01166359] [ 0.01103205 -0.0304003 -0.01663739] [ 0.01941045 0.03598218 -0.01197932] [-0.00547761 0.01664591 0.08429647] [-0.00580914 0.00499636 -0.00535866] [ 0.00390251 0.00667519 -0.01682674] [ 0.00128802 0.00992494 -0.01954386] [ 0.00806642 0.06226465 -0.00162261] [-0.00724226 0.0606442 -0.00474765] [ 0.00509752 -0.04986122 0.01546146] [-0.00323304 -0.02079065 -0.00595503] [-0.00690513 -0.0119774 0.01167514] [-0.00846582 -0.048459 0.01159929] [ 0.00618816 -0.00606128 0.02119807] [ 0.0072546 -0.02453223 -0.01910691] [-0.00109433 0.0055956 0.00977138] [-0.00180238 0.01343749 -0.01143929] [ 0.00128057 0.00978873 -0.00942355] [ 0.00087217 0.00410623 0.01070467] [-0.00054492 -0.00962486 -0.00900149] [-0.00208495 -0.00352383 0.01146479] [ 0.0004266 -0.00938589 0.00231135] [ 0.00186452 -0.00337356 -0.01063148]] Final stress: [ 1.46661096e-04 2.59900117e-04 -1.00797671e-05 4.85542550e-04 -1.49205571e-04 1.07728350e-05] Minimization converged after 56 steps. Minimization converged after 57 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-1.31696585e-04 -4.24243754e-04 -1.32612454e-03] [-9.41178291e-04 1.02335235e-03 1.00006763e-03] [-8.21740673e-04 -3.55070714e-04 5.07163101e-04] [-4.57226034e-04 1.53534653e-03 -1.00143966e-03] [ 6.23048888e-04 1.00079166e-03 -3.93380572e-04] [-1.60671812e-03 -1.73176424e-03 3.76387043e-04] [ 1.81091269e-03 -1.22010015e-03 1.59161184e-03] [ 2.53614618e-04 7.29042829e-04 2.31600969e-03] [ 3.49770617e-04 -9.55943722e-05 -3.55934994e-04] [ 2.90924473e-06 3.39270514e-04 -1.64440497e-03] [-5.53600407e-04 1.09741596e-03 1.19642498e-03] [ 2.72934757e-03 1.26158225e-04 1.19429445e-04] [-1.17351721e-03 -1.44589273e-03 6.64028589e-04] [ 4.00124667e-04 1.27302387e-03 -8.18105791e-04] [ 1.06580596e-03 -1.09915517e-03 -8.51624281e-04] [-1.51959085e-03 -2.69815738e-04 -1.17053644e-03] [ 2.21322845e-05 -2.94175645e-05 9.20996616e-05] [-1.08895741e-05 -2.96216921e-05 -1.07293736e-04] [ 1.53980490e-04 -1.09544370e-04 -1.76420997e-04] [ 1.43700678e-04 -1.38180767e-04 1.30013167e-04] [-2.96210286e-04 -5.36896933e-05 -2.42026896e-05] [-2.02128263e-04 9.42064955e-05 6.69697650e-05] [ 1.39120623e-04 -2.01069158e-04 1.01749832e-04] [ 2.00279608e-05 -1.54483146e-05 -2.92486075e-04]] Final stress: [ 5.97669963e-05 1.23900386e-04 -2.71889975e-05 3.06072939e-07 1.33952710e-04 -2.14768408e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 3.59099566e-05 7.51702584e-05 -1.26564638e-05] [ 3.58836108e-05 -7.51519390e-05 -1.29773595e-05] [-3.57947699e-05 -7.51377853e-05 1.06920921e-05] [-3.58292124e-05 7.51513070e-05 9.62924366e-06] [ 6.38191243e-08 6.58160719e-08 4.34001084e-07] [-1.67828321e-07 -1.14205840e-07 4.90810366e-07] [ 4.09377643e-08 3.23202611e-08 4.10447471e-07] [ 7.69263634e-08 1.22985423e-07 2.84248969e-07] [-3.48229644e-07 -1.83764393e-07 1.54631650e-07] [ 1.72803550e-07 5.59649432e-09 2.88410844e-07] [ 3.42247904e-08 -1.01774542e-04 4.11342407e-07] [-3.29593751e-06 -4.83121773e-05 -5.05898745e-05] [ 3.22772768e-06 -4.82336758e-05 5.14096614e-05] [ 2.57634070e-08 1.02682348e-04 5.47150051e-07] [ 2.55744121e-06 4.78037762e-05 5.15176829e-05] [-2.60881298e-06 4.78631014e-05 -5.04357265e-05] [ 1.38497225e-04 -1.57442929e-04 -5.95225009e-04] [ 1.38501034e-04 1.57452993e-04 -5.95206431e-04] [-1.38485892e-04 1.57447196e-04 5.95304766e-04] [-1.38482057e-04 -1.57437761e-04 5.95306316e-04] [ 3.63213888e-05 -2.91154297e-04 1.71257904e-04] [ 3.63187949e-05 2.91150027e-04 1.71270874e-04] [-3.63091715e-05 2.91151519e-04 -1.71159610e-04] [-3.63097435e-05 -2.91156167e-04 -1.71159109e-04]] Final stress: [-4.21197238e-04 -2.58425187e-04 -1.87696916e-04 1.85756013e-11 -1.84438718e-04 3.64660262e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-3.57577103e-05 7.49233143e-05 -8.13945486e-06] [-3.57995776e-05 -7.49422444e-05 -1.67572679e-05] [ 3.58408412e-05 -7.49466743e-05 4.57082563e-06] [ 3.57946498e-05 7.49397760e-05 1.62116314e-05] [-1.65770179e-08 -1.14945970e-06 -5.02176801e-08] [ 1.00018682e-06 5.89907217e-07 -5.01614561e-08] [-9.68406230e-07 5.52533638e-07 -2.91620594e-08] [ 5.65268179e-08 -9.35515394e-07 5.73821554e-07] [ 6.85186549e-07 3.91169422e-07 5.08603626e-07] [-8.17674334e-07 5.32558291e-07 6.13682740e-07] [-5.97839905e-09 -1.02763760e-04 2.18438345e-06] [-2.20993572e-06 -4.76643127e-05 5.31402143e-05] [ 2.19720966e-06 -4.76640875e-05 -4.87625856e-05] [ 3.52742195e-08 1.01384352e-04 -1.45768989e-06] [ 3.55467746e-06 4.83454576e-05 -5.24008469e-05] [-3.60974807e-06 4.84179017e-05 4.95293059e-05] [-1.38343741e-04 -1.57403866e-04 -5.94558288e-04] [-1.38336982e-04 1.57404284e-04 -5.94819796e-04] [ 1.38338626e-04 1.57406053e-04 5.94656578e-04] [ 1.38352050e-04 -1.57398591e-04 5.94862776e-04] [-3.62488688e-05 -2.90881908e-04 1.71306700e-04] [-3.62490303e-05 2.90870082e-04 1.71164776e-04] [ 3.62575615e-05 2.90873221e-04 -1.71247646e-04] [ 3.62514399e-05 -2.90880190e-04 -1.71050183e-04]] Final stress: [-4.21181006e-04 -2.58395404e-04 -1.87715135e-04 -1.65552756e-10 1.84418093e-04 -2.47591933e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 8.97063999e-04 -2.05871354e-03 1.65753519e-05] [-8.97063888e-04 2.05871355e-03 1.66024002e-05] [-8.97063537e-04 2.05871365e-03 -1.65724840e-05] [ 8.97063865e-04 -2.05871387e-03 -1.66059312e-05] [ 6.05409275e-11 5.84452664e-09 1.58660995e-09] [-4.56443472e-09 -2.83840072e-09 1.25263025e-09] [ 4.51766302e-09 -2.73390866e-09 1.26345992e-09] [ 3.81708323e-10 3.72464415e-09 -9.70075242e-10] [-3.78352405e-09 -2.38424180e-09 -1.33898825e-09] [ 2.96414127e-09 -1.41379325e-09 -7.57713729e-10] [ 4.25837662e-04 2.61298148e-04 -5.46295344e-09] [ 7.20322796e-04 -1.54318879e-03 -5.58068448e-09] [-1.08252542e-03 -8.50224364e-04 -5.35233032e-09] [-4.25837492e-04 -2.61301764e-04 5.50555582e-09] [-7.20319834e-04 1.54319043e-03 5.32120973e-09] [ 1.08252213e-03 8.50226393e-04 5.29349388e-09] [-5.55412049e-04 -3.89306310e-04 3.90651561e-04] [ 5.55412086e-04 3.89306305e-04 3.90652205e-04] [ 5.55412062e-04 3.89306266e-04 -3.90651524e-04] [-5.55411982e-04 -3.89306281e-04 -3.90652275e-04] [ 1.03803169e-04 -8.37671687e-05 1.91184653e-05] [-1.03803166e-04 8.37671555e-05 1.91188243e-05] [-1.03803144e-04 8.37671670e-05 -1.91183497e-05] [ 1.03803170e-04 -8.37671762e-05 -1.91190047e-05]] Final stress: [ 4.20534716e-04 2.69946831e-04 2.04492737e-04 3.76334154e-13 -1.09003521e-12 1.65212996e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-8.83327563e-04 -2.02727080e-03 1.92882199e-05] [ 8.83327599e-04 2.02727079e-03 1.93254969e-05] [ 8.83327321e-04 2.02727063e-03 -1.93149133e-05] [-8.83327461e-04 -2.02727071e-03 -1.93098389e-05] [-9.29019468e-11 9.49764434e-09 -3.00708014e-10] [-8.36060338e-09 -4.69059870e-09 -1.88618426e-10] [ 8.47462589e-09 -4.88844332e-09 -1.92522998e-10] [-1.54667285e-11 -2.80742269e-08 6.92683055e-09] [ 2.47200053e-08 1.41621656e-08 7.21343052e-09] [-2.45484646e-08 1.40657064e-08 7.07457335e-09] [-4.16139094e-04 2.58386029e-04 -4.07861055e-09] [ 1.07057853e-03 -8.39495021e-04 -3.85258616e-09] [-7.08359018e-04 -1.52102750e-03 -4.16602821e-09] [ 4.16139085e-04 -2.58409422e-04 1.70248643e-09] [-1.07055828e-03 8.39506736e-04 1.77087279e-09] [ 7.08338747e-04 1.52103920e-03 1.65829752e-09] [ 5.52670944e-04 -3.86870308e-04 3.87018666e-04] [-5.52670944e-04 3.86870305e-04 3.87018689e-04] [-5.52670964e-04 3.86870336e-04 -3.87018701e-04] [ 5.52670938e-04 -3.86870340e-04 -3.87019415e-04] [-1.03635082e-04 -8.19558262e-05 2.06489239e-05] [ 1.03635078e-04 8.19558229e-05 2.06492757e-05] [ 1.03635027e-04 8.19558348e-05 -2.06498896e-05] [-1.03635045e-04 -8.19558339e-05 -2.06500810e-05]] Final stress: [ 4.20737724e-04 2.69835838e-04 2.04702197e-04 5.67394085e-14 7.32414212e-13 -1.65272821e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 88 steps. Final forces: [[-0.01221854 -0.00585693 -0.00864119] [ 0.01777276 0.00930942 0.01221888] [-0.01630024 -0.01024849 -0.01050735] [ 0.0130971 0.00540129 0.01626359] [ 0.03212803 -0.01188709 0.00907481] [-0.01947812 -0.02863082 0.01001677] [-0.00120461 0.01845464 0.02330983] [-0.01578788 0.00239469 -0.0043086 ] [-0.00257635 0.01880959 -0.00639113] [ 0.00418194 -0.0010317 0.00167763] [ 0.01202789 -0.0063244 -0.00940899] [-0.02092123 0.00168337 0.00837436] [ 0.00814424 0.01418002 -0.01402091] [ 0.00743231 -0.01034441 -0.02531894] [-0.02234839 -0.00245207 0.01875703] [ 0.01202575 0.01224502 0.0121857 ] [-0.02077716 0.0034567 0.00257801] [-0.01087472 0.00764118 0.00325687] [ 0.00633956 -0.01262623 0.00159608] [ 0.02582356 0.00041597 -0.00103187] [-0.0021066 -0.00441019 -0.00898503] [ 0.00447219 -0.00044665 -0.00642738] [-0.00550195 -0.00726697 -0.00445689] [ 0.00665046 0.00753404 -0.01981129]] Final stress: [ 3.56326424e-02 3.59724412e-02 1.44440851e-01 3.14694069e-05 -3.31289958e-05 2.60214483e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-2.18407324e-03 -3.92625591e-03 2.21655454e-03] [ 2.24038902e-03 3.89245306e-03 1.21850936e-03] [ 2.19903127e-03 3.95757499e-03 -3.09857619e-03] [-2.18446146e-03 -3.96768731e-03 -2.78325056e-03] [ 1.79936906e-05 -1.29547762e-04 2.35371891e-04] [ 1.83351247e-04 6.48634404e-05 1.97027585e-04] [-2.38766474e-04 1.17087622e-04 1.42261977e-04] [ 2.96112280e-05 5.14292107e-04 4.54603031e-05] [-4.66623524e-04 -2.96675386e-04 1.64177679e-05] [ 4.09035444e-04 -2.29296469e-04 4.56361872e-05] [-3.60635539e-02 1.04881281e-02 4.07576161e-04] [ 8.44878954e-03 -1.23630035e-02 3.81918325e-04] [ 1.47287454e-02 3.25899801e-02 3.35251156e-04] [ 3.60772778e-02 -1.05016238e-02 1.54801334e-04] [-8.41681396e-03 1.23577270e-02 1.29322103e-04] [-1.47980243e-02 -3.25556442e-02 1.29532302e-04] [ 2.03945155e-03 -6.93467519e-03 -2.67374006e-04] [-2.03297922e-03 6.92888287e-03 -2.87430726e-04] [-2.03326878e-03 6.92477390e-03 3.23045033e-04] [ 2.03698157e-03 -6.92781922e-03 3.33580743e-04] [-1.30676155e-03 1.83423651e-03 4.66016801e-03] [ 1.31094932e-03 -1.83782446e-03 4.65370848e-03] [ 1.31597547e-03 -1.83337247e-03 -4.60113360e-03] [-1.31225615e-03 1.83342591e-03 -4.58837817e-03]] Final stress: [-1.53808019e-04 -6.05116125e-04 -4.64861135e-04 -6.95865437e-08 8.32586650e-08 -2.32108272e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 2.92362515e-09 5.27730298e-04 4.00103075e-04] [ 9.32830272e-10 -5.27728655e-04 4.00208366e-04] [ 1.89041376e-09 -5.27728808e-04 -4.00106319e-04] [ 5.58558894e-10 5.27730340e-04 -4.00188122e-04] [ 2.82340230e-10 -3.72159593e-08 -1.03118572e-08] [ 2.70992905e-08 1.72483655e-08 -7.64221675e-09] [-2.78801192e-08 1.81034641e-08 -8.32901423e-09] [ 2.34889404e-09 -4.51344850e-08 8.40291026e-09] [ 3.06433020e-08 1.85280872e-08 3.59254126e-09] [-3.68013927e-08 2.48676457e-08 8.80616137e-09] [ 1.98799738e-09 2.30299667e-03 -1.84773823e-08] [-2.53263642e-04 -3.16803312e-04 -1.82694490e-08] [ 2.53259983e-04 -3.16798949e-04 -1.84355547e-08] [ 2.13870127e-09 -2.30295469e-03 1.52133975e-08] [ 2.53222336e-04 3.16777419e-04 1.44936864e-08] [-2.53226604e-04 3.16782372e-04 1.58675764e-08] [ 3.50817708e-11 1.44743658e-03 5.46978342e-04] [ 3.05850678e-10 -1.44743600e-03 5.46980985e-04] [-3.40221740e-11 -1.44743611e-03 -5.46979147e-04] [ 2.49079202e-10 1.44743658e-03 -5.46980851e-04] [ 3.67540498e-10 -4.21006643e-05 -7.01777551e-04] [ 2.68231788e-10 4.21006487e-05 -7.01774388e-04] [ 3.82073238e-10 4.21005357e-05 7.01775326e-04] [ 2.28745523e-10 -4.21006475e-05 7.01775372e-04]] Final stress: [5.10148358e-04 8.03596599e-04 4.13976362e-04 2.67074786e-12 4.05714380e-12 2.25687550e-13] Minimization converged after 28 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.38264677e-10 -1.21734688e-04 -4.20230980e-04] [ 7.32598468e-10 1.21734327e-04 -4.20229861e-04] [-8.04429680e-10 1.21734416e-04 4.20222372e-04] [ 3.89348415e-10 -1.21734133e-04 4.20221225e-04] [ 8.31119670e-10 1.00644454e-09 8.98813524e-10] [-2.76017778e-09 -1.71088961e-09 1.99529057e-09] [ 9.41222655e-10 3.06530745e-10 6.57419674e-10] [-1.53580747e-10 4.16256829e-09 7.29175831e-10] [-2.01078598e-09 -1.54923063e-09 1.65874481e-09] [ 2.73176270e-09 -2.15554496e-09 8.25818539e-10] [-1.78918103e-10 -2.09478163e-04 1.48989112e-09] [ 1.02530827e-04 2.33879452e-04 1.67798824e-09] [-1.02530443e-04 2.33878997e-04 4.94072105e-10] [ 7.29159511e-11 2.09481713e-04 1.67179095e-09] [-1.02533679e-04 -2.33881072e-04 1.91556739e-09] [ 1.02533518e-04 -2.33880882e-04 1.83214368e-09] [ 1.48366708e-10 2.31783397e-04 1.76972183e-04] [-2.22473151e-11 -2.31783440e-04 1.76972359e-04] [ 9.97227856e-11 -2.31783327e-04 -1.76972020e-04] [-6.37296604e-11 2.31783339e-04 -1.76971940e-04] [-3.74839604e-11 -7.49567750e-06 -9.27545540e-05] [ 3.37232229e-11 7.49566786e-06 -9.27547753e-05] [-2.15791804e-11 7.49566558e-06 9.27551900e-05] [-1.23211441e-11 -7.49565060e-06 9.27549543e-05]] Final stress: [ 4.74259578e-05 2.04512730e-04 -1.90600563e-04 -1.83413679e-12 2.90770365e-12 -3.31921041e-14] Minimization converged after 34 steps. Minimization converged after 30 steps. Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-7.20852955e-09 1.09543367e-05 8.47589493e-06] [ 8.02802385e-09 8.54510383e-06 -4.38350545e-05] [-2.21312359e-08 -1.09293335e-05 -8.73850526e-06] [ 1.55221926e-08 -8.47712083e-06 4.30014945e-05] [ 3.73330807e-08 1.49071989e-06 3.03530572e-07] [-1.44801376e-06 -8.17526435e-07 3.99392636e-07] [ 1.36985934e-06 -7.29293392e-07 3.45349896e-07] [-9.18522968e-09 1.77508273e-07 1.36828171e-09] [-2.26130638e-07 -9.22496356e-08 -2.30770658e-08] [ 2.49078815e-07 -1.16151052e-07 -4.24926961e-08] [-4.30216077e-08 -2.58001981e-05 -1.73571886e-05] [ 6.08141159e-05 1.77762873e-05 8.24756397e-06] [-6.07401754e-05 1.76836903e-05 8.23451586e-06] [-1.06168295e-08 2.47787589e-05 1.73882923e-05] [-5.99582890e-05 -1.72250054e-05 -8.17815301e-06] [ 5.99743164e-05 -1.72465468e-05 -8.18314887e-06] [ 5.09440035e-09 -2.53620803e-05 6.15309572e-05] [-1.28184297e-09 7.94532738e-06 6.50040791e-05] [ 4.46104587e-09 2.53714270e-05 -6.15221922e-05] [-1.28466121e-09 -7.93892274e-06 -6.50152700e-05] [-4.88896235e-09 -5.08104980e-05 -4.88977718e-06] [-1.96016997e-10 4.56152159e-05 -4.85225111e-06] [-1.39875078e-09 5.08154258e-05 4.90936975e-06] [-3.98669958e-09 -4.56088751e-05 4.79530154e-06]] Final stress: [ 2.57023924e-04 4.45565085e-04 2.35244648e-04 1.58907424e-04 2.16147725e-11 -1.47333153e-11] Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.48085680e-03 -3.14894999e-03 4.47111459e-04] [-1.47486174e-03 3.15161112e-03 -4.05239572e-03] [ 1.47565403e-03 3.14912559e-03 2.16574652e-03] [ 1.47251187e-03 -3.15855398e-03 2.96137910e-03] [-3.16147114e-06 4.21165114e-04 1.95264093e-04] [-3.50596987e-04 -2.05280889e-04 1.84451670e-04] [ 3.57312207e-04 -2.12785667e-04 1.87729944e-04] [-2.11848049e-06 2.19341635e-03 -6.49909725e-04] [-1.90199801e-03 -1.09941895e-03 -6.32587087e-04] [ 1.90702681e-03 -1.10474162e-03 -6.42249711e-04] [-2.35929420e-06 5.48032959e-03 4.37454238e-04] [-2.64762911e-03 -2.50811123e-04 1.08870041e-03] [ 2.64743931e-03 -2.53515017e-04 -2.05448849e-04] [ 5.65221910e-08 -4.47406827e-03 -5.06105599e-04] [ 1.79572415e-03 -2.47027961e-04 -1.15880121e-03] [-1.79042220e-03 -2.49870064e-04 1.34364839e-04] [ 1.36414645e-03 1.70333847e-03 9.82528392e-05] [ 1.36273506e-03 -1.70649829e-03 5.00988295e-05] [-1.36450028e-03 -1.70356748e-03 -1.11944778e-04] [-1.36341220e-03 1.70536611e-03 -3.57523776e-05] [ 1.14459342e-03 1.08652009e-03 -3.08436523e-03] [ 1.14477529e-03 -1.08368908e-03 -3.15471113e-03] [-1.14524703e-03 -1.07616067e-03 3.13397512e-03] [-1.14481152e-03 1.08406662e-03 3.14974236e-03]] Final stress: [ 2.45598714e-04 1.00582202e-04 1.95100193e-04 -7.96559999e-08 3.11756191e-04 1.00777572e-08] Minimization converged after 44 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.29308707e-04 -1.04019672e-03 2.10846464e-04] [ 1.29308713e-04 1.04019664e-03 2.10853239e-04] [ 1.29308769e-04 1.04019684e-03 -2.10844755e-04] [-1.29308730e-04 -1.04019672e-03 -2.10851903e-04] [ 8.13873350e-11 -5.91415250e-11 -1.80278292e-10] [ 7.22404775e-11 -1.83670371e-11 -2.25692909e-10] [-1.88279170e-10 1.27177824e-10 -2.46726445e-10] [-2.67940791e-11 -2.18800866e-09 1.81550330e-10] [ 1.84534443e-09 1.07765719e-09 6.65841826e-11] [-1.82244420e-09 1.04329112e-09 9.69760834e-11] [-5.66042669e-04 2.49141246e-04 -1.53528963e-09] [ 3.16943058e-05 -1.45460940e-04 -1.73923961e-09] [-2.42447609e-04 -6.88892592e-04 -1.64618953e-09] [ 5.66042698e-04 -2.49139355e-04 8.44074299e-10] [-3.16959624e-05 1.45459960e-04 8.38615779e-10] [ 2.42449210e-04 6.88891662e-04 8.94028684e-10] [-4.23171018e-04 1.56969234e-04 -2.44712267e-05] [ 4.23171019e-04 -1.56969243e-04 -2.44710476e-05] [ 4.23171029e-04 -1.56969245e-04 2.44711275e-05] [-4.23171022e-04 1.56969250e-04 2.44709837e-05] [ 6.10962480e-05 -1.06074453e-04 3.55947408e-04] [-6.10962446e-05 1.06074450e-04 3.55947585e-04] [-6.10962388e-05 1.06074456e-04 -3.55947585e-04] [ 6.10962468e-05 -1.06074453e-04 -3.55947639e-04]] Final stress: [ 2.60359729e-04 4.31824781e-04 2.18912479e-04 -4.98162802e-13 -1.49491576e-13 1.65246811e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.07145064e-04 -1.01215357e-03 2.30184085e-04] [-1.07144949e-04 1.01215359e-03 2.30191643e-04] [-1.07144983e-04 1.01215351e-03 -2.30183307e-04] [ 1.07145087e-04 -1.01215359e-03 -2.30190119e-04] [ 5.15010745e-11 -4.70757655e-10 -2.94347768e-10] [ 3.17752630e-10 1.69060578e-10 -2.11945850e-10] [-4.49393522e-10 2.98945035e-10 -3.44239304e-10] [ 1.17807797e-10 7.48928475e-10 -2.85137802e-10] [-5.22320076e-10 -4.66436778e-10 -2.46783372e-10] [ 3.05125203e-10 -2.00634231e-10 -1.21825324e-10] [ 5.71303382e-04 2.57311369e-04 -1.43517112e-09] [ 1.98794422e-04 -6.94297503e-04 -1.36040032e-09] [-2.10884350e-05 -1.25968972e-04 -1.41899432e-09] [-5.71303341e-04 -2.57311965e-04 1.19469925e-09] [-1.98793954e-04 6.94297728e-04 1.16961922e-09] [ 2.10878277e-05 1.25969350e-04 1.12766362e-09] [ 4.16136293e-04 1.56104275e-04 -3.26902844e-05] [-4.16136270e-04 -1.56104279e-04 -3.26901253e-05] [-4.16136277e-04 -1.56104272e-04 3.26902725e-05] [ 4.16136294e-04 1.56104257e-04 3.26901009e-05] [-5.84571545e-05 -1.02703614e-04 3.64102212e-04] [ 5.84571647e-05 1.02703615e-04 3.64102319e-04] [ 5.84571623e-05 1.02703612e-04 -3.64102218e-04] [-5.84571542e-05 -1.02703616e-04 -3.64102351e-04]] Final stress: [ 2.60520316e-04 4.32314980e-04 2.19314614e-04 3.11261350e-13 1.11411905e-13 -1.65738053e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-5.67584978e-04 2.03249762e-04 4.20347115e-04] [ 5.63949388e-04 -2.20044880e-04 -1.21871474e-03] [ 5.54066223e-04 -2.11572673e-04 -7.16936781e-04] [-5.38831431e-04 2.19642497e-04 1.01969545e-03] [ 1.27296541e-05 2.44086257e-05 3.10175363e-05] [-4.77304946e-05 -3.05586540e-05 4.92033622e-05] [ 1.46980528e-05 3.27203092e-06 2.00107667e-05] [-4.23597783e-06 1.69008339e-04 1.20260728e-05] [-1.07498487e-04 -7.26533845e-05 3.03217718e-05] [ 1.20955725e-04 -8.52767544e-05 1.76258769e-05] [ 1.44896498e-03 -1.52913101e-04 3.60575854e-04] [ 3.78860825e-05 1.14348035e-03 3.50589498e-04] [-2.16531776e-03 -5.10866936e-04 3.46692043e-04] [-1.44857215e-03 1.89438605e-05 -2.61902172e-04] [ 8.99736913e-05 -1.07521958e-03 -2.42728702e-04] [ 2.03495569e-03 5.81149923e-04 -2.62234712e-04] [-7.79249149e-05 -2.82630145e-05 4.35102583e-05] [ 8.11614385e-05 2.78754451e-05 2.96024433e-06] [ 8.21094286e-05 2.93208037e-05 -3.31014950e-05] [-8.27879530e-05 -3.05446937e-05 6.09002160e-06] [-6.33290693e-06 4.95273607e-05 1.57025936e-04] [ 7.39834928e-06 -4.99138799e-05 1.25048422e-04] [ 4.31537643e-06 -5.08263025e-05 -1.38300248e-04] [-6.34703649e-06 4.87748547e-05 -1.18821388e-04]] Final stress: [-5.25284717e-04 -6.39038642e-04 -4.04676732e-04 -1.75891507e-08 5.36720659e-08 1.17314289e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 4.99207120e-04 -1.19187420e-03 -2.08161115e-03] [-5.61957753e-04 1.19375069e-03 -3.83036428e-03] [-6.27624743e-04 1.20687989e-03 -2.19286014e-03] [ 5.56761882e-04 -1.18778388e-03 -3.64308257e-04] [-2.20979132e-05 -1.14412387e-03 3.67864670e-04] [ 1.02234579e-03 5.97334143e-04 3.56424008e-04] [-9.81122194e-04 5.48078150e-04 3.74210216e-04] [-6.46261714e-05 5.96657933e-04 5.18304409e-04] [-4.58924363e-04 -2.17243993e-04 5.77150480e-04] [ 6.17229224e-04 -3.83895076e-04 4.44839268e-04] [-7.69023914e-03 7.79686508e-04 1.17455882e-03] [ 6.24778549e-03 -3.74087139e-03 1.18988891e-03] [ 1.30529694e-03 1.98103977e-03 1.15258896e-03] [ 7.64944984e-03 6.26652002e-05 5.20316351e-04] [-6.99397059e-03 3.35985360e-03 5.47314951e-04] [-4.63783919e-04 -2.46476171e-03 5.13467965e-04] [ 2.37934355e-04 6.22559810e-04 -9.69569662e-04] [-2.48002319e-04 -6.22545081e-04 -9.95690727e-04] [-2.42737654e-04 -6.21501839e-04 1.11938023e-03] [ 2.38315318e-04 6.19418282e-04 1.17841208e-03] [ 1.72395925e-04 -3.92185614e-04 3.47326925e-04] [-1.84389380e-04 3.96895421e-04 3.27423766e-04] [-1.69534611e-04 3.86350337e-04 -1.54339749e-04] [ 1.62288878e-04 -3.84383071e-04 -1.20728044e-04]] Final stress: [-6.35794745e-04 -6.64450888e-04 -4.04801035e-04 1.61324883e-08 -9.57576969e-08 -1.35774537e-04] Minimization converged after 8 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[ 1.94497284e-03 -1.74207980e-03 5.02337501e-05] [ 3.28153013e-03 -1.33693515e-03 -9.02038706e-05] [-3.26796717e-03 -1.73434645e-03 7.53213129e-06] [-2.55651871e-03 -1.56097505e-03 6.87902589e-05] [ 2.12027311e-04 2.26011483e-03 -5.80169448e-04] [-4.47295096e-06 1.21451234e-03 1.59476841e-03] [-1.25424803e-03 1.32591867e-03 -1.28071355e-04] [ 4.78539760e-04 -8.02088689e-04 -5.70515904e-03] [-1.68382919e-03 2.65083574e-04 2.15116574e-03] [ 3.11328530e-04 9.60477481e-04 3.29958368e-03] [-1.10003367e-03 -1.74691748e-03 -3.59130817e-03] [-4.81954375e-04 3.18232549e-03 5.06848366e-03] [ 2.81333511e-03 -8.38069775e-04 -2.12065337e-03] [-2.57523788e-03 -1.77082978e-03 -3.93058327e-03] [ 5.75205562e-04 3.43488611e-03 -4.09640142e-04] [ 3.89852877e-03 -1.20238455e-03 4.11807848e-03] [ 2.77158372e-04 1.47278238e-04 1.26593614e-04] [ 2.23989703e-04 -6.96945983e-06 -2.68909343e-04] [-1.84419462e-04 1.95244475e-04 -1.68508177e-04] [-3.13407279e-04 3.83710898e-05 2.30107041e-04] [ 1.93319044e-04 -1.11957998e-04 2.75973268e-04] [-4.84241660e-06 -1.91737442e-04 -2.50411058e-04] [-4.10437207e-04 2.87648295e-05 -5.47535594e-04] [-3.72566785e-04 -7.68550409e-06 7.99842816e-04]] Final stress: [-1.54968638e-04 1.05235254e-04 1.78248705e-04 -2.57592253e-04 3.03094832e-05 3.05639179e-06] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.61109731e-05 1.37500627e-04 2.62495397e-05] [-2.32107580e-04 4.06630531e-05 5.87612021e-05] [ 2.31265090e-05 1.69054074e-04 -1.15788495e-04] [-7.90297406e-05 3.21393086e-05 7.21003456e-05] [ 1.89920076e-04 -7.02277369e-05 -9.25101464e-05] [-1.30345600e-04 1.76058753e-04 2.13944039e-05] [-2.54727681e-05 -1.72665381e-05 -2.60109646e-04] [ 5.04174790e-05 -2.30200306e-04 2.70759298e-04] [-4.29045035e-04 -3.36191963e-04 -2.01667961e-04] [-6.94328385e-05 6.71693559e-06 6.16103344e-05] [ 2.04658317e-04 1.30185381e-04 1.51301409e-04] [ 1.09760500e-04 -3.03161202e-04 -9.30962431e-05] [ 2.83420639e-04 1.37105894e-04 -2.52179500e-05] [ 4.27050585e-06 -1.05980268e-04 -5.29388979e-06] [-5.43403412e-04 -1.36255699e-04 -8.16122858e-05] [-7.00051205e-05 2.37256421e-04 -1.43896227e-04] [ 2.36291626e-05 -5.58019825e-05 1.22938943e-04] [-4.17831167e-05 1.35233415e-04 1.56938300e-04] [-2.40673477e-05 -3.71387219e-05 7.13310301e-05] [ 2.90408571e-05 2.35794726e-05 -1.06666330e-05] [ 3.07712840e-04 7.82259692e-05 3.51269579e-05] [ 2.80109728e-04 -8.74474104e-05 7.91902544e-07] [ 8.71302474e-05 7.00708374e-05 -2.98355493e-05] [ 5.38472500e-06 5.88168759e-06 1.03913599e-05]] Final stress: [ 0.06983049 0.12877287 0.09771683 -0.01417285 0.0027898 -0.00030787] Minimization converged after 58 steps. Minimization converged after 57 steps. Minimization converged after 50 steps. Minimization converged after 51 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.38571823e-04 -5.76463307e-04 7.96825217e-05] [-1.11180717e-04 5.83910662e-04 -2.15722977e-04] [-1.21512712e-04 5.87388369e-04 -4.94230839e-04] [ 1.42708894e-04 -5.80027790e-04 -1.30460880e-04] [ 2.21111323e-05 -3.57691843e-04 -2.68293219e-05] [ 2.79492712e-04 1.50784043e-04 -6.45205554e-06] [-3.28950376e-04 2.04892651e-04 -3.91786898e-05] [ 9.68755936e-06 -2.65704388e-04 1.20904241e-04] [ 1.89385296e-04 1.15368841e-04 1.00573495e-04] [-2.11142626e-04 1.39032165e-04 1.13459924e-04] [ 4.51307178e-04 8.57364415e-04 1.32038526e-04] [-1.16858002e-03 6.98948134e-04 1.35465106e-04] [ 8.70277399e-04 -2.95753938e-03 1.29151184e-04] [-4.33368021e-04 -1.54358597e-04 1.33689337e-05] [ 5.23840529e-04 -1.07590540e-03 1.27639357e-05] [-2.67811771e-04 2.62606449e-03 1.36745974e-05] [-1.78311297e-04 1.23583416e-04 -2.48272346e-04] [ 1.81136762e-04 -1.22365643e-04 -2.44301261e-04] [ 1.82176056e-04 -1.23311329e-04 2.50675466e-04] [-1.80920870e-04 1.24208632e-04 2.70315684e-04] [ 6.71110831e-06 3.98818622e-04 2.33849766e-04] [-5.61200384e-07 -3.97630475e-04 2.39409069e-04] [-2.86665490e-06 -3.97469706e-04 -2.27641024e-04] [ 7.79982062e-06 3.98103423e-04 -2.12243056e-04]] Final stress: [-1.96014109e-05 -3.79236620e-05 2.08755633e-04 3.03066824e-10 4.11712360e-08 8.28042668e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 2.34704812e-05 -8.53552599e-05 -2.64932105e-05] [-2.34704982e-05 8.53552689e-05 -2.64558475e-05] [-2.34704873e-05 8.53552204e-05 2.64890259e-05] [ 2.34704951e-05 -8.53552686e-05 2.65091118e-05] [-1.32693236e-10 -6.03440172e-08 -1.65485470e-08] [ 5.23682134e-08 3.03000925e-08 -1.65632531e-08] [-5.21946484e-08 3.00488124e-08 -1.65457787e-08] [ 1.76643439e-11 -1.31774243e-08 3.34241212e-09] [ 1.14517816e-08 6.58415800e-09 3.36656414e-09] [-1.14854160e-08 6.62441135e-09 3.39023660e-09] [ 1.16911411e-04 -2.22567518e-06 -3.26308327e-09] [ 6.04783856e-05 -5.78162413e-05 -3.21341730e-09] [ 1.19154701e-04 -2.02093255e-05 -3.23655547e-09] [-1.16911345e-04 2.25136455e-06 -1.35277918e-10] [-6.05006477e-05 5.78033407e-05 -1.30064655e-10] [-1.19132520e-04 2.01965503e-05 -1.71963776e-10] [ 5.71153451e-05 -6.43874935e-06 7.11144623e-05] [-5.71153361e-05 6.43874872e-06 7.11150509e-05] [-5.71153385e-05 6.43874799e-06 -7.11149579e-05] [ 5.71153474e-05 -6.43875365e-06 -7.11147662e-05] [-8.44753126e-05 -1.02412059e-06 -1.59147551e-04] [ 8.44753031e-05 1.02411952e-06 -1.59146359e-04] [ 8.44753082e-05 1.02411737e-06 1.59146925e-04] [-8.44753176e-05 -1.02412048e-06 1.59147825e-04]] Final stress: [ 2.36591519e-04 2.36487589e-04 4.26294886e-04 1.64029817e-13 -4.09314346e-14 -1.85642046e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 2.63748083e-05 -7.56241247e-05 -3.81778276e-06] [-2.63748397e-05 7.56241452e-05 -3.80574749e-06] [-2.63748487e-05 7.56241787e-05 3.84111824e-06] [ 2.63748782e-05 -7.56242003e-05 3.82306045e-06] [ 4.75999643e-12 -9.80516202e-09 -2.90757785e-09] [ 8.46337432e-09 4.89820961e-09 -2.92098956e-09] [-8.48175430e-09 4.92143709e-09 -2.93846159e-09] [-6.37168074e-11 3.62624530e-08 -8.96765173e-09] [-3.13069923e-08 -1.80722640e-08 -8.97553643e-09] [ 3.14002160e-08 -1.82004510e-08 -9.00198908e-09] [-7.74220419e-05 1.14298738e-05 -3.68753645e-09] [-2.29313803e-05 -1.34954528e-05 -3.72485623e-09] [-7.98234035e-05 -5.09045201e-05 -3.71486132e-09] [ 7.74220936e-05 -1.14557021e-05 1.73114954e-09] [ 2.29537322e-05 1.35083173e-05 1.69439900e-09] [ 7.98009879e-05 5.09174851e-05 1.62437603e-09] [-6.06647322e-05 -6.88612520e-06 -4.85581894e-05] [ 6.06647312e-05 6.88612506e-06 -4.85582446e-05] [ 6.06647343e-05 6.88612439e-06 4.85586012e-05] [-6.06647263e-05 -6.88612828e-06 4.85578531e-05] [ 8.18901895e-05 -3.62958070e-06 1.19139232e-04] [-8.18901957e-05 3.62958123e-06 1.19139014e-04] [-8.18902006e-05 3.62958352e-06 -1.19138202e-04] [ 8.18901979e-05 -3.62958438e-06 -1.19138924e-04]] Final stress: [-2.08590213e-04 -2.08769060e-04 -4.07778340e-04 1.19123134e-13 -2.20473203e-13 1.86890830e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-2.56304801e-05 -7.71671708e-05 -3.83671522e-06] [ 2.56305349e-05 7.71672297e-05 -3.88469920e-06] [ 2.56305267e-05 7.71671793e-05 3.90462457e-06] [-2.56305000e-05 -7.71672411e-05 3.85651675e-06] [ 2.13331893e-11 1.98784184e-08 6.26067798e-09] [-1.72295129e-08 -9.95765526e-09 6.25171998e-09] [ 1.71980076e-08 -9.91318527e-09 6.24825738e-09] [ 1.57694723e-10 5.09120883e-08 -1.59310956e-08] [-4.42261807e-08 -2.56170781e-08 -1.59687014e-08] [ 4.39914096e-08 -2.52975723e-08 -1.59005053e-08] [ 7.87222736e-05 1.94837563e-06 -1.80818465e-09] [ 7.19968027e-05 -4.91730250e-05 -1.73780559e-09] [ 3.13890648e-05 -1.06185189e-05 -1.78078593e-09] [-7.87222333e-05 -1.92573488e-06 -1.70748473e-09] [-7.20164729e-05 4.91616584e-05 -1.76588409e-09] [-3.13694557e-05 1.06072385e-05 -1.77834815e-09] [ 6.14235187e-05 -6.86865782e-06 -4.99162901e-05] [-6.14235115e-05 6.86866459e-06 -4.99159357e-05] [-6.14235182e-05 6.86865776e-06 4.99157429e-05] [ 6.14235229e-05 -6.86866164e-06 4.99160938e-05] [-8.15519941e-05 -2.89300263e-06 1.21074474e-04] [ 8.15520019e-05 2.89300533e-06 1.21073691e-04] [ 8.15520044e-05 2.89300331e-06 -1.21073550e-04] [-8.15519975e-05 -2.89300480e-06 -1.21074334e-04]] Final stress: [-2.08592376e-04 -2.08778971e-04 -4.07761826e-04 3.45789358e-13 8.00240333e-14 -1.86867006e-04] Minimization converged after 53 steps. Minimization converged after 51 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-4.39030704e-04 -1.43690219e-03 -1.57511537e-04] [ 6.25532072e-04 -2.20264515e-03 1.86266137e-03] [ 4.37154583e-04 1.43511287e-03 -5.03633752e-04] [-6.29053637e-04 2.20544935e-03 5.29032998e-04] [ 3.52382826e-07 -1.56708349e-03 -5.16834949e-04] [ 1.36061851e-03 7.86499750e-04 -5.05790995e-04] [-1.34863608e-03 7.79986907e-04 -5.14590416e-04] [-1.33175765e-07 -2.05789271e-04 9.03325228e-05] [ 1.80184686e-04 1.03972982e-04 9.18734731e-05] [-1.77472566e-04 1.02240114e-04 9.07014074e-05] [ 1.21764357e-04 -6.35434450e-03 2.59232585e-03] [-1.49259237e-03 7.02558854e-04 -6.61646358e-04] [ 3.55968773e-03 2.46725461e-04 -6.59619548e-04] [-1.24606897e-04 5.05443379e-03 -2.74695252e-03] [ 2.61689888e-03 -5.16784685e-05 5.08933786e-04] [-4.68125300e-03 3.99432475e-04 5.07123615e-04] [ 3.20729433e-04 -8.95085087e-05 -3.20825295e-04] [ 7.55203640e-05 2.26466352e-04 -7.47841708e-04] [-3.19616220e-04 9.16052000e-05 3.30621609e-04] [-7.73838120e-05 -2.26493494e-04 7.19483545e-04] [-2.44889433e-05 -5.03648611e-05 -3.15325409e-03] [-7.40271436e-04 -8.87254316e-04 -3.39267124e-03] [ 2.29726755e-05 4.96341092e-05 3.14402688e-03] [ 7.33123170e-04 8.87946034e-04 3.41405536e-03]] Final stress: [-2.16505065e-04 -1.68110741e-04 -2.89831531e-06 -2.72799173e-04 -2.47577906e-04 1.34572655e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.29159267e-04 -8.02482849e-05 -2.00820127e-04] [-2.09651314e-04 1.34639012e-04 1.76004094e-05] [-2.42204048e-04 1.56038457e-04 3.35223339e-04] [ 3.65160194e-04 -8.13492017e-05 4.04941383e-04] [-1.22166398e-04 2.13401168e-04 -4.45420475e-05] [-1.08150312e-04 -3.08042954e-04 -9.48348286e-05] [ 2.36807475e-04 -1.17116677e-04 -1.11061969e-04] [ 2.20285575e-04 -7.73109917e-05 -1.89931747e-04] [ 2.09496133e-05 -1.23275279e-04 2.69083052e-05] [-1.80476965e-04 1.70160101e-04 8.70544245e-05] [ 1.48681957e-04 7.99739763e-05 -1.53673707e-04] [ 3.69619089e-04 -3.23047780e-04 -5.60357279e-05] [ 5.42519303e-05 2.51591496e-04 5.85749570e-05] [ 2.29684030e-05 -3.38435447e-04 -5.49073822e-05] [-4.15197434e-04 4.14898724e-04 -4.13777520e-05] [-5.28678489e-05 -1.30528361e-04 -7.94931950e-05] [-8.46557404e-05 -1.61033889e-04 -1.62972849e-04] [-1.06396576e-04 6.89486901e-05 1.72635126e-04] [ 3.53462103e-05 -1.08599320e-04 6.35528075e-05] [-9.11322890e-05 7.72758355e-05 1.29285752e-04] [-3.28389315e-05 3.05747044e-05 -1.91498398e-04] [-2.61133511e-05 -8.33935746e-05 1.59197629e-04] [ 1.54036657e-04 -5.68023691e-05 -2.55849597e-05] [-8.54151635e-05 3.91681963e-04 -4.82394439e-05]] Final stress: [ 0.032767 0.03331588 0.13518568 0.00100253 -0.0006352 -0.00047445] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 3.73513581e-05 -1.71771700e-05 3.82417444e-06] [ 4.02433454e-05 1.76680965e-04 -3.43456538e-06] [-3.63797217e-06 -2.10866424e-05 2.13166772e-05] [ 4.95882631e-05 1.77729023e-06 -1.30752032e-04] [ 2.79917551e-05 -1.71267878e-04 -3.75389023e-05] [ 2.55006844e-04 -3.15122705e-05 1.91272257e-04] [ 1.61637731e-04 -7.48277626e-05 -6.28189774e-05] [-1.51726649e-04 6.62269909e-05 -2.66862187e-04] [-3.24610575e-05 -1.46908728e-04 1.44390393e-05] [-1.54032119e-05 -1.13714764e-04 3.42459050e-05] [ 5.19753640e-04 -7.17056956e-05 4.00458095e-05] [ 2.19147223e-05 5.51216770e-04 -5.68929984e-05] [-4.41273578e-04 -2.18301126e-04 -5.79270977e-05] [-2.45192404e-04 3.86699795e-05 6.12824068e-05] [ 1.10030698e-04 -2.53109591e-04 2.48884263e-05] [ 9.09919953e-05 1.92547177e-04 -6.02176106e-05] [-6.09178678e-05 5.17649060e-05 -3.61455378e-05] [ 1.20902466e-04 1.54128454e-04 6.92307856e-06] [-2.82700257e-04 -4.89660995e-05 -3.90582935e-05] [ 3.81483696e-05 -6.01765357e-05 8.31695514e-05] [ 9.56757306e-05 -1.60601777e-04 8.84319311e-05] [-3.25162539e-05 8.51143092e-05 -3.22201077e-05] [-1.70266760e-04 -5.70433391e-05 8.04268846e-05] [-1.33140908e-04 1.28272538e-04 1.33602169e-04]] Final stress: [ 3.35887871e-02 3.24877154e-02 1.35176587e-01 -1.26999645e-04 1.14045119e-03 9.33925915e-06] Minimization converged after 196 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-5.15213709e-05 1.50900361e-04 -4.86705786e-04] [-9.29024291e-05 -2.13895693e-04 6.75649400e-04] [ 5.15214811e-05 -1.50900372e-04 4.86504553e-04] [ 9.29021418e-05 2.13894892e-04 -6.76202468e-04] [-5.66615829e-10 3.39568804e-07 1.14886042e-07] [-2.92802986e-07 -1.68997027e-07 1.13714074e-07] [ 2.93615668e-07 -1.70133639e-07 1.13857872e-07] [ 5.01140926e-10 -2.59749751e-07 7.05335649e-08] [ 2.24969934e-07 1.29443185e-07 7.10804923e-08] [-2.25658613e-07 1.30433281e-07 7.12302726e-08] [-5.02358115e-04 -1.20656572e-04 -2.59549924e-04] [ 1.35836257e-04 -2.32525672e-04 -3.50695378e-04] [ 2.11515904e-04 5.07899565e-04 -6.18542096e-05] [ 5.02357534e-04 1.20961170e-04 2.59616060e-04] [-1.36099070e-04 2.32374178e-04 3.50761168e-04] [-2.11252347e-04 -5.08052143e-04 6.19199777e-05] [ 2.74751683e-05 4.39226779e-05 -1.04670493e-05] [-8.13533745e-05 6.16802512e-05 2.09146909e-05] [-2.74751690e-05 -4.39229308e-05 1.04658792e-05] [ 8.13533086e-05 -6.16801630e-05 -2.09064761e-05] [ 1.02534630e-04 -6.49225976e-05 -1.22523773e-06] [-1.26745257e-04 -1.57351736e-04 1.66104728e-05] [-1.02534547e-04 6.49226967e-05 1.22175474e-06] [ 1.26745196e-04 1.57351523e-04 -1.66127296e-05]] Final stress: [ 1.37686086e-05 1.49191444e-05 1.45363784e-05 -1.61221513e-04 3.08697305e-07 1.86221375e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 4.42206489e-05 1.22230043e-04 -4.91521385e-04] [ 8.66980541e-05 -1.89121499e-04 6.99487500e-04] [-4.42208298e-05 -1.22230261e-04 4.91197505e-04] [-8.66979197e-05 1.89121084e-04 -6.99760612e-04] [ 2.58497677e-10 1.60370503e-07 5.54391369e-08] [-1.38636805e-07 -8.03297160e-08 5.49251293e-08] [ 1.38270097e-07 -7.98174311e-08 5.48660097e-08] [-5.95702588e-10 -3.12415526e-07 9.07025830e-08] [ 2.71451931e-07 1.56884647e-07 9.16045945e-08] [-2.70622266e-07 1.55728131e-07 9.14289195e-08] [ 4.99021070e-04 -1.18075490e-04 -2.66520931e-04] [-1.94738422e-04 4.86969478e-04 -7.51819581e-05] [-1.38402286e-04 -2.40157022e-04 -3.44531758e-04] [-4.99020776e-04 1.18206815e-04 2.66573303e-04] [ 1.94624981e-04 -4.87035204e-04 7.52342038e-05] [ 1.38515369e-04 2.40091839e-04 3.44584023e-04] [-2.99838106e-05 4.57177428e-05 -1.13123597e-05] [ 8.11693289e-05 6.35090694e-05 2.05815204e-05] [ 2.99838057e-05 -4.57178678e-05 1.13131469e-05] [-8.11692842e-05 -6.35090684e-05 -2.05766963e-05] [-1.01794364e-04 -6.93818145e-05 -1.53750016e-06] [ 1.24656532e-04 -1.58260635e-04 1.68443565e-05] [ 1.01794281e-04 6.93818413e-05 1.53266518e-06] [-1.24656503e-04 1.58260528e-04 -1.68439908e-05]] Final stress: [ 1.36505571e-05 1.50162605e-05 1.45515932e-05 -1.61125062e-04 -4.73220104e-07 -1.86109613e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 8.51592740e-05 1.91878592e-04 6.96929682e-04] [ 4.24430280e-05 -1.25915177e-04 -4.94584639e-04] [-8.51592797e-05 -1.91878880e-04 -6.96871757e-04] [-4.24431156e-05 1.25915566e-04 4.94409842e-04] [-6.30784791e-12 1.98339673e-08 1.74363128e-08] [-1.73159434e-08 -9.95862118e-09 1.76085820e-08] [ 1.73482506e-08 -9.97923405e-09 1.76170230e-08] [ 1.81221428e-10 -7.07548611e-08 1.08656262e-08] [ 6.11830291e-08 3.52297664e-08 1.07787451e-08] [-6.14284866e-08 3.55681162e-08 1.08493408e-08] [-4.98154637e-04 -1.15839329e-04 2.65940231e-04] [ 1.35587195e-04 -2.39397550e-04 3.43208406e-04] [ 1.97995813e-04 4.87052111e-04 7.73777964e-05] [ 4.98153997e-04 1.16168131e-04 -2.65930012e-04] [-1.35871589e-04 2.39233707e-04 -3.43197848e-04] [-1.97710625e-04 -4.87217141e-04 -7.73672414e-05] [ 8.07642457e-05 -6.28799745e-05 2.05714078e-05] [-2.98570813e-05 -4.51489649e-05 -1.13326044e-05] [-8.07642872e-05 6.28801564e-05 -2.05759046e-05] [ 2.98570374e-05 4.51487957e-05 1.13382534e-05] [ 1.24705807e-04 1.58404015e-04 1.68307490e-05] [-1.01951173e-04 6.91681974e-05 -1.55490265e-06] [-1.24705764e-04 -1.58404150e-04 -1.68335023e-05] [ 1.01951193e-04 -6.91680425e-05 1.55688771e-06]] Final stress: [ 1.36655195e-05 1.50064353e-05 1.45430700e-05 1.61152316e-04 -4.88769776e-07 1.86128057e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-9.27143800e-05 2.12050458e-04 6.81249365e-04] [-5.11635644e-05 -1.48784715e-04 -4.90240794e-04] [ 9.27142843e-05 -2.12050272e-04 -6.81457992e-04] [ 5.11635617e-05 1.48784782e-04 4.90232373e-04] [-4.45207339e-11 -2.20425969e-08 -3.78686066e-09] [ 1.90868646e-08 1.10585732e-08 -3.80321044e-09] [-1.90282761e-08 1.09678743e-08 -3.79364140e-09] [-3.36806397e-10 -1.93656890e-07 5.72641643e-08] [ 1.67571959e-07 9.70748941e-08 5.67981131e-08] [-1.67118755e-07 9.64089058e-08 5.67240005e-08] [ 5.01439878e-04 -1.19357034e-04 2.61172624e-04] [-2.10914031e-04 5.05007403e-04 6.40907038e-05] [-1.34439797e-04 -2.32966945e-04 3.51649560e-04] [-5.01439755e-04 1.19394976e-04 -2.61153559e-04] [ 2.10880922e-04 -5.05026565e-04 -6.40716478e-05] [ 1.34472776e-04 2.32948006e-04 -3.51630494e-04] [-8.12583685e-05 -6.16869274e-05 2.08953120e-05] [ 2.76487857e-05 -4.39706001e-05 -1.06702853e-05] [ 8.12583739e-05 6.16869603e-05 -2.08948712e-05] [-2.76487594e-05 4.39706149e-05 1.06718988e-05] [-1.26503109e-04 1.57532028e-04 1.66864214e-05] [ 1.02435748e-04 6.53793498e-05 -1.30912908e-06] [ 1.26503062e-04 -1.57532010e-04 -1.66901151e-05] [-1.02435756e-04 -6.53793208e-05 1.31122812e-06]] Final stress: [ 1.37604705e-05 1.49273958e-05 1.45318175e-05 1.61218116e-04 3.23303570e-07 -1.86213241e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-8.87754128e-06 -8.77851590e-05 7.05402405e-06] [-8.87207582e-06 8.77839194e-05 8.44530139e-06] [ 8.87818334e-06 8.77862623e-05 -7.24164946e-06] [ 8.87437262e-06 -8.77847458e-05 -8.30512375e-06] [ 1.26058158e-09 1.68406610e-07 2.02537662e-08] [-1.45989280e-07 -8.53801984e-08 1.99887996e-08] [ 1.43388600e-07 -8.23951785e-08 1.87308993e-08] [ 1.00699890e-09 -1.08955358e-08 1.17818922e-08] [ 7.31954342e-09 3.96284194e-09 1.03075944e-08] [-9.37344130e-09 6.32205394e-09 1.16662725e-08] [ 2.00900796e-09 1.28730423e-04 -2.24165119e-07] [-2.06512385e-05 1.85247095e-04 -1.09024537e-05] [ 2.06438264e-05 1.85253659e-04 1.04505599e-05] [-6.89744095e-10 -1.29296457e-04 2.13897424e-07] [ 2.11392827e-05 -1.84965827e-04 1.08914390e-05] [-2.11346803e-05 -1.84969257e-04 -1.04623458e-05] [ 3.71209290e-05 -1.05646780e-04 1.69001016e-04] [ 3.71196756e-05 1.05646711e-04 1.69020569e-04] [-3.71200519e-05 1.05646578e-04 -1.68994133e-04] [-3.71199682e-05 -1.05646640e-04 -1.69031055e-04] [-5.42084656e-05 -1.02707968e-04 2.32705677e-04] [-5.42086478e-05 1.02708133e-04 2.32721317e-04] [ 5.42081441e-05 1.02708051e-04 -2.32704975e-04] [ 5.42093232e-05 -1.02708017e-04 -2.32730630e-04]] Final stress: [ 3.89479285e-05 3.97543619e-06 1.42465820e-05 -1.87621470e-12 -3.33039878e-04 4.68047400e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 8.88489134e-06 -8.81641151e-05 7.51255463e-06] [ 8.88330304e-06 8.81658660e-05 8.24201389e-06] [-8.88604638e-06 8.81628586e-05 -8.01183239e-06] [-8.88378059e-06 -8.81659966e-05 -8.32262796e-06] [-3.29988398e-10 3.85694502e-07 7.08511395e-08] [-3.31938380e-07 -1.92361674e-07 7.07773902e-08] [ 3.32243774e-07 -1.92901510e-07 6.94205037e-08] [-1.12441321e-10 -5.70302903e-07 1.39916311e-07] [ 4.96890691e-07 2.86113846e-07 1.40529043e-07] [-4.96180708e-07 2.85609538e-07 1.41678620e-07] [-1.22498467e-09 1.29336877e-04 -9.67514555e-08] [-2.07764342e-05 1.85679571e-04 1.06493924e-05] [ 2.07803177e-05 1.85675903e-04 -1.08374968e-05] [-1.60165159e-10 -1.29592881e-04 9.26727782e-08] [ 2.09993552e-05 -1.85549927e-04 -1.06522918e-05] [-2.10003930e-05 -1.85549481e-04 1.08337056e-05] [-3.71599977e-05 -1.06079821e-04 1.69158566e-04] [-3.71595052e-05 1.06079868e-04 1.69166497e-04] [ 3.71596626e-05 1.06079599e-04 -1.69159049e-04] [ 3.71596051e-05 -1.06080080e-04 -1.69175047e-04] [ 5.42776879e-05 -1.02588450e-04 2.32974751e-04] [ 5.42777763e-05 1.02588548e-04 2.32984668e-04] [-5.42775795e-05 1.02588119e-04 -2.32992659e-04] [-5.42780504e-05 -1.02588308e-04 -2.33000240e-04]] Final stress: [ 3.89797549e-05 3.95591367e-06 1.42332317e-05 1.65236849e-11 3.33049104e-04 -2.05202093e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 3.32060303e-05 2.09133004e-04 -2.73583071e-04] [-1.69063929e-04 -1.44390590e-04 6.98089307e-05] [-3.32062475e-05 -2.09133043e-04 2.72255599e-04] [ 1.69060473e-04 1.44390689e-04 -7.17290723e-05] [-3.10437899e-09 1.28007466e-06 4.17328074e-07] [-1.10606597e-06 -6.36774724e-07 4.14912244e-07] [ 1.11137428e-06 -6.43434399e-07 4.19932380e-07] [ 1.69444161e-09 -1.33728059e-06 3.84928453e-07] [ 1.15737447e-06 6.67225883e-07 3.86603570e-07] [-1.15901550e-06 6.70139008e-07 3.83271475e-07] [ 2.99852581e-04 2.47100188e-04 1.76410932e-04] [-3.98783825e-04 2.97583810e-04 8.38114691e-05] [ 1.04558651e-06 -3.35753956e-04 2.12678295e-04] [-2.99854332e-04 -2.46352416e-04 -1.76131463e-04] [ 3.98138330e-04 -2.97955440e-04 -8.35323783e-05] [-3.95731720e-07 3.35377782e-04 -2.12398428e-04] [ 7.60026108e-05 -8.94910085e-06 2.37324952e-05] [-2.41217398e-05 -1.69879618e-05 -2.63657130e-05] [-7.60032880e-05 8.94910834e-06 -2.37294278e-05] [ 2.41215992e-05 1.69879756e-05 2.63918301e-05] [ 8.13773560e-06 -2.88341359e-05 -1.99039203e-05] [-2.08577275e-04 1.57253437e-05 3.26978491e-05] [-8.13730128e-06 2.88340810e-05 1.98857840e-05] [ 2.08576466e-04 -1.57252878e-05 -3.27066849e-05]] Final stress: [ 1.69754602e-05 1.21105611e-05 1.35364651e-05 1.85441424e-06 -1.63584536e-04 1.86585476e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.70218053e-04 8.89878581e-05 1.92765522e-05] [ 3.59736251e-05 -2.26400302e-04 -2.98735472e-04] [ 1.70220311e-04 -8.89878457e-05 -1.87287664e-05] [-3.59774970e-05 2.26400390e-04 2.94125228e-04] [ 2.92854148e-09 2.83122686e-06 9.48853317e-07] [-2.45309375e-06 -1.41796826e-06 9.44534445e-07] [ 2.45118061e-06 -1.41349133e-06 9.53288135e-07] [-1.25568478e-09 -4.39708241e-07 5.43160902e-08] [ 3.81516531e-07 2.20999199e-07 5.47316679e-08] [-3.80089036e-07 2.18720263e-07 5.38830045e-08] [-3.04730660e-04 2.31585167e-04 -1.38049113e-04] [ 1.28354002e-06 -3.39843741e-04 -2.42094966e-04] [ 3.97769573e-04 2.95820560e-04 -1.10405363e-04] [ 3.04735227e-04 -2.28651890e-04 1.38399080e-04] [-3.82565672e-06 3.38373468e-04 2.42442651e-04] [-3.95230782e-04 -2.97283585e-04 1.10757475e-04] [-2.88614190e-05 1.38187118e-05 -2.58041486e-05] [ 7.27935591e-05 6.35706088e-06 2.55415164e-05] [ 2.88594376e-05 -1.38187114e-05 2.57771554e-05] [-7.27918494e-05 -6.35701498e-06 -2.54779050e-05] [-2.00563696e-04 -1.68710443e-05 3.23856615e-05] [ 1.69943496e-05 2.78053617e-05 -1.98918236e-05] [ 2.00564480e-04 1.68710334e-05 -3.23879224e-05] [-1.69956767e-05 -2.78052548e-05 1.98605542e-05]] Final stress: [ 1.69338732e-05 1.21757914e-05 1.35886122e-05 -2.21749750e-06 -1.63483600e-04 -1.86620485e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 6.62737562e-05 -3.23247718e-05 -7.95956654e-05] [-2.22916678e-05 8.67064286e-05 -1.31744423e-04] [-6.62605718e-05 3.23245068e-05 7.28296066e-05] [ 2.22871050e-05 -8.67064715e-05 1.35500746e-04] [ 9.81655315e-10 -1.38744229e-06 -5.74924596e-07] [ 1.20167687e-06 6.93237923e-07 -5.77639256e-07] [-1.20156170e-06 6.94304879e-07 -5.72129661e-07] [ 9.06335955e-09 -3.81323533e-06 1.31832775e-06] [ 3.29467040e-06 1.89693019e-06 1.31072472e-06] [-3.31071693e-06 1.91665665e-06 1.32630204e-06] [ 2.83454914e-04 -1.06533550e-04 -2.78806009e-04] [-3.34131015e-04 3.24792940e-04 -1.48936312e-04] [-1.07259662e-04 -2.86600942e-04 -1.33910362e-04] [-2.83445325e-04 1.00949890e-04 2.79065003e-04] [ 3.38959605e-04 -3.22010854e-04 1.49191337e-04] [ 1.02416456e-04 2.89402659e-04 1.34173430e-04] [ 2.25160172e-05 1.76287274e-05 -2.24410906e-05] [-7.65014317e-05 1.74678522e-05 2.93718886e-05] [-2.25183649e-05 -1.76287499e-05 2.25407981e-05] [ 7.65053298e-05 -1.74679117e-05 -2.94445648e-05] [ 1.95020590e-04 -1.11760334e-05 2.79267259e-05] [-2.10326074e-05 2.72789403e-05 -1.64112182e-05] [-1.95017268e-04 1.11758705e-05 -2.79749667e-05] [ 2.10300282e-05 -2.72789836e-05 1.64344154e-05]] Final stress: [ 1.62734825e-05 1.25884165e-05 1.44751574e-05 -1.20439423e-06 1.61697408e-04 1.86521607e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-4.85996423e-05 1.09089513e-04 -1.21616245e-04] [ 4.65857118e-05 -7.76287715e-05 4.42648166e-05] [ 4.86129454e-05 -1.09089799e-04 1.04713213e-04] [-4.66011876e-05 7.76285530e-05 -3.73676627e-05] [-6.04605186e-09 -2.66829451e-06 -1.07938873e-06] [ 2.31705545e-06 1.34124098e-06 -1.08580888e-06] [-2.30508363e-06 1.32734929e-06 -1.07334560e-06] [-1.15738357e-08 -1.07546362e-05 3.55458109e-06] [ 9.31847403e-06 5.38673727e-06 3.53840667e-06] [-9.31026510e-06 5.36864513e-06 3.57078611e-06] [-2.93384200e-04 -2.97986219e-05 2.40377724e-04] [ 2.00425377e-04 -2.24953310e-04 1.61457111e-04] [ 2.22998499e-04 3.69526554e-04 1.90643007e-04] [ 2.93368362e-04 1.92218053e-05 -2.39519116e-04] [-1.91257878e-04 2.30255340e-04 -1.60607081e-04] [-2.32151210e-04 -3.64251653e-04 -1.89776016e-04] [-8.39677306e-05 -1.32983123e-05 3.20535856e-05] [-8.68924734e-06 -1.81111406e-05 -2.36170555e-05] [ 8.39611356e-05 1.32981767e-05 -3.18455623e-05] [ 8.69623603e-06 1.81111495e-05 2.34983410e-05] [-4.59202022e-05 -3.08803424e-05 -1.84511072e-05] [ 1.74034794e-04 1.39027129e-05 3.09626572e-05] [ 4.59247240e-05 3.08799375e-05 1.82965744e-05] [-1.74039048e-04 -1.39028329e-05 -3.08924142e-05]] Final stress: [ 1.66002420e-05 1.22015176e-05 1.46808316e-05 1.51395749e-06 1.62838132e-04 -1.86892292e-04] Minimization converged after 174 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 3.86218767e-03 -8.91947805e-04 -3.48176199e-04] [-3.86231023e-03 8.91977397e-04 -2.83905241e-04] [-3.86245413e-03 8.91988902e-04 3.46929639e-04] [ 3.86239853e-03 -8.92120966e-04 2.90195579e-04] [-1.65519586e-08 4.02763715e-06 -1.49043915e-07] [-3.32258717e-06 -1.94376141e-06 -3.02215510e-07] [ 3.30685448e-06 -1.96005221e-06 -3.21569895e-07] [-4.89238921e-08 -1.18248625e-05 1.98853367e-06] [ 1.01896391e-05 5.99766439e-06 1.98658118e-06] [-9.92828658e-06 5.78555587e-06 1.82778478e-06] [-9.29247111e-03 -9.34230264e-04 -1.23050784e-05] [ 9.10355212e-03 -2.12157566e-02 -1.22144987e-05] [ 7.84250368e-03 1.42703470e-02 -1.24700116e-05] [ 9.29245200e-03 9.35095316e-04 9.55332302e-06] [-9.10428064e-03 2.12153760e-02 9.51059617e-06] [-7.84168502e-03 -1.42708133e-02 9.46065557e-06] [-1.66037783e-03 2.02588955e-03 -1.09638496e-03] [ 1.66048400e-03 -2.02591094e-03 -1.09492132e-03] [ 1.66038991e-03 -2.02591369e-03 1.09604705e-03] [-1.66049185e-03 2.02594786e-03 1.09462431e-03] [ 1.22105430e-03 -8.35836874e-05 2.14016693e-03] [-1.22099572e-03 8.35530566e-05 2.14116095e-03] [-1.22116400e-03 8.35721923e-05 -2.14075540e-03] [ 1.22102819e-03 -8.35522561e-05 -2.14154639e-03]] Final stress: [-4.17658421e-04 -8.51394280e-05 -2.28983073e-04 3.86643007e-10 4.51765200e-09 -1.72920479e-04] Minimization converged after 30 steps. Minimization converged after 27 steps. Minimization converged after 9 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 10 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 4.47591963e-11 2.79517409e-05 -2.16673181e-05] [ 2.82477769e-10 -2.79519178e-05 -2.16675786e-05] [ 1.98377388e-10 -2.79528140e-05 2.16871594e-05] [ 2.67250000e-10 2.79526732e-05 2.16800313e-05] [ 8.77810595e-10 -6.67675754e-09 -1.56230595e-09] [ 3.10284820e-09 1.94508647e-09 -1.19414867e-10] [-4.82083423e-09 3.95543515e-09 -1.21915122e-09] [ 4.15143246e-10 2.53453454e-08 -8.47898018e-09] [-1.96182789e-08 -1.26130226e-08 -7.52447016e-09] [ 1.87243523e-08 -1.16230615e-08 -6.88780248e-09] [-1.66572534e-10 -3.95083572e-05 -1.92685583e-09] [ 2.88763822e-05 -3.95023770e-05 -1.68726733e-09] [-2.88761700e-05 -3.95026941e-05 -1.64972710e-09] [-4.71494011e-10 3.94694411e-05 -6.85488015e-10] [-2.88420930e-05 3.95225212e-05 -3.37021395e-10] [ 2.88428245e-05 3.95215556e-05 -4.49511471e-10] [ 1.00568831e-10 -3.68547270e-05 -4.02396320e-06] [ 4.50932069e-11 3.68546832e-05 -4.02469741e-06] [ 1.09182274e-10 3.68549059e-05 4.02469561e-06] [ 4.86226059e-11 -3.68549462e-05 4.02379506e-06] [-3.99402733e-12 2.21975212e-05 3.76824258e-05] [-4.00093620e-11 -2.21975324e-05 3.76824888e-05] [-3.51260258e-11 -2.21975652e-05 -3.76822312e-05] [-3.83576504e-12 2.21975555e-05 -3.76822794e-05]] Final stress: [ 1.39626061e-04 3.03426137e-05 -1.11445147e-04 -1.00845739e-13 -3.92267625e-13 1.61159723e-13] Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-8.34009001e-10 -1.44859199e-05 4.66697954e-06] [-6.88487650e-10 1.44865170e-05 5.27424651e-06] [-1.01420092e-09 1.44875016e-05 -5.45659846e-06] [-8.55989724e-11 -1.44861528e-05 -5.23455099e-06] [-3.97782214e-10 -3.18797308e-08 -7.66174829e-09] [ 2.69935407e-08 1.61744075e-08 -7.41113462e-09] [-2.62934539e-08 1.53119435e-08 -6.99971173e-09] [-1.42002046e-09 -6.02165831e-07 1.89023726e-07] [ 5.19653682e-07 3.01972555e-07 1.88040646e-07] [-5.16658563e-07 2.98599381e-07 1.85936173e-07] [-1.47726414e-09 1.30417430e-05 7.89758502e-11] [ 3.88675856e-06 2.14368371e-05 -5.28883751e-10] [-3.88403746e-06 2.14335605e-05 -3.91405046e-10] [-4.48829918e-10 -1.32210456e-05 6.86605813e-08] [-3.73048618e-06 -2.13452922e-05 6.89421772e-08] [ 3.73132696e-06 -2.13462908e-05 6.86206376e-08] [-4.50238735e-11 3.47270978e-05 -5.13815994e-06] [-1.77390935e-10 -3.47269080e-05 -5.13660264e-06] [-3.69172470e-11 -3.47270392e-05 5.14492061e-06] [-1.48437318e-10 3.47272757e-05 5.13762334e-06] [-1.99336769e-10 -2.34556012e-05 3.60908796e-05] [-4.94440495e-11 2.34556441e-05 3.61013080e-05] [-7.62519644e-11 2.34556503e-05 -3.61001547e-05] [-1.58089042e-10 -2.34555900e-05 -3.60962008e-05]] Final stress: [-3.92167153e-04 -2.77349110e-04 -3.90507836e-04 -1.83878275e-12 -1.20654644e-12 -4.24932273e-13] Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-1.53526942e-04 -2.01543503e-04 -2.77358172e-04] [-1.60151366e-04 1.14367585e-03 3.58429633e-04] [ 8.71659319e-05 -3.82250398e-04 -3.56450892e-04] [-8.43942825e-06 1.01471812e-03 4.09958602e-04] [ 6.07349869e-05 -7.54902898e-04 8.40037254e-04] [ 4.17212243e-04 -5.60583128e-04 5.99212187e-04] [-5.15686753e-04 -2.04843743e-04 6.25388291e-04] [-9.43708007e-05 7.53160838e-04 7.85157088e-05] [ 1.44845855e-04 1.04290529e-03 -2.55989112e-04] [ 8.11421405e-05 1.08764053e-03 -4.76585130e-04] [-1.34825494e-06 8.67297558e-05 9.08874599e-04] [ 6.96127278e-04 -8.89068817e-04 -1.03647243e-03] [-6.85460450e-04 -6.03538312e-04 -6.61190592e-04] [-1.36635507e-04 8.71769893e-05 1.02269067e-03] [ 8.55581264e-04 -8.24899910e-04 -7.49010620e-04] [-6.10958232e-04 -7.83605806e-04 -7.96089850e-04] [ 1.08033573e-06 -6.29753063e-05 9.38028538e-05] [ 4.49436986e-06 2.27435765e-04 -1.54276074e-04] [ 2.09702123e-05 -6.36838401e-05 -2.13203297e-04] [ 2.04347604e-05 2.58118095e-04 1.46603756e-04] [-1.52903716e-05 -2.69923099e-04 3.54696583e-05] [-1.32581055e-05 7.99878055e-05 -3.93657261e-05] [-1.27990493e-05 -2.90059403e-04 -1.26935549e-04] [ 1.81358829e-05 1.10329130e-04 2.39442244e-05]] Final stress: [-9.08447992e-05 4.01874287e-05 -1.04006547e-04 1.44435920e-04 -1.13348875e-06 1.21863876e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 1.82819610e-08 9.91617004e-06 7.04699851e-06] [-9.02426265e-08 1.35125380e-07 -5.96020935e-06] [-7.57761858e-08 -9.92851013e-06 5.65770500e-06] [-8.09867979e-08 -2.55208795e-07 -1.80472529e-06] [-4.48000888e-08 -9.56777239e-06 -1.43598269e-06] [ 8.57704185e-06 4.89607504e-06 -1.60032138e-06] [-8.44450523e-06 4.76761690e-06 -1.47572830e-06] [ 3.95911731e-09 -7.65058424e-06 5.35574580e-07] [ 6.72814248e-06 3.83980814e-06 5.81702536e-07] [-6.72992711e-06 3.84563495e-06 5.77540971e-07] [-2.03398304e-07 1.43708956e-05 3.96725786e-06] [-1.93986418e-05 -1.45152840e-05 -6.31256331e-06] [ 1.97652866e-05 -1.49618450e-05 -6.32432971e-06] [-5.47862453e-08 2.97115527e-05 -4.58251474e-06] [-1.84836439e-05 -7.22110137e-06 5.61310818e-06] [ 1.85843481e-05 -7.34223239e-06 5.69366632e-06] [-3.28328781e-09 -2.86966654e-06 -5.15872207e-05] [ 3.66905650e-09 2.98835290e-05 -5.14298070e-05] [-8.41181336e-09 2.84028919e-06 5.08666690e-05] [ 1.27616298e-09 -2.98738393e-05 5.20471817e-05] [-2.23888392e-08 -2.62841962e-05 -6.56403192e-06] [-8.02788194e-09 4.51291689e-05 -8.75808598e-06] [-7.10523909e-09 2.62872427e-05 6.06190550e-06] [-2.60800957e-08 -4.51528682e-05 9.18621015e-06]] Final stress: [-2.54993608e-04 -1.38667900e-04 -1.24549818e-04 -1.00588130e-04 2.42712308e-10 -6.63224895e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-1.17883272e-08 2.23588693e-06 2.53824950e-05] [ 2.64601325e-08 -1.58493985e-05 -2.43353803e-05] [-3.78670358e-08 -2.58183039e-06 1.59811521e-05] [ 6.78812479e-08 1.57540226e-05 -1.12582553e-05] [ 1.28892115e-07 6.31635511e-06 3.99241941e-06] [-5.21229985e-06 -3.23044798e-06 3.90744884e-06] [ 4.94119884e-06 -2.92516726e-06 3.71843274e-06] [ 3.37415408e-08 8.24156038e-06 -5.18401559e-06] [-6.29635656e-06 -3.97209383e-06 -4.75603710e-06] [ 6.25163953e-06 -3.90771120e-06 -4.74696815e-06] [-1.26870272e-07 2.33840767e-05 -1.41528660e-05] [-3.22330712e-05 -2.09899847e-05 -1.61593049e-06] [ 3.24472154e-05 -2.12601783e-05 -1.64014923e-06] [-2.88967719e-08 4.67316708e-05 1.32885959e-05] [-2.84667205e-05 -1.38839661e-05 8.65361777e-07] [ 2.85059428e-05 -1.39397232e-05 8.24399191e-07] [ 1.66285972e-08 -2.97006433e-05 -5.32158793e-05] [ 2.23363966e-09 -9.61872564e-07 -4.93514766e-05] [ 1.64082065e-08 2.96930945e-05 5.20742642e-05] [ 3.84579421e-09 8.67397994e-07 5.03563683e-05] [-1.42475574e-08 -4.57404546e-05 -7.94380226e-06] [-7.91714970e-11 2.64334839e-05 -6.72783859e-06] [-3.04716692e-09 4.57066203e-05 7.66643631e-06] [-1.08433342e-08 -2.64206972e-05 6.87122512e-06]] Final stress: [-2.55069773e-04 -1.38574958e-04 -1.24559221e-04 1.00787652e-04 -4.35004221e-11 -4.42641791e-11] Minimization converged after 43 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 7.24969663e-05 7.15807542e-05 2.51815873e-04] [ 7.16690859e-05 -7.15111147e-05 -3.03630537e-04] [-7.28552940e-05 -7.13966772e-05 6.08843447e-05] [-7.23544754e-05 7.11515222e-05 6.63950252e-05] [-1.20878232e-07 6.95536378e-05 3.43533991e-05] [-5.93580733e-05 -3.44718166e-05 3.37075278e-05] [ 5.97415054e-05 -3.48318992e-05 3.41907974e-05] [-5.38383205e-07 1.78526082e-04 -5.95048564e-05] [-1.54888651e-04 -8.88463256e-05 -5.94980003e-05] [ 1.55920295e-04 -9.00630598e-05 -5.99044159e-05] [-9.03955477e-07 6.91677049e-05 4.97190014e-05] [-1.64719710e-04 -8.48907897e-05 4.75104639e-05] [ 1.66637940e-04 -8.70387107e-05 5.19819795e-05] [ 2.14713102e-07 2.54470294e-04 -5.06396514e-05] [-1.14660559e-04 -7.60493766e-05 -4.87683767e-05] [ 1.14049837e-04 -7.54505001e-05 -5.28466071e-05] [ 5.65535781e-05 -7.13763627e-05 -2.70570991e-04] [ 5.66543906e-05 7.13610726e-05 -2.72036062e-04] [-5.66899795e-05 7.13457981e-05 2.65960478e-04] [-5.66686692e-05 -7.12847270e-05 2.77413849e-04] [ 3.03758876e-05 -1.33374172e-04 -1.72186389e-05] [ 3.04322755e-05 1.33368122e-04 -2.33747882e-05] [-3.03685659e-05 1.33455354e-04 2.03870912e-05] [-3.06192804e-05 -1.33394809e-04 2.36730933e-05]] Final stress: [-2.54249575e-04 -1.55569489e-04 -1.15395007e-04 -1.49022477e-09 -1.10992166e-04 -7.78405204e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-7.55234590e-06 1.14313621e-05 1.21975978e-04] [-7.31325484e-06 -1.14991205e-05 -3.86079287e-05] [ 7.23327758e-06 -1.14453182e-05 1.14549271e-04] [ 7.49015864e-06 1.14526549e-05 -5.08256044e-05] [ 5.68094557e-08 1.98998137e-05 1.24545068e-05] [-1.72184631e-05 -1.00045139e-05 1.24664860e-05] [ 1.70814906e-05 -9.86007203e-06 1.23212002e-05] [-2.60480813e-07 1.86401664e-04 -5.55082635e-05] [-1.61172008e-04 -9.28964445e-05 -5.50906339e-05] [ 1.61732450e-04 -9.35205639e-05 -5.57230290e-05] [ 4.26994539e-08 3.05250023e-05 -4.08342825e-06] [-3.67722736e-05 -4.32224383e-05 1.44085206e-05] [ 3.67236602e-05 -4.31452956e-05 -2.26643289e-05] [ 6.28714454e-08 9.04978295e-05 -3.27246526e-06] [-6.81729582e-05 -1.73845709e-05 -2.16897779e-05] [ 6.80841981e-05 -1.72607007e-05 1.51956487e-05] [-4.72307885e-05 -6.31354900e-05 -1.89077076e-04] [-4.73076001e-05 6.31210764e-05 -1.87124434e-04] [ 4.72840597e-05 6.31369669e-05 1.87221556e-04] [ 4.72067065e-05 -6.31453209e-05 1.89064104e-04] [-7.69365976e-06 -9.00718247e-05 5.94426771e-05] [-7.64717193e-06 9.00973401e-05 5.74778165e-05] [ 7.65057174e-06 9.01318179e-05 -5.54325119e-05] [ 7.69205106e-06 -9.01038534e-05 -5.74782834e-05]] Final stress: [-2.54060815e-04 -1.45609018e-04 -1.19736183e-04 -2.03839599e-10 1.06497107e-04 -1.14517251e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 1.71823518e-04 7.94679241e-04 -2.95319337e-04] [-1.78363237e-04 -7.87700210e-04 1.23001283e-04] [-1.80744632e-04 -7.97422449e-04 1.19729640e-05] [ 1.76216975e-04 7.95140761e-04 1.89144484e-04] [-1.25654757e-06 -1.95831521e-04 -6.46268027e-05] [ 1.63919450e-04 9.68298937e-05 -6.10177896e-05] [-1.61803067e-04 9.40985997e-05 -5.76712897e-05] [-6.96203817e-06 -1.47287836e-04 4.42616717e-05] [ 1.25519725e-04 8.11036268e-05 4.99912291e-05] [-1.11099287e-04 6.46291759e-05 3.81337158e-05] [ 2.28100826e-03 3.59846117e-04 -2.41138467e-05] [-1.27703928e-03 2.06070090e-03 -1.55224177e-05] [-5.60965634e-04 -4.98633313e-04 -1.52310062e-05] [-2.28064372e-03 -7.41394058e-04 2.52146934e-05] [ 1.60283421e-03 -1.87023900e-03 2.63942499e-05] [ 2.37612904e-04 6.88037727e-04 2.40708299e-05] [-3.18254917e-04 3.03390867e-05 -8.37742508e-04] [ 3.17500973e-04 -2.90284889e-05 -8.41389902e-04] [ 3.18606204e-04 -2.92275554e-05 8.45002971e-04] [-3.18727184e-04 2.99016299e-05 8.35587145e-04] [-1.82733858e-04 1.34138402e-04 -4.48141092e-04] [ 1.83073413e-04 -1.33490804e-04 -4.42324895e-04] [ 1.83331520e-04 -1.33656326e-04 4.44074688e-04] [-1.82853753e-04 1.34466400e-04 4.46250960e-04]] Final stress: [-6.72259755e-05 -1.18906850e-04 -3.94980330e-05 2.35765516e-08 -1.45412006e-08 4.01329870e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 1.89621589e-05 1.01261610e-04 7.19842547e-05] [-1.54775533e-05 -1.01756734e-04 2.88657730e-05] [-1.31286259e-05 -1.01074744e-04 -9.96913073e-05] [ 1.52473823e-05 1.01027108e-04 -6.69323260e-05] [ 3.99559746e-07 -1.63218431e-05 3.31424806e-06] [ 1.31994014e-05 7.85904166e-06 3.13822583e-06] [-1.36831536e-05 8.58845322e-06 2.98611092e-06] [ 3.42457185e-06 1.20712097e-06 6.51347986e-07] [-5.88914340e-06 -5.23770897e-06 -3.04310608e-06] [-2.52325096e-06 3.69641139e-06 3.90316806e-06] [-1.30150488e-03 3.37071582e-05 1.53663847e-05] [ 3.31055995e-04 -5.33872461e-04 1.43512018e-05] [ 6.49380038e-04 9.19929770e-04 1.52547588e-05] [ 1.30196168e-03 -5.82259517e-05 1.50587492e-06] [-3.09944408e-04 5.45525695e-04 1.59226211e-07] [-6.72485897e-04 -9.06568469e-04 2.44299066e-06] [ 1.41053109e-04 5.45863486e-05 -9.10007777e-05] [-1.40671567e-04 -5.44563828e-05 -9.27417327e-05] [-1.41216206e-04 -5.44465584e-05 9.34274032e-05] [ 1.41603583e-04 5.45433296e-05 9.34789136e-05] [ 5.73450220e-06 1.37063471e-04 -7.86779043e-05] [-5.62844723e-06 -1.37047352e-04 -7.82791171e-05] [-5.48591157e-06 -1.36946140e-04 7.89863981e-05] [ 5.61706287e-06 1.36958827e-04 8.05499908e-05]] Final stress: [-3.81076397e-05 -8.27058934e-05 -6.19335370e-05 9.22214608e-11 1.38340798e-09 -4.29317133e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 3.96848705e-04 -7.37567183e-05 9.90142818e-04] [-3.97411677e-04 6.91499489e-05 -9.54182686e-04] [-3.91498968e-04 4.65562863e-05 -1.49848358e-03] [ 3.89835795e-04 -5.63569058e-05 3.64309429e-04] [-1.28845039e-05 -3.79125620e-04 2.00076704e-06] [ 3.12279327e-04 1.97400777e-04 1.04207271e-05] [-2.89613940e-04 1.69331669e-04 2.68631325e-05] [-4.45664101e-07 1.76871404e-04 4.18999434e-05] [-1.02947185e-04 -7.72780695e-05 6.77811626e-05] [ 9.99205987e-05 -7.59682702e-05 7.36252342e-05] [ 2.47500829e-03 5.87394948e-04 4.62434663e-04] [-1.00466121e-03 7.77672690e-04 4.71861275e-04] [-4.46963239e-04 -1.42740050e-03 4.74338056e-04] [-2.47769335e-03 -1.20294652e-04 -2.20435538e-04] [ 6.15244150e-04 -1.00592947e-03 -2.16599298e-04] [ 8.37017871e-04 1.19576696e-03 -2.13907665e-04] [-1.59194471e-04 2.86555357e-05 -8.43630141e-05] [ 1.59212637e-04 -2.99085026e-05 -1.21165999e-04] [ 1.55370776e-04 -2.53096499e-05 1.01886438e-04] [-1.59208736e-04 2.50786600e-05 1.55050004e-04] [ 1.69927601e-04 -2.34747612e-05 2.02974926e-04] [-1.66924175e-04 2.15415948e-05 1.77866170e-04] [-1.71437369e-04 2.31304086e-05 -1.72965233e-04] [ 1.70218747e-04 -2.37477627e-05 -1.41351732e-04]] Final stress: [-4.38808610e-04 -4.09662465e-04 -3.58104598e-04 -4.42624344e-08 1.21918202e-07 2.40883823e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.01723977e-03 -1.04596801e-03 2.04262806e-03] [ 9.95047852e-04 1.06522516e-03 -1.31511115e-03] [ 9.38679062e-04 1.09617312e-03 -2.20430594e-03] [-9.96022105e-04 -1.08351383e-03 3.84852506e-04] [ 2.76001783e-06 -8.31447966e-04 -2.19844832e-05] [ 7.58455184e-04 4.22188406e-04 -3.19570401e-05] [-7.61772335e-04 4.27157709e-04 -4.43591512e-05] [-7.53825654e-05 5.14105610e-04 7.15139304e-07] [-4.64690652e-04 -1.92169088e-04 4.25218469e-06] [ 6.18603627e-04 -3.67322459e-04 -1.08054520e-04] [-3.88873664e-03 2.07834378e-03 7.25100884e-04] [ 4.25228268e-04 -3.08604797e-03 7.33474670e-04] [ 1.96252399e-03 9.84274355e-04 7.00757954e-04] [ 3.87874790e-03 -9.10124156e-04 -3.42136986e-04] [-1.45004120e-03 2.51252907e-03 -3.62120106e-04] [-9.02135537e-04 -1.58962676e-03 -3.54229365e-04] [-2.82873178e-04 -4.27668463e-04 4.41945865e-04] [ 2.74095587e-04 4.28848819e-04 3.89935190e-04] [ 2.85998315e-04 4.24140526e-04 -4.20319680e-04] [-2.91876642e-04 -4.21125267e-04 -3.32289845e-04] [-2.46143106e-04 -1.26778885e-04 1.26936710e-03] [ 2.38457855e-04 1.25946091e-04 1.23524269e-03] [ 2.46869568e-04 1.31307780e-04 -1.22255085e-03] [-2.48553498e-04 -1.28447575e-04 -1.16885313e-03]] Final stress: [-4.20608662e-04 -3.90501598e-04 -4.09606610e-04 -6.75774014e-08 -8.45911578e-08 -2.50631932e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.08560966e-10 -3.78351502e-05 2.70665620e-05] [ 5.84456226e-11 3.78351962e-05 2.70870693e-05] [-1.16526149e-10 3.78352715e-05 -2.70710562e-05] [ 1.16812282e-10 -3.78349147e-05 -2.70886626e-05] [ 1.97295154e-11 -2.21046909e-09 -3.03928660e-10] [ 1.32968479e-09 9.22700791e-10 8.19417589e-11] [-1.48617429e-09 1.04043713e-09 -1.09867893e-10] [-2.17343944e-10 -4.34587699e-09 1.50790902e-09] [ 3.88884291e-09 2.42002474e-09 1.63783420e-09] [-3.41263912e-09 1.89359395e-09 1.29054118e-09] [-3.68457487e-11 1.48062964e-04 -3.02834653e-09] [-4.08495815e-05 -3.63332840e-06 -3.15190085e-09] [ 4.08496431e-05 -3.63341078e-06 -3.19518411e-09] [ 1.01395337e-10 -1.48058293e-04 3.61456534e-09] [ 4.08447914e-05 3.63080362e-06 3.80134916e-09] [-4.08449598e-05 3.63101872e-06 3.70323624e-09] [ 3.49334450e-12 3.82390386e-05 -2.28555634e-05] [-2.95455327e-11 -3.82390254e-05 -2.28550356e-05] [ 4.62779814e-12 -3.82390016e-05 2.28555219e-05] [-2.62093125e-11 3.82390389e-05 2.28551682e-05] [-1.07734377e-11 -6.28757881e-05 9.42112763e-05] [ 1.86957153e-11 6.28758194e-05 9.42116887e-05] [ 5.49178010e-12 6.28758145e-05 -9.42112937e-05] [ 4.13502566e-12 -6.28757734e-05 -9.42115231e-05]] Final stress: [ 3.18489676e-04 5.50049050e-04 2.87779385e-04 -8.43813190e-13 -1.44608728e-13 -8.13940260e-14] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.40836109e-10 9.67194784e-06 -1.35792250e-04] [ 1.28016257e-10 -9.67374849e-06 -1.37336186e-04] [-1.02580898e-10 -9.67398819e-06 1.38817786e-04] [ 6.76370376e-10 9.67390489e-06 1.37105692e-04] [ 1.00161466e-09 1.11479479e-07 3.47209940e-08] [-9.94405399e-08 -5.71918479e-08 3.60073818e-08] [ 9.73761920e-08 -5.48494873e-08 3.46185776e-08] [-1.17639618e-09 2.26705464e-06 -7.13391889e-07] [-1.95962018e-06 -1.13147955e-06 -7.10334360e-07] [ 1.96171451e-06 -1.13404793e-06 -7.11483414e-07] [-1.42597767e-10 -1.60665453e-04 -1.40574587e-07] [ 6.68738584e-05 1.03806278e-04 -1.41186940e-07] [-6.68736552e-05 1.03805992e-04 -1.40639890e-07] [ 3.81427390e-10 1.61464949e-04 -1.11518815e-07] [-6.75627339e-05 -1.04205595e-04 -1.10104958e-07] [ 6.75620313e-05 -1.04204747e-04 -1.10414127e-07] [ 9.27058985e-11 4.82510076e-05 2.42000688e-05] [-1.52057644e-10 -4.82512317e-05 2.42145609e-05] [ 1.22916954e-10 -4.82507446e-05 -2.42266052e-05] [-1.12830439e-10 4.82506634e-05 -2.42159906e-05] [-2.55134247e-11 -2.72493448e-05 -7.50067886e-05] [ 5.88262084e-11 2.72492158e-05 -7.50312743e-05] [ 4.65088170e-11 2.72493567e-05 7.50413104e-05] [ 1.38107858e-11 -2.72494282e-05 7.50139789e-05]] Final stress: [ 3.05468549e-04 4.20138534e-04 4.11628016e-04 -4.79882157e-12 -2.26162779e-12 -2.67147610e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.44098428e-10 -2.02860327e-05 -9.95520496e-06] [-4.56977766e-11 2.02860070e-05 -9.93626253e-06] [ 1.73873564e-10 2.02864849e-05 9.99415745e-06] [-4.06821687e-10 -2.02862104e-05 9.93352077e-06] [ 1.90740777e-11 -2.16043874e-08 -3.44644491e-09] [ 1.85090202e-08 1.08628954e-08 -3.66592628e-09] [-1.82666115e-08 1.07260263e-08 -3.28178515e-09] [ 2.71216417e-10 2.46640859e-08 -8.22851753e-09] [-2.04967251e-08 -1.25256330e-08 -8.18369206e-09] [ 2.00508388e-08 -1.19496830e-08 -7.95868385e-09] [ 2.18701890e-10 1.28019929e-05 -7.19698960e-09] [ 1.42740032e-06 6.09988704e-05 -7.84517513e-09] [-1.42778612e-06 6.09993416e-05 -7.76066990e-09] [-6.57928101e-10 -1.27694168e-05 6.87946916e-09] [-1.45681316e-06 -6.10148989e-05 6.48267309e-09] [ 1.45803773e-06 -6.10163776e-05 6.61437662e-09] [-3.05888648e-12 4.54928079e-05 -5.16922716e-06] [ 4.34405290e-11 -4.54928618e-05 -5.16787975e-06] [ 4.06297218e-12 -4.54928114e-05 5.16890314e-06] [ 3.24283378e-11 4.54927791e-05 5.16841491e-06] [ 2.21668239e-11 -2.07312689e-05 3.48398931e-05] [-9.16577682e-11 2.07313411e-05 3.48408962e-05] [-7.76980100e-11 2.07313571e-05 -3.48396425e-05] [ 6.70469236e-12 -2.07312770e-05 -3.48399772e-05]] Final stress: [ 3.03271443e-05 1.39503053e-04 -1.11354618e-04 -7.83491133e-13 1.26621881e-13 3.55764869e-13] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.37246173e-09 8.81186314e-06 -3.51546378e-06] [-8.69568656e-10 -8.81122244e-06 -2.81347552e-06] [-1.82149252e-09 -8.81250565e-06 4.40462088e-06] [-7.53245188e-10 8.81377346e-06 5.18201659e-06] [-1.69990130e-09 -1.26640716e-06 -4.47844291e-07] [ 1.09333237e-06 6.34127193e-07 -4.46910351e-07] [-1.08980845e-06 6.30129424e-07 -4.44498949e-07] [-2.59017463e-09 1.36350261e-06 -3.58996894e-07] [-1.17528231e-06 -6.78096438e-07 -3.56038545e-07] [ 1.18101150e-06 -6.84395565e-07 -3.60273427e-07] [-7.85095156e-10 -1.86811239e-05 -1.33508008e-07] [ 8.78972300e-06 -2.81301473e-05 -1.33035652e-07] [-8.78798796e-06 -2.81320578e-05 -1.33628554e-07] [ 7.11515291e-11 1.68403614e-05 -1.47435373e-07] [-7.20018814e-06 2.90508058e-05 -1.46562805e-07] [ 7.20040929e-06 2.90507670e-05 -1.46793860e-07] [-1.65303021e-10 -2.90109876e-05 -6.66482020e-06] [-3.08127579e-10 2.90111562e-05 -6.69423119e-06] [-1.87914739e-10 2.90113336e-05 6.67872209e-06] [-3.14771820e-10 -2.90111135e-05 6.65105142e-06] [-1.64178282e-10 2.16633681e-05 3.03419202e-05] [-3.60385268e-11 -2.16632591e-05 3.03308276e-05] [-7.44290466e-11 -2.16634899e-05 -3.03179061e-05] [-1.37761191e-10 2.16636185e-05 -3.03277353e-05]] Final stress: [-2.77726129e-04 -3.92012347e-04 -3.90321858e-04 -1.73808333e-12 9.56680450e-13 -4.04709521e-13] Minimization converged after 57 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-3.74914114e-07 3.85137695e-04 2.21266558e-04] [ 8.58922216e-07 -7.54485701e-04 3.70380050e-04] [ 1.21420295e-07 -3.84363707e-04 -1.00159547e-04] [ 8.46003917e-07 7.53962464e-04 -1.87586928e-04] [ 1.42138581e-06 -4.63204169e-05 -2.59954192e-05] [ 3.83363459e-05 2.15496989e-05 -2.50151308e-05] [-4.14884078e-05 2.49965498e-05 -2.73321397e-05] [-2.10388163e-07 1.38503483e-04 -4.05233695e-05] [-1.20804179e-04 -6.93541561e-05 -4.05334208e-05] [ 1.21287509e-04 -6.98760069e-05 -4.09089411e-05] [ 5.07025230e-07 -2.10491402e-04 -1.69307026e-04] [-6.11209256e-04 3.40754539e-04 -5.59401063e-04] [ 6.10204608e-04 3.41910645e-04 -5.59483841e-04] [-2.35029078e-07 3.15842260e-05 1.37056008e-04] [ 7.66718965e-04 -2.51589630e-04 5.26786011e-04] [-7.66403140e-04 -2.52039914e-04 5.26174617e-04] [ 1.62727822e-07 1.76688041e-05 5.31586870e-04] [-4.51742926e-08 -4.87397730e-04 6.28734734e-04] [ 1.91904730e-07 -1.77537270e-05 -5.31108432e-04] [-3.16406788e-08 4.87406470e-04 -6.33692153e-04] [ 5.00712878e-08 -3.69079707e-05 -5.76374020e-04] [ 1.67615807e-08 6.64120044e-05 -6.37833932e-04] [-2.69527469e-08 3.72043731e-05 5.78127615e-04] [ 1.05430304e-07 -6.65105899e-05 6.35142899e-04]] Final stress: [ 1.84778245e-04 2.39034748e-04 1.23333267e-04 9.71065206e-05 -1.40734289e-09 3.23834990e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-4.89261069e-08 -1.96217192e-05 5.53821045e-06] [ 5.30297735e-08 6.43721959e-05 5.90436241e-06] [-3.67730758e-10 1.94451016e-05 -9.56437846e-06] [-3.90522511e-08 -6.42408912e-05 2.60553724e-05] [ 2.12347343e-09 -1.47559255e-05 -5.78808437e-06] [ 1.24963961e-05 7.31134067e-06 -5.63445868e-06] [-1.25045599e-05 7.31862316e-06 -5.64409472e-06] [ 3.78813122e-09 4.31945805e-06 -7.87262947e-07] [-3.40611085e-06 -2.07999243e-06 -5.96928290e-07] [ 3.42699220e-06 -2.08760539e-06 -6.34148370e-07] [ 9.20388498e-08 3.48306981e-05 1.17373430e-05] [ 8.94992218e-06 6.81624252e-05 -3.27795275e-05] [-9.11082381e-06 6.83615737e-05 -3.28299812e-05] [-1.13081372e-07 -6.19258543e-05 -1.46400233e-05] [ 1.45873230e-05 -5.45782538e-05 3.00122884e-05] [-1.43826695e-05 -5.48267579e-05 3.00089497e-05] [ 1.41888662e-09 1.76211614e-04 -2.50293943e-04] [ 1.39593437e-09 -5.58522973e-05 -2.45356008e-04] [ 1.49667978e-09 -1.76175086e-04 2.50520173e-04] [-2.39756087e-09 5.58200342e-05 2.44765134e-04] [ 9.25056243e-09 1.42967009e-04 4.01229070e-05] [-1.22724630e-08 -8.51076264e-05 5.96044953e-05] [-1.46218609e-08 -1.42989573e-04 -4.00895097e-05] [ 9.70765851e-09 8.51215097e-05 -5.96308869e-05]] Final stress: [-1.50201316e-04 -2.54273400e-04 -1.17470675e-04 -1.09092124e-04 1.25539886e-10 9.37586058e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.96394535e-07 -6.21474054e-05 -6.00002917e-05] [-2.51102330e-07 -2.27313113e-05 1.20183368e-04] [-1.48673171e-07 6.28191788e-05 -1.35965846e-05] [-2.58322871e-07 2.24844190e-05 1.27450069e-04] [-3.87010503e-07 -8.87505599e-05 -3.80152420e-05] [ 7.76333413e-05 4.48690434e-05 -3.87016860e-05] [-7.67750601e-05 4.39268285e-05 -3.80644984e-05] [-2.23040475e-07 2.44186341e-05 -4.14212882e-07] [-2.25263190e-05 -1.22654628e-05 -9.85210752e-07] [ 2.30370574e-05 -1.28207935e-05 -1.37640265e-06] [-1.07456462e-07 -7.53449284e-05 -5.15892993e-05] [ 1.07954975e-04 2.32029321e-04 3.82375787e-05] [-1.07709937e-04 2.31762877e-04 3.82803235e-05] [-1.89579308e-07 -2.16669309e-04 3.37163911e-05] [ 1.44443834e-04 -8.56873157e-05 -5.63620398e-05] [-1.44053331e-04 -8.61319578e-05 -5.63631028e-05] [-4.54046423e-08 1.91824609e-04 -3.45328818e-04] [-2.43351542e-08 -4.02443117e-04 -3.57854834e-04] [-4.28897165e-08 -1.91942806e-04 3.48656993e-04] [-2.33525175e-08 4.02755420e-04 3.52152470e-04] [-2.08242262e-08 1.01302835e-04 -1.08375086e-04] [-3.35767237e-08 -2.41489512e-04 -1.46984470e-04] [-2.90690927e-08 -1.01231046e-04 1.09048703e-04] [-2.35278096e-08 2.41462358e-04 1.46285883e-04]] Final stress: [-1.68314675e-04 -2.55313734e-04 -1.12027328e-04 1.16447816e-04 -1.15744534e-10 3.87836187e-11] Minimization converged after 48 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-3.15035212e-04 -1.48643374e-03 -2.03677871e-04] [ 3.15035220e-04 1.48643372e-03 -2.03667667e-04] [ 3.15035544e-04 1.48643351e-03 2.03686818e-04] [-3.15035455e-04 -1.48643383e-03 2.03659839e-04] [-5.54607467e-11 2.90913377e-09 1.17678761e-09] [-1.77835219e-09 -1.26700696e-09 8.58454752e-10] [ 2.01755146e-09 -1.46131252e-09 1.11650567e-09] [ 1.22576539e-10 1.40678447e-09 -1.03796816e-09] [-9.72804393e-10 -8.25269519e-10 -1.01163877e-09] [ 6.09107542e-10 -4.17554158e-10 -6.88581636e-10] [-6.25547029e-04 2.28462659e-04 -3.68354698e-09] [ 2.56297888e-04 -3.28801072e-04 -3.57546675e-09] [-7.34528919e-04 -7.75294836e-04 -3.35765921e-09] [ 6.25546981e-04 -2.28446666e-04 3.13133230e-09] [-2.56311431e-04 3.28793076e-04 3.01326390e-09] [ 7.34542445e-04 7.75286971e-04 3.13143959e-09] [-2.60345100e-04 3.01636067e-05 2.46790088e-04] [ 2.60345100e-04 -3.01636414e-05 2.46790769e-04] [ 2.60345074e-04 -3.01636614e-05 -2.46790391e-04] [-2.60345056e-04 3.01635946e-05 -2.46790560e-04] [-1.80091231e-05 -1.01484702e-04 -1.48849813e-05] [ 1.80091222e-05 1.01484695e-04 -1.48846447e-05] [ 1.80091442e-05 1.01484683e-04 1.48849087e-05] [-1.80091365e-05 -1.01484706e-04 1.48846186e-05]] Final stress: [ 1.70127846e-04 2.61651753e-04 1.28185876e-04 9.86584852e-13 -5.37595453e-13 8.31570224e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 3.18686673e-04 -1.51025626e-03 -2.19952116e-04] [-3.18686591e-04 1.51025656e-03 -2.19931492e-04] [-3.18686434e-04 1.51025638e-03 2.19953788e-04] [ 3.18686757e-04 -1.51025606e-03 2.19933461e-04] [ 1.30077266e-10 3.84020155e-09 2.29367358e-10] [-3.87449131e-09 -2.22069106e-09 7.10256354e-10] [ 3.56738622e-09 -1.88426508e-09 4.72825890e-10] [ 1.44037842e-10 -4.91773955e-10 7.82263143e-13] [-5.01860886e-10 -8.19621038e-11 -3.68267639e-10] [ 1.26980426e-10 3.38896078e-10 -6.59536974e-11] [ 6.36378284e-04 2.52451809e-04 -4.46430521e-09] [ 7.52597128e-04 -8.04765502e-04 -4.32640975e-09] [-2.87398637e-04 -3.38518256e-04 -4.18446968e-09] [-6.36378206e-04 -2.52454975e-04 2.83649719e-09] [-7.52595086e-04 8.04766841e-04 3.11638172e-09] [ 2.87396404e-04 3.38519795e-04 3.00706971e-09] [ 2.59852053e-04 2.84709494e-05 2.50045116e-04] [-2.59852028e-04 -2.84709011e-05 2.50045565e-04] [-2.59852028e-04 -2.84709079e-05 -2.50045237e-04] [ 2.59852062e-04 2.84709515e-05 -2.50045725e-04] [ 2.06283665e-05 -1.04235846e-04 -3.27246179e-05] [-2.06283364e-05 1.04235888e-04 -3.27243834e-05] [-2.06283418e-05 1.04235877e-04 3.27245665e-05] [ 2.06283686e-05 -1.04235842e-04 3.27241114e-05]] Final stress: [ 1.69799008e-04 2.61274124e-04 1.28292318e-04 7.70597320e-14 -3.56458540e-13 -8.29074587e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.30885237e-04 -3.69364339e-04 1.72478821e-04] [-1.30885330e-04 3.69364535e-04 1.72496242e-04] [-1.30885401e-04 3.69364648e-04 -1.72429133e-04] [ 1.30885323e-04 -3.69364376e-04 -1.72410906e-04] [ 1.27779321e-10 -5.92140000e-08 -1.96547985e-08] [ 5.09484260e-08 2.94045829e-08 -1.95127111e-08] [-5.11512417e-08 2.96663273e-08 -1.95210378e-08] [-2.21732345e-10 3.23159508e-08 -1.11452684e-08] [-2.83726379e-08 -1.60657011e-08 -1.13974077e-08] [ 2.88050373e-08 -1.65494077e-08 -1.16335181e-08] [-1.01542332e-04 -1.81720907e-04 -6.65325548e-09] [ 3.77484421e-05 -1.18735883e-04 -6.72968394e-09] [-8.30124176e-05 -2.12001450e-04 -6.69180690e-09] [ 1.01542266e-04 1.81711328e-04 -6.84064692e-09] [-3.77403590e-05 1.18740675e-04 -6.83816659e-09] [ 8.30044764e-05 2.12006095e-04 -6.81657118e-09] [-9.54848463e-05 -6.50420886e-05 -8.80402140e-08] [ 9.54848328e-05 6.50421112e-05 -8.82072929e-08] [ 9.54848521e-05 6.50420876e-05 8.73431244e-08] [-9.54848645e-05 -6.50420585e-05 8.71936763e-08] [ 2.43028380e-05 6.15067621e-06 -2.26445240e-04] [-2.43028456e-05 -6.15064573e-06 -2.26444949e-04] [-2.43028674e-05 -6.15065099e-06 2.26445003e-04] [ 2.43028606e-05 6.15068398e-06 2.26445308e-04]] Final stress: [-1.46771633e-04 -2.53565964e-04 -1.25239122e-04 -2.13456672e-13 -4.01667770e-14 1.08687140e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 6.63509915e-04 4.45502843e-04 2.85177787e-04] [-6.47540916e-04 -4.23968984e-04 -1.90446946e-03] [-6.62524756e-04 -4.31135155e-04 -8.31150820e-06] [ 6.40069947e-04 4.40198117e-04 2.06286457e-03] [ 2.75773128e-06 5.60708809e-05 -1.97433166e-05] [-1.03973251e-04 -3.98399504e-05 1.57377163e-08] [ 1.03216795e-04 -3.60473002e-05 4.92507577e-06] [-4.28693580e-06 -1.00073107e-04 -1.99971638e-05] [ 7.56094186e-05 5.01972637e-05 -2.90547274e-05] [-6.81089707e-05 4.10114112e-05 -3.24836921e-05] [ 1.86624835e-03 6.15428842e-04 3.32674107e-04] [-2.89878237e-04 2.04758817e-03 3.42682288e-04] [-9.08086923e-04 -1.55119803e-03 3.29667525e-04] [-1.86786366e-03 -6.47762890e-04 -4.25402046e-04] [ 2.91404095e-04 -2.03517413e-03 -4.48623742e-04] [ 9.10346592e-04 1.55970132e-03 -4.24621192e-04] [ 1.09249997e-04 -1.25723306e-04 -8.04387176e-05] [-1.10995420e-04 1.31156099e-04 -1.32488218e-04] [-1.08647519e-04 1.30020380e-04 7.22296180e-05] [ 1.10372197e-04 -1.29746610e-04 1.21004086e-04] [ 1.76016475e-04 -2.23505860e-05 -1.35871443e-04] [-1.78880963e-04 2.53954321e-05 -1.65804866e-04] [-1.77267851e-04 2.50443656e-05 1.20656563e-04] [ 1.79253892e-04 -2.42950735e-05 1.55412742e-04]] Final stress: [-4.33409546e-04 -5.07843524e-04 -3.22286503e-04 1.09078619e-07 -2.24140602e-08 -3.38028130e-05] Minimization converged after 7 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[-2.32241214e-02 -9.45055822e-03 3.65886927e-02] [-1.30385654e-02 2.87815265e-02 -2.73653148e-02] [-2.89824828e-02 -1.38058628e-02 4.54385871e-02] [-1.60879789e-02 3.56244520e-02 -3.45662917e-02] [ 3.32728796e-02 -8.11779078e-02 -3.94393744e-02] [-9.62653941e-02 -3.64766893e-02 2.70487296e-02] [ 4.60780938e-02 7.57591574e-02 2.50777698e-02] [ 3.51728071e-02 -3.03795973e-02 7.13256990e-02] [-1.86132126e-02 2.11780342e-02 -1.94500270e-02] [ 1.93333707e-02 3.94553004e-02 -6.19185185e-02] [-3.73265166e-02 -1.33575262e-02 5.21938375e-03] [ 1.36685805e-02 3.72767036e-02 -1.34983919e-02] [ 5.91326952e-02 -4.41787595e-02 -4.42859878e-03] [-3.42857390e-02 -1.34711810e-02 9.10007911e-03] [ 1.72555989e-02 2.89356172e-02 -1.73242408e-02] [ 4.80447679e-02 -4.09378082e-02 2.36079892e-03] [ 6.06290220e-03 4.91041502e-03 1.62898307e-02] [ 3.72012641e-03 5.62482799e-03 -2.33086886e-02] [ 5.73653172e-03 2.32606385e-03 -1.42494727e-02] [ 5.15586693e-03 2.21741258e-03 2.03948355e-02] [-8.36520321e-03 -7.96598230e-04 6.90665056e-03] [-4.32718990e-03 9.56581025e-04 -1.99475885e-03] [-7.26730925e-03 2.58203441e-05 -1.16359148e-02] [-4.85050786e-03 9.60576544e-04 3.42853621e-03]] Final stress: [-1.11636503e-04 6.16345409e-05 7.00846430e-05 -1.69454420e-04 3.31145144e-05 5.16177430e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.79260226e-06 1.96409847e-04 3.64864226e-05] [-3.42860316e-06 -2.53928905e-04 -1.17715205e-04] [ 9.73069837e-07 -1.88159510e-04 -5.88625655e-05] [-4.24516649e-06 2.48985294e-04 -2.65867472e-05] [-7.61882697e-06 2.76898544e-04 6.97980784e-05] [-2.26815484e-04 -1.27763929e-04 6.06516871e-05] [ 2.42768834e-04 -1.45770616e-04 7.17486708e-05] [ 4.29575178e-06 2.15712293e-04 -3.11291125e-05] [-2.05363896e-04 -1.16186483e-04 -4.20481232e-05] [ 1.96890091e-04 -1.06331784e-04 -3.65841075e-05] [-1.04324781e-06 -2.49939951e-04 3.07369386e-05] [ 1.62047295e-04 6.13787699e-05 1.07808931e-04] [-1.59909222e-04 5.89267942e-05 1.07855572e-04] [-1.04407375e-06 -1.08529486e-04 -4.20918030e-06] [ 1.48983526e-04 1.19932629e-04 -8.87787523e-05] [-1.46847136e-04 1.17507813e-04 -8.69573173e-05] [-8.69349206e-07 9.95954269e-05 -4.30999701e-05] [ 5.68113290e-07 -1.42915175e-04 -5.92078268e-05] [-9.41574420e-07 -1.00203941e-04 4.94208378e-05] [ 4.97448036e-07 1.44530847e-04 5.66035303e-05] [-5.24314140e-08 -7.15206004e-05 -2.54786198e-04] [-2.60699806e-07 -8.76322150e-05 -2.61397719e-04] [-8.38315952e-08 7.18229595e-05 2.67013814e-04] [-2.93187121e-07 8.71813777e-05 2.53238341e-04]] Final stress: [ 1.31485651e-04 1.63185781e-04 2.79622716e-04 1.06431227e-04 4.67045192e-09 -7.36728082e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 58 steps. Final forces: [[-3.10527120e-05 2.80183449e-04 -2.03178872e-04] [ 4.15783242e-05 3.57407735e-04 3.57118150e-04] [-3.24808593e-05 3.11863738e-04 -1.93644899e-04] [ 3.65820398e-05 4.93078242e-04 2.16538351e-04] [-1.32017860e-04 -4.94406920e-06 1.42155488e-03] [ 6.50389826e-04 -5.42665053e-04 -2.77969479e-04] [-5.90936270e-04 -2.78915138e-04 -2.47925975e-04] [ 1.49743351e-04 -1.71530076e-05 -8.67171773e-04] [ 3.65405382e-04 -2.35838854e-05 -1.30951232e-04] [-3.66435756e-04 -5.23077321e-04 -1.52345478e-04] [-2.05470329e-05 7.07365846e-04 9.70370596e-05] [ 4.39982428e-04 -4.91483609e-04 -2.27640704e-05] [-4.75166890e-04 -1.51750671e-04 2.24873490e-05] [ 2.91581520e-06 7.36565208e-04 2.09872610e-04] [ 6.28886370e-04 -6.91800365e-04 -1.31422990e-04] [-6.84555362e-04 -3.98902187e-04 -7.87174967e-05] [ 2.04646448e-06 8.54221503e-05 2.27821679e-04] [-1.93563433e-06 9.40891298e-05 -2.54424622e-04] [ 7.65903794e-07 3.99109718e-06 -2.68407787e-04] [-2.07945098e-06 3.20357410e-05 3.11932380e-04] [-3.16194998e-06 1.64677094e-05 1.74086710e-05] [ 1.28058652e-05 -4.39730161e-06 -4.18533859e-05] [-3.03706120e-06 -2.18863094e-05 1.35378965e-05] [ 1.23050699e-05 3.20888710e-05 -2.45309657e-05]] Final stress: [-4.51803890e-04 -2.26575151e-04 -4.63516943e-04 -1.43607202e-04 2.38681667e-08 -8.54843822e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 60 steps. Final forces: [[-1.51512305e-04 -2.97414456e-05 1.20813205e-04] [ 1.28022021e-04 5.91779529e-04 9.09674381e-04] [-1.64536027e-04 -1.16728040e-03 -4.82005763e-05] [ 1.38497966e-04 5.65336386e-05 7.96924712e-04] [ 1.83325579e-04 1.00561164e-05 5.04526006e-04] [-4.31813358e-05 -3.52424546e-04 -4.77407359e-04] [-3.43422391e-04 3.34922384e-05 -7.67958242e-04] [-9.61987607e-05 2.86366268e-04 7.38275407e-04] [ 9.59095373e-04 6.62255256e-04 -3.01982532e-04] [-6.10851099e-04 3.49393400e-05 -5.70778405e-04] [ 1.49259826e-05 -1.11372931e-03 -6.41426301e-04] [ 7.07266890e-04 8.57392332e-04 1.70767433e-04] [-6.90655417e-04 5.78445652e-04 1.08616543e-05] [-1.42543434e-04 -9.88489720e-04 7.28369771e-04] [ 1.20070476e-03 3.13439317e-04 -3.98807705e-04] [-1.05465914e-03 4.31368685e-04 -5.54798814e-04] [ 2.37453472e-05 -1.16793305e-04 -1.88237780e-04] [-2.59400319e-05 -7.34113144e-05 2.26964065e-04] [ 2.81190507e-05 9.72275207e-05 2.18182094e-04] [-2.92946177e-05 -8.77505156e-05 -2.78023956e-04] [-8.07768689e-06 8.72180038e-05 -1.62147041e-05] [-8.90856903e-06 4.90085349e-05 -5.42960462e-05] [-6.54553524e-06 -1.32599375e-04 -1.01536103e-04] [-7.37661450e-06 -2.73024975e-05 -2.56902069e-05]] Final stress: [-4.48495044e-04 -2.25328895e-04 -4.64693790e-04 1.62526459e-04 2.01871533e-08 6.34011974e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.83199309e-05 -1.06562574e-04 -5.08730418e-04] [ 2.17125393e-05 1.10565693e-04 6.42945474e-04] [-2.11150569e-05 1.09687980e-04 6.35743304e-04] [-2.03700638e-05 -1.03592566e-04 -5.07860101e-04] [ 3.34448874e-06 8.20533962e-05 -1.17358635e-05] [-8.88105099e-05 -4.79331062e-05 -2.57590373e-06] [ 8.27795438e-05 -4.05949458e-05 -5.88057456e-06] [-5.12436198e-06 1.08006466e-05 -1.52666573e-05] [-1.03841343e-05 -9.26053983e-07 -1.53184277e-05] [ 2.01725348e-05 -1.24821659e-05 -2.12492591e-05] [ 4.30110256e-07 1.04552477e-04 -2.32702585e-04] [ 9.81774202e-06 1.51412398e-05 -2.63235903e-04] [-1.16218549e-05 1.66756103e-05 -2.02869135e-04] [-2.63747362e-07 -1.24447493e-04 1.77007500e-04] [-2.37497685e-06 -7.37934541e-06 2.07982941e-04] [ 3.90641678e-06 -8.55760195e-06 1.49204805e-04] [ 2.26488396e-05 -2.59970466e-05 -8.00105516e-05] [ 2.15382802e-05 2.68305736e-05 -5.27121258e-05] [-2.19129502e-05 2.72421606e-05 7.36817998e-05] [-2.26287435e-05 -2.64293518e-05 4.81307031e-05] [ 9.71147521e-05 -1.99092491e-05 -2.27282208e-04] [ 9.69974600e-05 2.06382676e-05 -2.11456363e-04] [-9.72209834e-05 2.04611698e-05 2.23618226e-04] [-9.69552555e-05 -1.98377148e-05 2.00571325e-04]] Final stress: [ 1.59152197e-04 1.38180249e-04 2.79528852e-04 -7.99477255e-10 -1.03947412e-04 1.45987946e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[-5.32410294e-05 7.21234508e-05 -1.92068726e-03] [-3.20396003e-05 -3.10680394e-05 3.52450359e-03] [ 2.09108396e-05 -2.13266515e-05 1.81457022e-03] [ 5.12988320e-05 5.22345785e-05 -1.25807506e-04] [ 7.84108610e-06 -1.91469750e-03 -7.11611891e-04] [ 1.62005765e-03 9.39808932e-04 -6.82843303e-04] [-1.64391999e-03 9.62636624e-04 -7.03108201e-04] [-1.56353830e-05 5.34287648e-05 1.24818215e-05] [-1.43147525e-04 -3.08477861e-05 -2.77566594e-05] [ 1.83602951e-04 -7.22790698e-05 -6.24693405e-05] [-5.44101216e-06 -6.40290760e-04 -8.39786800e-04] [ 6.25659381e-04 4.94443800e-04 -7.59688351e-04] [-6.11356037e-04 4.79935218e-04 -9.14049988e-04] [-2.80227804e-06 -8.28359519e-04 4.89167042e-04] [ 5.84219517e-04 2.34772729e-04 4.20485740e-04] [-5.81628576e-04 2.30061306e-04 5.44051227e-04] [-8.31117499e-05 4.34867701e-05 -6.88923293e-05] [-8.60236009e-05 -3.66664329e-05 -2.39437895e-06] [ 8.56542098e-05 -4.16252937e-05 6.34445651e-05] [ 8.14736275e-05 4.61764303e-05 -4.01799390e-05] [-1.89982581e-04 -1.32807741e-05 -6.15213726e-04] [-1.88405312e-04 1.81497498e-05 -5.44941625e-04] [ 1.87900286e-04 1.85963940e-05 6.02839145e-04] [ 1.88116295e-04 -1.54129198e-05 5.47887948e-04]] Final stress: [ 1.61651430e-04 1.20759518e-04 2.83659490e-04 6.49746944e-08 1.11235620e-04 -5.30142858e-09] Minimization converged after 17 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.97782153e-07 -7.67390913e-05 -4.99022215e-06] [ 3.97723038e-07 7.67391017e-05 -5.04468195e-06] [ 3.97739833e-07 7.67391145e-05 5.04215893e-06] [-3.97781203e-07 -7.67390854e-05 4.99430174e-06] [-1.82511537e-10 6.04231907e-08 1.60558271e-08] [-5.22061882e-08 -3.00233010e-08 1.60115614e-08] [ 5.25082986e-08 -3.04164681e-08 1.61375889e-08] [ 1.88734096e-11 4.75064654e-08 -1.44398336e-08] [-4.11861558e-08 -2.37820447e-08 -1.44753405e-08] [ 4.11577579e-08 -2.37437775e-08 -1.44511629e-08] [-8.72575818e-05 -4.58135636e-05 -2.59131176e-10] [-1.23960879e-04 5.90934684e-06 -2.50372867e-10] [ 3.22755170e-05 -4.45342179e-05 -2.91266148e-10] [ 8.72576081e-05 4.57972648e-05 -1.45430291e-09] [ 1.23974981e-04 -5.90121929e-06 -1.41924846e-09] [-3.22896274e-05 4.45423783e-05 -1.47748966e-09] [-3.93942350e-05 -6.52901010e-06 3.79664554e-05] [ 3.93942344e-05 6.52901107e-06 3.79661389e-05] [ 3.93942179e-05 6.52901175e-06 -3.79664321e-05] [-3.93942174e-05 -6.52900912e-06 -3.79665964e-05] [ 4.99868534e-05 4.42958670e-06 -9.85041395e-05] [-4.99868673e-05 -4.42958516e-06 -9.85056352e-05] [-4.99868652e-05 -4.42958462e-06 9.85051747e-05] [ 4.99868517e-05 4.42958684e-06 9.85037907e-05]] Final stress: [ 1.53411744e-04 1.53200085e-04 2.70849629e-04 -5.37924232e-14 -4.26385813e-14 1.15244893e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[-2.60835461e-04 4.17455255e-04 -1.05843845e-02] [ 4.69261724e-04 -4.18060387e-04 7.66196117e-03] [ 4.26119591e-04 -3.73060950e-04 -6.66231443e-03] [-1.80417354e-04 4.02424891e-04 2.19405661e-03] [ 2.29972222e-04 -1.18284178e-02 -2.84313964e-03] [ 1.00446672e-02 5.65898700e-03 -2.61067411e-03] [-1.04623441e-02 6.16749220e-03 -3.03012451e-03] [ 1.48992819e-04 -6.97213953e-03 3.17842394e-03] [ 5.80767658e-03 3.30159230e-03 2.98288220e-03] [-6.06463214e-03 3.62301707e-03 3.23550678e-03] [ 4.84657557e-03 -1.91861732e-03 9.64051551e-05] [-1.32858402e-03 1.05385201e-02 7.71737486e-05] [-5.39663330e-03 -3.94047758e-03 6.32938677e-05] [-4.65344028e-03 -6.04369795e-03 1.76825507e-03] [ 8.04306425e-03 -6.79292728e-03 1.80131220e-03] [-1.71208740e-03 8.14856345e-03 1.74915813e-03] [ 3.93389833e-04 -1.16837502e-03 1.16191013e-04] [-3.44080919e-04 1.17554282e-03 1.19563059e-04] [-3.38932428e-04 1.17818439e-03 1.84020673e-04] [ 3.77401004e-04 -1.16382376e-03 -3.48945815e-05] [-1.77055158e-04 9.22426563e-04 -4.51497020e-04] [ 1.61413046e-04 -9.19944511e-04 -1.93250731e-04] [ 1.83281046e-04 -9.18595823e-04 5.32392910e-04] [-2.12772376e-04 9.23931966e-04 6.49682961e-04]] Final stress: [ 1.71243080e-05 -2.34342542e-04 5.01968184e-05 -1.10645563e-07 2.23482237e-07 -4.48115924e-05] Minimization converged after 176 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-3.48784649e-05 -1.67372369e-04 5.09981023e-06] [ 3.48782714e-05 1.67372303e-04 5.50075271e-06] [ 3.48782655e-05 1.67372394e-04 -5.32385739e-06] [-3.48783848e-05 -1.67372362e-04 -4.97870702e-06] [-3.27442696e-10 -3.34595225e-07 -1.11354781e-07] [ 2.90117180e-07 1.67651861e-07 -1.11401931e-07] [-2.89634621e-07 1.66993966e-07 -1.11415361e-07] [-1.48191212e-10 -1.21945546e-07 4.15602910e-08] [ 1.05741853e-07 6.11276191e-08 4.16034989e-08] [-1.05443983e-07 6.08009170e-08 4.14745472e-08] [ 4.05569347e-05 3.50565170e-05 -1.92633222e-08] [ 6.06868974e-05 -7.80267337e-05 -1.93090642e-08] [ 4.97929019e-05 -9.10840076e-05 -1.93502358e-08] [-4.05572104e-05 -3.53431243e-05 -9.33200917e-09] [-6.04384726e-05 7.81703066e-05 -9.25254160e-09] [-5.00409466e-05 9.12270556e-05 -9.35852610e-09] [ 6.17270908e-05 -1.25757301e-05 -3.70532269e-05] [-6.17270970e-05 1.25757211e-05 -3.70570070e-05] [-6.17270760e-05 1.25757193e-05 3.70559043e-05] [ 6.17270710e-05 -1.25757197e-05 3.70508402e-05] [-4.88677336e-05 -5.57924232e-06 9.86516538e-05] [ 4.88676911e-05 5.57923908e-06 9.86563470e-05] [ 4.88677102e-05 5.57924307e-06 -9.86554330e-05] [-4.88677527e-05 -5.57924298e-06 -9.86516775e-05]] Final stress: [-1.24866991e-04 -1.24628808e-04 -2.51168302e-04 -2.83663215e-13 -1.30528662e-13 -1.14702624e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[ 2.15918468e-04 1.12425708e-03 -1.87796067e-04] [ 3.36878299e-04 -1.27852546e-03 2.96219845e-04] [-3.17678300e-05 1.06454710e-03 -9.48789353e-05] [ 1.02246551e-04 -1.36865462e-03 2.35266169e-04] [-3.85623799e-04 1.02579794e-03 -1.49338312e-03] [-5.96246847e-05 7.89977797e-04 4.54857380e-05] [ 1.13978672e-04 1.01895494e-03 -2.88769623e-04] [-3.18857506e-04 -1.37702584e-03 -2.57040382e-03] [-6.31854936e-04 -3.99071434e-05 3.98102510e-04] [ 7.97086007e-04 6.65844164e-05 6.39952564e-04] [-1.05166313e-04 2.94093882e-04 -1.21848037e-04] [ 4.74844589e-04 -4.00639593e-04 1.00661038e-03] [-4.28126157e-04 -4.29467826e-04 6.88336213e-04] [-2.37344155e-04 3.13880416e-04 -8.14523288e-06] [ 5.10145924e-04 -5.07379859e-04 5.95919992e-04] [-3.41712635e-04 -2.87209379e-04 8.11433639e-04] [-7.31112049e-06 9.95394381e-05 1.17379031e-04] [ 5.94012486e-07 2.11688283e-04 -6.13165908e-05] [-2.71577304e-05 9.37485977e-05 -1.50139010e-05] [-2.76587936e-05 1.63458878e-04 8.18539927e-05] [ 1.77829044e-05 -2.76180133e-05 9.94026160e-04] [ 2.65529452e-05 -2.76018721e-04 -1.04821602e-03] [-4.87866597e-06 -3.45048909e-05 -9.62247575e-04] [ 1.10559536e-05 -2.39577409e-04 9.41432691e-04]] Final stress: [-3.42114401e-04 -9.57324352e-05 -2.15779273e-04 -3.08927464e-04 1.52474921e-06 5.00982635e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 1.09532664e-03 2.28253996e-03 -5.40480261e-03] [ 1.22283235e-03 -1.90604165e-03 5.58912334e-03] [-4.59256111e-05 3.38009788e-03 -6.42151016e-03] [-4.51578133e-06 -3.41401041e-03 4.52822729e-03] [-1.58936531e-03 -2.21012475e-03 -1.78205530e-02] [ 6.90870043e-03 7.14391786e-03 2.70306136e-03] [-5.83266454e-03 4.55560421e-03 1.48817377e-03] [-2.31891098e-03 -9.12286370e-03 -8.37081448e-03] [ 1.11590683e-02 4.06781404e-03 3.35313252e-03] [-1.00160480e-02 3.74134935e-03 4.24083680e-03] [-1.38468559e-03 -5.78237378e-03 -3.98510975e-03] [ 3.35488724e-03 1.39418472e-03 7.08446007e-03] [-1.96908726e-03 3.80724272e-04 5.22859249e-03] [-1.37560009e-03 -5.32225858e-03 -4.33299911e-04] [ 4.88536514e-03 1.69176651e-03 3.78755893e-03] [-3.43730318e-03 4.34338942e-04 4.49400991e-03] [-7.56886315e-05 -8.34487460e-04 -2.90164871e-04] [-1.50588525e-04 4.22215537e-05 3.32365079e-04] [-1.99759911e-04 5.90368033e-04 6.85337773e-04] [-2.39151119e-04 -5.44536279e-04 5.29875434e-06] [ 1.07118245e-04 8.63601732e-04 -5.30594373e-03] [-7.39655855e-06 -1.20546386e-04 5.17777183e-03] [ 2.15397756e-05 -6.46219800e-04 4.41987643e-03] [-1.08147046e-04 -6.65066273e-04 -5.08562783e-03]] Final stress: [-3.30125846e-04 -1.03504624e-04 -2.05826846e-04 4.77167817e-04 6.84147769e-06 -2.84464759e-07] Minimization converged after 188 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 44 steps. Final forces: [[-0.00179671 0.01452925 -0.07109855] [ 0.01215484 -0.0130427 -0.05406566] [-0.00563562 -0.01346528 -0.11306173] [ 0.00198531 0.01276312 -0.08387251] [ 0.01171851 -0.14085194 -0.0047796 ] [ 0.10847985 0.05613753 0.00509222] [-0.13431327 0.08466035 -0.01271737] [-0.00979044 0.0137588 0.02602944] [-0.00232341 0.00445022 0.03274792] [ 0.02249649 -0.01857774 0.01887749] [ 0.04523586 0.0351894 0.03183201] [-0.06922774 0.01894001 0.03823489] [ 0.02703579 -0.03953505 0.03169113] [-0.04024735 0.06700027 0.04285826] [-0.02573088 -0.07638235 0.03804859] [ 0.05767022 -0.00554284 0.03871409] [ 0.00350093 0.00424899 -0.00111321] [ 0.00126923 -0.008695 0.00167094] [-0.00080686 -0.00411366 0.0071386 ] [-0.00391288 0.00831713 0.00779908] [ 0.00246234 0.0013778 0.00398014] [ 0.00319154 -0.00591125 0.00584705] [-0.0026934 -0.00109528 0.00382941] [-0.00072235 0.00584023 0.00631736]] Final stress: [-2.93741330e-04 -5.50261312e-05 1.06526098e-06 -1.16956918e-05 4.88916174e-05 -3.64978852e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-4.11546665e-04 5.97316432e-04 1.30296014e-03] [ 8.81186783e-04 -5.02724460e-05 -2.89481177e-04] [ 5.87349679e-04 -8.51711362e-04 3.31240891e-04] [ 6.61812885e-04 4.36777583e-04 6.09003610e-04] [-6.72152236e-04 8.04484436e-04 1.58305282e-04] [ 1.85319607e-04 -3.28772794e-05 -2.47305556e-04] [ 7.62343240e-04 -2.96379514e-04 -6.62781671e-04] [ 5.50559662e-04 1.61198239e-04 4.04342651e-04] [-4.72895763e-05 -7.84968056e-05 -4.58579532e-04] [-6.46549077e-04 -3.63774747e-05 2.85384745e-04] [ 6.04979492e-05 -1.54708087e-03 -1.86484482e-04] [-3.56520849e-04 1.36905014e-04 7.04733074e-04] [ 6.73206881e-04 -3.85708224e-04 -5.67090998e-04] [ 4.02118867e-04 3.05453032e-04 2.06162678e-04] [ 7.10063842e-04 -7.15188251e-04 7.87659102e-04] [-9.75812014e-04 -4.58728789e-05 -1.89046893e-04] [ 2.52758040e-04 2.50650044e-04 4.03184382e-04] [-1.51606995e-03 6.36099403e-05 -4.61288227e-04] [-7.62017850e-04 6.18727053e-04 2.26428715e-04] [ 4.74558867e-05 -1.50963669e-04 4.32645111e-04] [ 3.88692754e-04 7.06101314e-04 -1.85639773e-04] [-2.54321349e-04 -1.57309471e-04 -8.28616691e-04] [-6.29393358e-04 4.25567425e-04 -8.11636852e-04] [ 1.08306848e-04 -1.58552265e-04 -9.64098525e-04]] Final stress: [ 0.03274615 0.03330917 0.13512384 0.00077854 -0.00041262 -0.00048456] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.02026555e-05 -9.60777554e-06 1.34176386e-05] [-2.29846413e-06 -6.13149567e-06 1.30001938e-06] [ 1.59502587e-05 1.56681344e-05 5.15499805e-06] [-3.18916630e-06 -1.77592433e-05 -1.14841841e-05] [ 4.56935416e-06 1.86161628e-05 4.13453047e-06] [ 1.10993288e-07 2.35719257e-05 3.56724040e-06] [ 2.79053216e-05 -2.59745516e-05 -2.96165309e-07] [ 1.51444231e-05 2.52877844e-05 -8.02569840e-06] [ 1.71615542e-05 -2.64479619e-05 -1.15599391e-05] [-3.85741017e-05 2.24396675e-05 2.23078001e-06] [-2.28784895e-05 -1.24023633e-05 -2.84166103e-06] [ 4.18510898e-05 2.29141373e-05 1.04406733e-05] [-3.33022629e-05 8.27233079e-06 -1.80775659e-06] [ 3.27700317e-06 -7.57281100e-06 -1.28253139e-05] [-1.84321840e-05 1.16256253e-05 -2.64799366e-06] [ 1.03745898e-05 -3.41554529e-05 -3.20369530e-06] [ 5.52928881e-06 -4.83348621e-06 -8.23234110e-06] [-6.51043892e-06 1.28375251e-05 9.17504936e-06] [ 3.96965035e-06 4.21669280e-06 1.34100669e-05] [ 2.50276739e-05 -1.93618003e-05 -1.76431829e-05] [-8.26765381e-06 -1.03473637e-05 1.66486249e-05] [-1.40231390e-05 1.35856176e-05 7.39497412e-06] [ 4.21709075e-06 7.98752156e-06 -1.26535922e-06] [-1.74097359e-05 -1.24288198e-05 -5.04130488e-06]] Final stress: [ 3.32788711e-02 3.23476777e-02 1.34817814e-01 -8.33831019e-05 -9.03793263e-05 8.06256189e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.04786380e-03 -9.88828810e-05 -6.03888552e-03] [ 1.73718106e-03 1.98160459e-04 5.99432806e-03] [-1.04786294e-03 9.88825361e-05 6.03857811e-03] [-1.73718126e-03 -1.98160363e-04 -5.99434344e-03] [ 5.27348009e-11 3.30861348e-08 9.05236130e-09] [-2.88161077e-08 -1.65109973e-08 9.23400384e-09] [ 2.89877934e-08 -1.66424839e-08 9.14703827e-09] [ 3.95244664e-10 -2.04346838e-07 6.69771478e-08] [ 1.76738291e-07 1.01590761e-07 6.74539418e-08] [-1.78270879e-07 1.02975750e-07 6.77520005e-08] [-2.51947029e-03 3.16993097e-04 -2.25536965e-03] [ 1.85565648e-03 -2.25308130e-03 -1.51772324e-03] [ 1.40705732e-03 2.62621224e-03 -2.92909287e-03] [ 2.51947062e-03 -3.17114111e-04 2.25539992e-03] [-1.85555184e-03 2.25314167e-03 1.51775358e-03] [-1.40716250e-03 -2.62615145e-03 2.92912327e-03] [ 6.64260664e-04 -4.05746622e-04 5.67545399e-04] [-9.62013919e-04 9.81219571e-04 8.52303437e-04] [-6.64260560e-04 4.05746694e-04 -5.67541757e-04] [ 9.62013949e-04 -9.81219688e-04 -8.52303534e-04] [ 1.96829797e-04 6.73455452e-05 -1.05987086e-03] [-3.83707823e-04 -3.08997680e-04 -8.82277140e-04] [-1.96829394e-04 -6.73455532e-05 1.05986866e-03] [ 3.83707744e-04 3.08997694e-04 8.82277957e-04]] Final stress: [ 1.12102057e-05 -1.80281147e-05 -1.41150023e-05 -1.12999535e-04 -5.34521367e-06 9.08529261e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-1.31456371e-03 -4.27328629e-04 -9.16792285e-03] [-2.31360899e-03 5.78562270e-04 8.96334468e-03] [ 1.31456254e-03 4.27328245e-04 9.16725330e-03] [ 2.31360825e-03 -5.78561923e-04 -8.96300408e-03] [-2.72936013e-10 -1.71514884e-07 -6.04043272e-08] [ 1.48714558e-07 8.62116502e-08 -6.02244484e-08] [-1.47364564e-07 8.51808745e-08 -5.95978863e-08] [-5.13847565e-10 -3.95414725e-07 1.35172035e-07] [ 3.43490808e-07 1.98514527e-07 1.36316737e-07] [-3.41270864e-07 1.96821030e-07 1.35643222e-07] [ 2.96118513e-03 3.42561339e-04 -3.37458322e-03] [-1.61887156e-03 3.08627539e-03 -4.31453403e-03] [-2.32405243e-03 -2.79538454e-03 -2.33119428e-03] [-2.96118580e-03 -3.43017013e-04 3.37461573e-03] [ 1.61926670e-03 -3.08604646e-03 4.31456708e-03] [ 2.32365861e-03 2.79561135e-03 2.33122697e-03] [-7.71261814e-04 -6.33424712e-04 7.78905329e-04] [ 1.12948199e-03 1.34371856e-03 1.20014589e-03] [ 7.71261603e-04 6.33424950e-04 -7.78896214e-04] [-1.12948210e-03 -1.34371877e-03 -1.20015092e-03] [-1.27039578e-04 1.26650509e-04 -1.56642720e-03] [ 3.70723621e-04 -3.47159962e-04 -1.29413463e-03] [ 1.27038776e-04 -1.26650527e-04 1.56642232e-03] [-3.70724020e-04 3.47160120e-04 1.29413922e-03]] Final stress: [ 8.26470903e-06 -3.28585698e-05 -2.31809760e-05 -1.15564649e-04 5.44490248e-06 -8.49864152e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.01690763e-03 -4.41313823e-04 7.77466007e-03] [-1.16976258e-03 3.12474918e-04 -7.93818926e-03] [ 2.01690904e-03 4.41314302e-04 -7.77517542e-03] [ 1.16976193e-03 -3.12473977e-04 7.93763553e-03] [-5.39403474e-10 2.86665031e-07 1.05728662e-07] [-2.48603554e-07 -1.43233425e-07 1.06809181e-07] [ 2.50162809e-07 -1.43978885e-07 1.07038390e-07] [ 8.42807120e-10 -4.74799292e-07 1.44246791e-07] [ 4.09141797e-07 2.35946729e-07 1.42622563e-07] [-4.11830737e-07 2.38359731e-07 1.43608756e-07] [-2.74800122e-03 3.15145246e-04 2.92536311e-03] [ 2.09726019e-03 -2.54591185e-03 2.05146415e-03] [ 1.51276151e-03 2.83420269e-03 3.72409082e-03] [ 2.74800035e-03 -3.14868996e-04 -2.92525996e-03] [-2.09749950e-03 2.54577395e-03 -2.05136135e-03] [-1.51252148e-03 -2.83434177e-03 -3.72398720e-03] [ 1.04644648e-03 -1.15721964e-03 1.02830718e-03] [-7.14111558e-04 5.13465833e-04 6.61014132e-04] [-1.04644649e-03 1.15721988e-03 -1.02830521e-03] [ 7.14111262e-04 -5.13465909e-04 -6.61003594e-04] [ 3.82815055e-04 3.13646362e-04 -1.07231569e-03] [-1.67441811e-04 -1.06973207e-04 -1.30784128e-03] [-3.82814070e-04 -3.13646248e-04 1.07231038e-03] [ 1.67441376e-04 1.06973289e-04 1.30784352e-03]] Final stress: [ 9.64976521e-06 -2.49053281e-05 -1.84581123e-05 1.14421827e-04 5.55937921e-06 8.80551589e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 1.80623178e-03 -3.09217849e-04 6.54104953e-03] [ 1.05722124e-03 1.99337112e-04 -6.62174632e-03] [-1.80623337e-03 3.09218941e-04 -6.54170521e-03] [-1.05722137e-03 -1.99336488e-04 6.62166734e-03] [-2.23783335e-10 -1.04488283e-07 -1.29969929e-08] [ 9.02399424e-08 5.24326382e-08 -1.27688415e-08] [-8.97418627e-08 5.17007765e-08 -1.26352807e-08] [-1.08489093e-09 -6.12836736e-07 1.83656847e-07] [ 5.30361685e-07 3.07296330e-07 1.82213530e-07] [-5.27049268e-07 3.04436558e-07 1.81261324e-07] [ 2.59991297e-03 3.11793672e-04 2.46015458e-03] [-1.44505049e-03 2.68432515e-03 3.14626900e-03] [-1.93984938e-03 -2.36530201e-03 1.71073754e-03] [-2.59991199e-03 -3.11566967e-04 -2.46008183e-03] [ 1.44485320e-03 -2.68443976e-03 -3.14619614e-03] [ 1.94004610e-03 2.36518911e-03 -1.71066513e-03] [-9.92606293e-04 -1.04096180e-03 9.09466790e-04] [ 6.76488746e-04 4.40343232e-04 5.99609425e-04] [ 9.92606377e-04 1.04096193e-03 -9.09465732e-04] [-6.76488460e-04 -4.40343188e-04 -5.99601398e-04] [-3.85693738e-04 3.02719787e-04 -9.45645556e-04] [ 1.86913945e-04 -8.64762539e-05 -1.14071780e-03] [ 3.85692515e-04 -3.02719585e-04 9.45634821e-04] [-1.86914284e-04 8.64764294e-05 1.14072735e-03]] Final stress: [ 1.06161966e-05 -2.01882492e-05 -1.55742717e-05 1.13547539e-04 -5.77199138e-06 -8.99718561e-05] Minimization converged after 44 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-3.32674867e-07 9.11693890e-05 -5.20206783e-05] [-1.31364439e-05 -9.97496460e-05 4.67420635e-05] [ 3.32649410e-07 -9.11694008e-05 5.19528027e-05] [ 1.31364675e-05 9.97496429e-05 -4.67259838e-05] [-2.67786379e-12 -1.03988518e-09 -1.24598104e-09] [ 8.97415850e-10 5.27985287e-10 -1.24510924e-09] [-8.89996965e-10 5.12403342e-10 -1.25065125e-09] [ 2.76437304e-11 -3.89433898e-08 1.35042988e-08] [ 3.37209396e-08 1.94573621e-08 1.35507560e-08] [-3.37518353e-08 1.94971632e-08 1.34759882e-08] [ 1.24382370e-04 3.38323665e-06 1.42611052e-04] [-1.13640463e-04 1.87375789e-04 7.87361155e-05] [-6.86279437e-05 -8.78066268e-05 6.67139493e-05] [-1.24382323e-04 -3.42987919e-06 -1.42606174e-04] [ 1.13680852e-04 -1.87352501e-04 -7.87312117e-05] [ 6.85875128e-05 8.78299885e-05 -6.67090961e-05] [ 6.59334313e-05 -1.05373892e-05 1.96772695e-05] [-6.87862285e-06 -1.19064906e-05 -7.53783974e-06] [-6.59334144e-05 1.05373900e-05 -1.96762592e-05] [ 6.87860397e-06 1.19064905e-05 7.53740676e-06] [ 2.69287326e-05 -1.08046820e-05 -1.04265497e-05] [-1.28438312e-04 1.97902886e-06 1.69333929e-05] [-2.69287437e-05 1.08046794e-05 1.04261863e-05] [ 1.28438320e-04 -1.97903008e-06 -1.69332352e-05]] Final stress: [ 1.57435671e-05 1.34239833e-05 1.19111663e-05 8.78163805e-08 -1.01463267e-04 1.16563006e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-1.32147451e-05 1.00631521e-04 4.29383282e-05] [-3.06470487e-07 -8.82807283e-05 -5.54004518e-05] [ 1.32146866e-05 -1.00631510e-04 -4.29957211e-05] [ 3.06502002e-07 8.82807328e-05 5.54256825e-05] [-1.99607765e-11 -5.99724281e-09 -3.02162584e-09] [ 5.18124246e-09 3.00318286e-09 -3.00182124e-09] [-5.17020926e-09 2.98794856e-09 -3.01572373e-09] [-4.33902003e-11 -2.83680230e-08 1.04613024e-08] [ 2.45738359e-08 1.42204989e-08 1.04752875e-08] [-2.45069529e-08 1.41380804e-08 1.04260091e-08] [-1.24359696e-04 2.96464017e-08 -1.44994357e-04] [ 6.81789318e-05 -8.69496900e-05 -6.56566106e-05] [ 1.14094115e-04 1.88251937e-04 -7.74617355e-05] [ 1.24359630e-04 -8.17443302e-08 1.44997528e-04] [-6.81337677e-05 8.69758005e-05 6.56597963e-05] [-1.14139184e-04 -1.88225953e-04 7.74648845e-05] [-6.79904428e-06 1.20521758e-05 -7.47750189e-06] [ 6.60002046e-05 1.07260768e-05 1.97343523e-05] [ 6.79905276e-06 -1.20521747e-05 7.47850466e-06] [-6.60002279e-05 -1.07260743e-05 -1.97349607e-05] [-1.28361355e-04 -1.77243869e-06 1.68904427e-05] [ 2.69794867e-05 1.07363269e-05 -1.04573399e-05] [ 1.28361337e-04 1.77243834e-06 -1.68906332e-05] [-2.69794698e-05 -1.07363267e-05 1.04574691e-05]] Final stress: [ 1.57412296e-05 1.34224313e-05 1.19238079e-05 -6.62699357e-08 -1.01469976e-04 -1.16562158e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 1.32092592e-05 1.00229396e-04 4.44918486e-05] [ 3.15241489e-07 -8.94186282e-05 -5.40006155e-05] [-1.32092743e-05 -1.00229391e-04 -4.45009489e-05] [-3.15181253e-07 8.94186248e-05 5.39261987e-05] [-6.57045013e-12 3.88291105e-08 1.40448326e-08] [-3.36048739e-08 -1.94037188e-08 1.40726876e-08] [ 3.35837184e-08 -1.94194886e-08 1.39762109e-08] [ 3.72795718e-11 -2.36434847e-08 5.92579563e-09] [ 2.04419938e-08 1.17798429e-08 5.88974192e-09] [-2.04880322e-08 1.18603396e-08 5.93445170e-09] [ 1.24358660e-04 1.34886620e-06 -1.44012098e-04] [-1.13925090e-04 1.87890337e-04 -7.79691277e-05] [-6.83408378e-05 -8.72987202e-05 -6.60960783e-05] [-1.24358707e-04 -1.29291759e-06 1.44019833e-04] [ 1.13876647e-04 -1.87918269e-04 7.79768762e-05] [ 6.83893006e-05 8.72707016e-05 6.61037839e-05] [ 6.83468831e-06 1.19909174e-05 -7.50167879e-06] [-6.59761627e-05 1.06483716e-05 1.97107817e-05] [-6.83466379e-06 -1.19909211e-05 7.50126158e-06] [ 6.59761431e-05 -1.06483697e-05 -1.97094706e-05] [ 1.28424811e-04 -1.85595469e-06 1.69065441e-05] [-2.69222817e-05 1.07618044e-05 -1.04435575e-05] [-1.28424817e-04 1.85595409e-06 -1.69068519e-05] [ 2.69223005e-05 -1.07618035e-05 1.04434549e-05]] Final stress: [ 1.57420242e-05 1.34230787e-05 1.19189985e-05 -7.52146636e-08 1.01467501e-04 1.16562287e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 3.01424320e-07 8.62405473e-05 -5.76618597e-05] [ 1.32868469e-05 -1.01186558e-04 4.02599739e-05] [-3.01430388e-07 -8.62405660e-05 5.76787685e-05] [-1.32867963e-05 1.01186560e-04 -4.03065586e-05] [ 3.49783917e-11 2.91656254e-08 9.82054849e-09] [-2.53057123e-08 -1.46236302e-08 9.85480114e-09] [ 2.52442059e-08 -1.45460587e-08 9.79550580e-09] [ 1.11880322e-11 8.88550944e-09 -3.02371028e-09] [-7.67377217e-09 -4.45266291e-09 -3.00186620e-09] [ 7.66095620e-09 -4.41796261e-09 -2.99995246e-09] [-1.24319824e-04 -2.29411466e-06 1.46656629e-04] [ 6.78645432e-05 -8.63853887e-05 6.49531305e-05] [ 1.14416313e-04 1.88840752e-04 7.66177827e-05] [ 1.24319850e-04 2.31959801e-06 -1.46653671e-04] [-6.78866238e-05 8.63726218e-05 -6.49501530e-05] [-1.14394287e-04 -1.88853461e-04 -7.66148235e-05] [-6.60512934e-05 -1.08552231e-05 1.97748945e-05] [ 6.75804553e-06 -1.21501838e-05 -7.43724188e-06] [ 6.60513035e-05 1.08552256e-05 -1.97751008e-05] [-6.75804938e-06 1.21501817e-05 7.43782270e-06] [-2.69786772e-05 -1.06888175e-05 -1.04760689e-05] [ 1.28336294e-04 1.63216120e-06 1.68584937e-05] [ 2.69786705e-05 1.06888159e-05 1.04763926e-05] [-1.28336281e-04 -1.63216188e-06 -1.68588561e-05]] Final stress: [ 1.57394258e-05 1.34214674e-05 1.19327155e-05 5.16020305e-08 1.01473780e-04 -1.16561117e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 77 steps. Final forces: [[ 7.48488001e-04 1.35309078e-03 3.78842983e-03] [-4.58144527e-04 3.49119238e-03 -7.17765804e-04] [-1.16178250e-03 -2.45983032e-03 1.58312083e-03] [ 1.04485733e-03 -1.93378636e-03 3.97550017e-04] [ 1.64068029e-04 1.43734441e-03 1.08231262e-03] [-3.16678291e-03 -1.00749281e-03 -1.01362614e-03] [ 3.05976374e-03 -8.26740285e-04 1.28467405e-03] [ 6.49511539e-05 7.25440930e-03 -5.40505742e-04] [-6.29129835e-03 -4.31215351e-03 -3.00487070e-03] [ 5.98251300e-03 -4.03540311e-03 -8.64329746e-04] [-1.79209945e-03 2.50242351e-04 3.92294333e-03] [ 5.84275188e-04 -1.29372433e-03 8.74310982e-04] [ 4.64590845e-03 1.23537964e-04 -3.25989360e-03] [-1.88209377e-03 2.80585957e-03 -1.55245405e-03] [ 2.15836101e-04 -3.03514347e-03 1.34819287e-03] [-1.98381092e-03 1.53230413e-03 -2.35532822e-03] [-2.60508996e-03 -2.05903686e-03 2.85531413e-04] [ 7.00409122e-04 4.14293025e-04 1.35259156e-04] [-2.21963909e-03 -2.02739968e-04 -3.78804055e-04] [ 3.90718891e-03 1.91043523e-03 -9.91612210e-05] [-1.47655798e-03 -5.86157993e-04 -1.38459094e-03] [ 2.58971494e-03 -1.88833240e-03 -1.00345768e-03] [-1.80446959e-04 5.22058246e-04 1.16601535e-03] [-4.90227546e-04 2.54577405e-03 3.06447446e-04]] Final stress: [ 3.61728486e-02 3.61668620e-02 1.44668492e-01 1.37796516e-05 -4.05940349e-07 3.49136009e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 82 steps. Final forces: [[ 3.62753735e-03 -9.21356846e-04 -7.47779780e-03] [ 2.35192019e-03 -1.95722720e-03 1.07740481e-03] [-1.10923801e-03 7.12752012e-04 -6.67453317e-03] [-4.09054597e-03 1.16888982e-03 2.15730901e-03] [ 8.09379290e-03 -1.29641461e-02 1.32059663e-03] [ 1.46959806e-02 -4.89506162e-04 3.19788912e-03] [-2.55771343e-02 1.56920879e-02 -4.78224590e-03] [ 2.19399012e-02 -2.67707107e-02 4.86648273e-03] [-4.30220443e-02 -1.08924959e-02 9.25584551e-04] [ 1.63741239e-02 3.03459846e-02 -1.68221899e-03] [ 1.51546915e-04 3.12561854e-03 1.16310239e-02] [-1.74358524e-03 4.44029441e-03 2.62123577e-03] [ 8.23738109e-05 -4.84609598e-03 -1.50407514e-02] [ 9.66584399e-06 1.31498869e-03 1.00660881e-03] [-7.15200048e-04 5.76807310e-03 -1.26144380e-02] [ 3.82413507e-03 -6.73905538e-03 1.80531184e-02] [ 9.66471078e-03 -2.77065910e-04 -5.75531144e-04] [-1.55148045e-03 5.29355696e-03 1.00750331e-03] [ 5.02909048e-03 -3.12971064e-03 7.52715971e-04] [-7.82827695e-03 2.33024167e-03 -6.89850405e-04] [ 5.33937198e-03 -7.99869101e-03 -1.05003632e-03] [-1.41966100e-03 -7.53055775e-03 1.76835638e-03] [-4.45980225e-04 6.69363483e-03 2.25552890e-03] [-3.68100458e-03 7.63049709e-03 -2.05395524e-03]] Final stress: [ 3.61534978e-02 3.61506655e-02 1.44651781e-01 -1.61953316e-05 2.85537023e-05 -3.55011580e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-1.55183644e-11 3.56587009e-05 1.95610277e-05] [-1.50806009e-11 -3.56585239e-05 1.95741952e-05] [-8.45542057e-11 -3.56589854e-05 -1.95556658e-05] [-2.94949370e-10 3.56588532e-05 -1.95663564e-05] [-9.66076680e-11 -4.73150513e-09 -1.87520510e-09] [ 4.84678796e-09 2.55304402e-09 -2.06921305e-09] [-4.46608017e-09 2.21588081e-09 -1.67663028e-09] [-9.29569639e-11 2.28607555e-09 -1.01843556e-09] [-1.48019197e-09 -9.17926735e-10 -6.65326350e-10] [ 1.65590164e-09 -1.13252757e-09 -7.81326309e-10] [ 9.68752301e-11 -8.95398406e-05 -3.21178282e-09] [ 2.47653683e-06 -8.12825798e-06 -2.71986610e-09] [-2.47667983e-06 -8.12806552e-06 -2.87896008e-09] [-1.71844095e-10 8.95428929e-05 1.25528302e-09] [-2.48008794e-06 8.12668130e-06 1.26884650e-09] [ 2.48043978e-06 8.12627840e-06 1.49047273e-09] [-4.19650426e-12 -3.33715125e-05 -1.18838835e-05] [-6.53921362e-13 3.33714726e-05 -1.18835249e-05] [-1.69866898e-11 3.33714625e-05 1.18836822e-05] [-1.89747107e-11 -3.33715283e-05 1.18834899e-05] [ 1.32969746e-11 3.96219885e-05 1.10498067e-05] [-3.17819697e-11 -3.96219339e-05 1.10500229e-05] [-2.34078447e-11 -3.96219551e-05 -1.10498629e-05] [-7.91089416e-12 3.96219999e-05 -1.10500489e-05]] Final stress: [3.46993965e-04 2.05619986e-04 1.85245794e-04 8.64980606e-13 1.01477611e-12 1.05866458e-13] Minimization converged after 29 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.03595882e-10 2.71452499e-04 7.07808854e-04] [-1.90874201e-10 -2.71452704e-04 7.07751346e-04] [ 3.19607639e-11 -2.71452658e-04 -7.07766129e-04] [-1.33204003e-11 2.71452722e-04 -7.07766666e-04] [ 1.78143052e-10 -1.83933097e-09 1.24617167e-09] [ 1.61343651e-09 7.43437936e-10 1.25995317e-09] [-1.87808818e-09 1.11254267e-09 1.19341870e-09] [-1.26913348e-10 3.18117013e-08 -9.65595592e-09] [-2.72847732e-08 -1.56362276e-08 -9.34838051e-09] [ 2.76366965e-08 -1.59596837e-08 -9.63173769e-09] [-1.12679310e-10 1.41769365e-04 4.57251203e-09] [-1.31921143e-04 -1.82015910e-04 4.24903625e-09] [ 1.31921373e-04 -1.82016173e-04 4.68435917e-09] [-3.10328430e-11 -1.41741166e-04 -5.74797058e-09] [ 1.31896772e-04 1.82001954e-04 -5.65201709e-09] [-1.31896682e-04 1.82001883e-04 -5.57193853e-09] [ 1.89506744e-12 8.87846387e-05 3.60342475e-04] [-8.15497669e-12 -8.87846426e-05 3.60342252e-04] [ 1.69922409e-11 -8.87846646e-05 -3.60342861e-04] [ 8.08103584e-12 8.87846680e-05 -3.60341785e-04] [-3.22911142e-11 1.56832941e-05 2.79708214e-05] [-4.39321745e-12 -1.56833134e-05 2.79701355e-05] [-1.45640981e-11 -1.56833629e-05 -2.79701588e-05] [-5.87763171e-12 1.56833377e-05 -2.79698815e-05]] Final stress: [ 6.09073309e-05 -3.01514223e-05 -1.58857760e-05 -3.36668346e-13 -1.06125929e-12 -4.77098063e-14] Minimization converged after 26 steps. Minimization converged after 7 steps. Minimization converged after 27 steps. Minimization converged after 30 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.22964527e-09 -8.17699859e-06 -3.58656601e-07] [-5.76511088e-10 8.17570790e-06 1.75349285e-06] [-1.12951451e-09 8.17443253e-06 -1.63411336e-06] [-7.48867912e-11 -8.17559112e-06 4.96358006e-09] [-7.40723912e-10 -9.25339220e-07 -3.31785056e-07] [ 8.01356129e-07 4.63331354e-07 -3.31581185e-07] [-7.99867421e-07 4.61607980e-07 -3.30589014e-07] [-2.75222620e-09 -1.18519284e-06 3.97601857e-07] [ 1.03451556e-06 5.96942385e-07 4.01855536e-07] [-1.02893728e-06 5.90543811e-07 3.98127060e-07] [-2.16602014e-10 1.00191083e-05 -3.64693581e-08] [-6.68655468e-06 2.13145868e-05 -3.61857750e-08] [ 6.68718133e-06 2.13139663e-05 -3.59992165e-08] [ 3.50303841e-10 -1.16792472e-05 4.82795690e-08] [ 8.12881190e-06 -2.04838442e-05 4.89793426e-08] [-8.12920578e-06 -2.04832037e-05 4.85102547e-08] [-9.33668420e-11 1.98005012e-05 3.47135074e-06] [-3.40798945e-10 -1.98006291e-05 3.45118787e-06] [-7.22247262e-11 -1.98003621e-05 -3.44575656e-06] [-3.08869236e-10 1.98002286e-05 -3.47681434e-06] [-8.30442937e-11 -1.57198385e-05 -9.86220565e-06] [ 1.52576699e-11 1.57195665e-05 -9.84075518e-06] [-8.45769738e-12 1.57194863e-05 9.84154634e-06] [-3.84489662e-11 -1.57197632e-05 9.85501630e-06]] Final stress: [-6.47282652e-05 5.46599665e-06 8.63586555e-05 -7.66460479e-14 -1.73981657e-12 -2.51903410e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-6.38982228e-10 -1.41867317e-05 1.93693972e-06] [ 9.54528766e-11 1.41854179e-05 1.83695851e-06] [-3.79043041e-10 1.41863586e-05 -1.81953922e-06] [-3.31684596e-10 -1.41871063e-05 -1.83666846e-06] [ 2.16498628e-11 -2.43264343e-08 -5.21099369e-09] [ 2.49069352e-08 1.29942582e-08 -7.19258536e-09] [-2.47926945e-08 1.29363982e-08 -6.99515051e-09] [-1.07542518e-09 3.74323759e-08 -1.83140557e-08] [-2.88683135e-08 -1.71015468e-08 -1.67799034e-08] [ 3.09507958e-08 -1.95388621e-08 -1.81157946e-08] [ 2.19874785e-10 8.04380062e-06 8.79326434e-10] [-1.13091682e-05 2.37523520e-05 2.95873579e-10] [ 1.13088260e-05 2.37527940e-05 8.22629336e-11] [-6.93675062e-10 -7.92767580e-06 -1.43869381e-08] [ 1.12093206e-05 -2.38096954e-05 -1.45216504e-08] [-1.12079993e-05 -2.38112579e-05 -1.45523417e-08] [ 8.56184568e-12 2.43474295e-05 4.64159219e-06] [-1.21275989e-10 -2.43477358e-05 4.64235911e-06] [ 1.02337028e-11 -2.43477828e-05 -4.64435277e-06] [-1.37963807e-10 2.43475298e-05 -4.64166566e-06] [ 1.65475966e-11 -1.17543949e-05 3.53850069e-05] [-9.02940987e-11 1.17543373e-05 3.53849167e-05] [-8.88636354e-11 1.17543760e-05 -3.53860152e-05] [ 9.15784115e-12 -1.17544113e-05 -3.53847199e-05]] Final stress: [-2.38192630e-04 -1.68454409e-04 -2.40596563e-04 -1.69367765e-12 4.91700531e-13 3.77357183e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-5.16968681e-05 -8.06080011e-04 8.51487676e-04] [ 1.90220090e-04 4.69356155e-04 -7.36538061e-04] [ 6.53192634e-07 -8.16732056e-04 8.58234321e-04] [ 7.71712880e-05 4.70189977e-04 -7.46644005e-04] [-1.32464864e-04 3.25760874e-04 6.64035684e-04] [-6.43763101e-04 -8.64457370e-04 -1.24135483e-04] [ 6.10568966e-04 -8.61980087e-04 -3.54310463e-04] [-1.86624466e-04 1.00210018e-03 -2.67394676e-04] [-7.51593924e-04 8.63742598e-05 -2.21858585e-04] [ 9.87107999e-04 1.00707978e-04 -3.36326690e-04] [-7.81327614e-06 5.86142271e-04 5.07882458e-04] [-7.42788678e-04 -1.09850602e-04 -4.84736472e-06] [ 6.61867018e-04 -3.68738047e-05 -1.30118077e-04] [-1.25556279e-05 5.63527602e-04 4.79586128e-04] [-7.00976764e-04 -2.25411393e-04 -9.04749105e-05] [ 6.94059834e-04 5.61879602e-05 -1.51532286e-04] [-5.90608029e-06 5.75692659e-06 -3.07846717e-04] [-6.18143712e-06 3.13404421e-05 3.13965086e-04] [-5.47182981e-06 -9.66229662e-05 3.16793084e-04] [-1.26791794e-05 1.01089730e-04 -3.13590571e-04] [ 3.09637125e-06 -6.98872174e-05 -7.07747701e-05] [ 1.92550667e-05 1.03350731e-04 5.04365166e-05] [ 7.61669259e-06 -1.14635511e-04 -1.85589010e-05] [ 8.89957693e-06 1.00645927e-04 -1.67469393e-04]] Final stress: [-1.83019610e-04 -1.06091513e-05 -1.48152618e-04 -9.09468155e-05 1.63396447e-07 1.29625589e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[-5.47633243e-04 -1.29073609e-03 -2.68180465e-03] [ 9.99132428e-05 9.65340985e-04 -1.68760387e-03] [-8.00763136e-05 -1.03040322e-03 -2.66944624e-03] [ 1.92998255e-04 7.34242481e-04 -1.67005363e-03] [-5.70054908e-04 1.17313710e-03 6.27872246e-03] [-3.72029873e-03 -2.24903919e-03 3.20315117e-04] [ 3.24651712e-03 -1.50253381e-03 -9.65406373e-04] [-6.94408604e-05 -5.64286577e-03 1.37835976e-03] [ 5.78570121e-03 1.60835684e-03 1.39873137e-03] [-4.96282607e-03 1.95033257e-03 1.98510647e-04] [-1.38474140e-04 1.88095984e-03 -5.32752294e-04] [ 1.30931160e-03 2.45541718e-04 -1.51992067e-04] [-1.07117301e-03 3.36781505e-04 5.92639083e-04] [-1.20280731e-03 1.84091690e-03 -5.70323192e-04] [ 2.09239922e-03 1.07357729e-03 2.78755894e-04] [-1.91294170e-04 -7.58676183e-04 4.31325123e-04] [-6.37648078e-05 5.13708078e-04 6.70565753e-04] [ 5.56359411e-05 -1.79796495e-04 -7.14069048e-04] [-3.45772614e-05 3.03978276e-04 -6.98901059e-04] [ 7.19828596e-05 -1.75365510e-04 8.30385198e-04] [-9.66224925e-05 1.82146486e-04 2.02753432e-04] [-2.42507158e-05 -1.64214893e-04 3.69782310e-05] [-1.92853768e-04 1.35184512e-04 -3.28058678e-04] [ 1.11688343e-04 4.94265837e-05 5.23690379e-05]] Final stress: [-1.80205019e-04 -1.43020065e-05 -1.49175304e-04 8.42136515e-05 -1.50441076e-06 9.78771910e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-7.20566821e-07 1.93596157e-04 -2.66546292e-04] [ 1.05929310e-07 -1.60009800e-04 3.67743553e-04] [-1.25283160e-06 -1.91657938e-04 5.58693791e-04] [ 7.23257204e-08 1.59664887e-04 -4.31530198e-04] [-6.59325915e-08 2.58300367e-05 9.71135347e-06] [-2.16853932e-05 -1.26951227e-05 9.24280855e-06] [ 2.17224716e-05 -1.27963729e-05 9.17906400e-06] [-1.78223954e-06 1.58744049e-04 -5.77184929e-05] [-1.37311038e-04 -7.78545383e-05 -5.76281297e-05] [ 1.41182063e-04 -8.21418232e-05 -6.04225090e-05] [-3.41549520e-07 9.88605567e-05 5.04784757e-05] [-2.73272874e-05 -1.23220631e-04 1.69402210e-05] [ 2.80826192e-05 -1.24057658e-04 1.62114112e-05] [ 3.69974134e-07 5.44216170e-05 -7.50232979e-05] [-1.08970667e-04 4.59983057e-05 -4.23623018e-05] [ 1.08450172e-04 4.67273771e-05 -4.24732707e-05] [ 2.45207387e-08 1.19954500e-04 -3.24583526e-05] [-2.13410593e-07 -2.08895891e-05 -4.81229596e-05] [-7.50857065e-09 -1.20060476e-04 2.84676450e-05] [-2.31683974e-07 2.10484554e-05 4.85548270e-05] [-8.54836545e-08 6.35583832e-05 -5.04325522e-04] [ 4.31938455e-08 2.77412614e-04 -4.56507443e-04] [-1.30985758e-08 -6.31643969e-05 5.04983065e-04] [-4.45786275e-08 -2.77268593e-04 4.54912556e-04]] Final stress: [-1.53070289e-04 -1.07218975e-04 -6.79469396e-05 -6.23294459e-05 1.63245020e-09 -3.12550476e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[-5.54597175e-07 4.27846182e-05 4.74713223e-04] [ 3.51659727e-08 -3.44869687e-05 -1.16168614e-04] [-7.22765186e-07 -4.20685949e-05 2.26773121e-04] [ 1.04168038e-07 3.50724553e-05 1.17549689e-04] [ 3.62575959e-07 -1.58908976e-04 -3.53046158e-05] [ 1.36612112e-04 7.89020641e-05 -3.47366131e-05] [-1.37313360e-04 7.97242471e-05 -3.51800191e-05] [-8.11332507e-07 4.02405179e-04 -1.37806731e-04] [-3.48625726e-04 -2.00516817e-04 -1.37242109e-04] [ 3.50529569e-04 -2.02555614e-04 -1.38727980e-04] [-5.45712098e-07 2.97371931e-04 -2.59790488e-05] [-2.22028641e-04 -1.58401775e-04 -2.62972450e-05] [ 2.23058922e-04 -1.59628207e-04 -2.66065903e-05] [-2.05032871e-07 2.16179543e-04 -3.49240247e-05] [-2.25093797e-04 -9.79331697e-05 -3.44648060e-05] [ 2.25514460e-04 -9.84120156e-05 -3.46662448e-05] [ 5.79439826e-08 -6.07499070e-05 -6.44764127e-05] [-1.00302783e-07 -2.88689172e-05 -5.05346585e-05] [ 5.03053414e-08 6.09573721e-05 5.31538606e-05] [-1.01314038e-07 2.88067450e-05 5.54157026e-05] [-8.94508711e-08 -1.07458642e-04 -1.04580013e-04] [-2.01756616e-08 -5.08306573e-07 -1.16377613e-04] [-5.29130233e-08 1.07650220e-04 1.07999205e-04] [-6.01019992e-08 6.43537081e-07 1.18468538e-04]] Final stress: [-1.51232995e-04 -8.96514833e-05 -7.15955753e-05 6.25162926e-05 2.86892662e-10 -1.52005491e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 2.94250003e-06 -8.12385576e-06 1.00082858e-04] [ 3.15253711e-06 8.49682148e-06 -1.43111597e-05] [-3.23536331e-06 7.96227674e-06 -8.00010066e-05] [-2.99009951e-06 -7.44339346e-06 1.37417560e-05] [-1.27366610e-07 -1.44036778e-05 -2.90931308e-06] [ 1.03444258e-05 6.82078493e-06 -1.74337533e-06] [-1.02295361e-05 6.60750704e-06 -1.79836200e-06] [ 2.94717889e-08 1.38170168e-05 -4.30834678e-06] [-1.16506688e-05 -6.81345858e-06 -4.01352028e-06] [ 1.17497428e-05 -6.83658639e-06 -4.20621176e-06] [ 3.94443960e-08 7.12254650e-05 1.82800843e-05] [ 8.56995451e-05 -2.91849554e-05 -1.08699383e-05] [-8.57030990e-05 -2.91368979e-05 4.77612784e-05] [-8.87588799e-08 -5.27316191e-05 -1.90724566e-05] [-1.02518562e-04 1.98184668e-05 1.07631937e-05] [ 1.02624374e-04 1.96558628e-05 -4.83403511e-05] [ 2.55445549e-06 3.73166166e-05 6.79082131e-05] [ 2.56967280e-06 -3.72370632e-05 6.57748574e-05] [-2.56866419e-06 -3.71225095e-05 -6.80999949e-05] [-2.57829551e-06 3.72001227e-05 -6.54414281e-05] [-3.62658549e-06 3.00583116e-05 2.64793256e-05] [-3.62645866e-06 -2.99991971e-05 2.48812419e-05] [ 3.61050591e-06 -3.00340527e-05 -2.62350754e-05] [ 3.62678272e-06 3.00880145e-05 -2.43222690e-05]] Final stress: [ 1.80040770e-04 1.14518431e-04 9.46012717e-05 -9.59433716e-11 -6.33827778e-05 3.47586884e-12] Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[ 4.66610054e-06 -1.79995263e-05 3.58559350e-05] [ 4.67676830e-06 1.79994545e-05 2.66290731e-05] [-4.69507646e-06 1.79858778e-05 -3.60498239e-05] [-4.67257770e-06 -1.79634571e-05 -2.79129995e-05] [ 2.51913646e-08 -4.95819277e-07 6.24992211e-08] [ 3.39042970e-07 2.05120539e-07 1.11104971e-07] [-3.85302118e-07 2.61069747e-07 8.44731273e-08] [-1.67412587e-08 2.42606514e-07 -1.07603371e-10] [-2.17192623e-07 -9.86845511e-08 2.11281899e-08] [ 2.59659402e-07 -1.42994132e-07 -1.35723263e-08] [-1.65736734e-08 3.17302573e-05 1.72584906e-06] [ 3.62468379e-05 -6.42963636e-05 -1.80847842e-05] [-3.62111990e-05 -6.43362490e-05 2.15448212e-05] [-1.33379129e-08 -3.07337525e-05 -1.39815384e-06] [-3.70930472e-05 6.38296122e-05 1.84430389e-05] [ 3.71133295e-05 6.38026552e-05 -2.11855652e-05] [ 1.21697458e-05 -1.93761370e-05 -9.38892141e-05] [ 1.21661719e-05 1.93795184e-05 -9.40774863e-05] [-1.21641726e-05 1.93833043e-05 9.39134014e-05] [-1.21695921e-05 -1.93768406e-05 9.41242990e-05] [ 7.41314767e-06 -5.92848893e-05 1.86481753e-05] [ 7.41501316e-06 5.92842947e-05 1.85176889e-05] [-7.41813738e-06 5.92839646e-05 -1.86160742e-05] [-7.41805840e-06 -5.92830226e-05 -1.84537064e-05]] Final stress: [-1.53798558e-04 -8.38370520e-05 -7.20250056e-05 -8.75773464e-11 -6.54846977e-05 -6.98284504e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-4.67308762e-05 4.98418922e-04 -9.24645552e-05] [-4.71222625e-05 -4.97973562e-04 -9.16121666e-05] [ 4.79914799e-05 -4.97980832e-04 7.36611308e-05] [ 4.71511708e-05 4.97762209e-04 7.62412402e-05] [ 3.86872616e-07 -1.27995661e-05 -5.35206140e-07] [ 9.98851960e-06 5.86377487e-06 -9.40825087e-08] [-1.06587611e-05 6.69684463e-06 -4.26135546e-07] [ 7.41508384e-07 6.58641872e-06 2.48013739e-06] [-7.04445406e-06 -4.42757955e-06 1.28992817e-06] [ 5.15903074e-06 -2.48849137e-06 2.85254253e-06] [ 2.87098446e-07 -1.69917362e-04 4.26883999e-06] [ 7.27701461e-05 -7.64189727e-05 7.47855985e-05] [-7.34135486e-05 -7.57188622e-05 -6.63341195e-05] [-3.59962324e-07 1.86374548e-04 4.36854837e-06] [-8.58534744e-05 6.83586858e-05 -6.72619401e-05] [ 8.63661697e-05 6.76505989e-05 7.46707235e-05] [-1.72302524e-04 2.45242709e-04 -1.91231374e-04] [-1.72226572e-04 -2.45165277e-04 -1.90897760e-04] [ 1.72364675e-04 -2.45200883e-04 1.91721637e-04] [ 1.72428104e-04 2.45221095e-04 1.92095652e-04] [-1.34917935e-04 -2.27947496e-04 -9.87408509e-04] [-1.35022892e-04 2.27920596e-04 -9.87488597e-04] [ 1.34989279e-04 2.27944105e-04 9.88684376e-04] [ 1.35029208e-04 -2.28001624e-04 9.88634092e-04]] Final stress: [-1.69006979e-04 -1.40409854e-04 -5.85560433e-05 1.86056269e-09 8.20218494e-05 2.78380919e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.78270910e-04 -2.36849837e-04 -1.01643672e-05] [-1.78270046e-04 2.36849634e-04 -9.38564737e-06] [-1.78269990e-04 2.36849626e-04 9.67615764e-06] [ 1.78270182e-04 -2.36849956e-04 9.92094756e-06] [ 2.47474397e-10 -1.94480071e-07 -8.29199321e-08] [ 1.69335155e-07 9.71229172e-08 -8.34240621e-08] [-1.69867849e-07 9.77599353e-08 -8.35420984e-08] [ 5.49006198e-10 -2.03222679e-07 7.79847553e-08] [ 1.75249196e-07 1.00911387e-07 7.76990844e-08] [-1.76645158e-07 1.02353386e-07 7.86179751e-08] [ 4.59120916e-05 1.83561022e-04 -5.24701625e-08] [ 6.17647937e-05 -3.36025158e-04 -5.23234724e-08] [-2.64078802e-04 -1.66149611e-04 -5.23903273e-08] [-4.59114017e-05 -1.84237077e-04 4.32148821e-08] [-6.11798381e-05 3.36362591e-04 4.29741364e-08] [ 2.63492834e-04 1.66488420e-04 4.35505226e-08] [-8.44716067e-05 -5.22119460e-05 3.90862647e-05] [ 8.44717156e-05 5.22118973e-05 3.90819612e-05] [ 8.44716626e-05 5.22118530e-05 -3.90766999e-05] [-8.44715545e-05 -5.22118849e-05 -3.90933023e-05] [ 3.41443489e-05 -1.50224399e-05 1.50399937e-04] [-3.41442657e-05 1.50224240e-05 1.50405870e-04] [-3.41442344e-05 1.50224332e-05 -1.50402518e-04] [ 3.41443333e-05 -1.50224349e-05 -1.50405575e-04]] Final stress: [ 1.79345973e-04 1.15986837e-04 9.16703140e-05 -2.88543505e-13 7.57430040e-13 6.58240661e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-2.46861083e-04 -3.79645285e-04 2.34828861e-05] [ 2.46861247e-04 3.79645340e-04 2.34229410e-05] [ 2.46861418e-04 3.79645470e-04 -2.24817366e-05] [-2.46861405e-04 -3.79645625e-04 -2.27362046e-05] [-3.08394644e-10 -4.93255007e-07 -1.58580864e-07] [ 4.27512934e-07 2.47025644e-07 -1.58839779e-07] [-4.26914069e-07 2.46318378e-07 -1.58996766e-07] [ 5.07955290e-10 8.00203946e-07 -2.48678581e-07] [-6.93297432e-07 -4.00701685e-07 -2.48943847e-07] [ 6.92257214e-07 -3.99495664e-07 -2.49096695e-07] [-7.29151585e-05 3.47272074e-05 -9.36279599e-08] [ 1.55921008e-04 -1.83941372e-04 -9.37145487e-08] [-8.86857954e-05 -3.07110210e-04 -9.38002013e-08] [ 7.29150601e-05 -3.47633664e-05 -5.86637902e-08] [-1.55889555e-04 1.83959541e-04 -5.90221181e-08] [ 8.86544084e-05 3.07128259e-04 -5.89169885e-08] [ 1.22114471e-04 -7.33360862e-05 1.16382304e-05] [-1.22114472e-04 7.33361001e-05 1.16397818e-05] [-1.22114414e-04 7.33360064e-05 -1.16461200e-05] [ 1.22114380e-04 -7.33360015e-05 -1.16490507e-05] [-3.57188820e-05 -9.38457607e-06 1.51099829e-04] [ 3.57189573e-05 9.38453841e-06 1.51097706e-04] [ 3.57191874e-05 9.38443707e-06 -1.51090991e-04] [-3.57191310e-05 -9.38447434e-06 -1.51096390e-04]] Final stress: [ 1.79046782e-04 1.15072507e-04 9.31016140e-05 3.59989398e-13 8.26804442e-13 -6.72596304e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.53983426e-04 -3.58942584e-04 -1.22192631e-04] [ 1.53983760e-04 3.58942756e-04 -1.21169481e-04] [ 1.53983507e-04 3.58942807e-04 1.21336899e-04] [-1.53983156e-04 -3.58942977e-04 1.22230410e-04] [ 2.60599721e-10 -3.15555110e-07 -1.50054810e-07] [ 2.73188202e-07 1.57495275e-07 -1.49943792e-07] [-2.73958713e-07 1.58246525e-07 -1.50276843e-07] [ 3.03061044e-10 -2.42300480e-07 1.12452715e-07] [ 2.09127546e-07 1.20729195e-07 1.12087790e-07] [-2.09684743e-07 1.21390740e-07 1.12132991e-07] [-2.41453343e-05 -1.14367326e-08 -2.55600713e-08] [-3.38661294e-04 -2.34637617e-04 -2.54013880e-08] [-1.83896996e-05 -5.66808995e-05 -2.55921232e-08] [ 2.41467519e-05 -1.48770606e-06 -2.11095103e-09] [ 3.39959914e-04 2.35385903e-04 -2.25805881e-09] [ 1.70893603e-05 5.74318238e-05 -2.49340251e-09] [-6.20734049e-05 1.81662999e-05 5.24935985e-06] [ 6.20735308e-05 -1.81663041e-05 5.22773617e-06] [ 6.20735414e-05 -1.81663538e-05 -5.22851001e-06] [-6.20734011e-05 1.81663127e-05 -5.25311688e-06] [ 2.78571809e-05 -1.35747089e-05 -1.20279115e-04] [-2.78571275e-05 1.35747028e-05 -1.20278943e-04] [-2.78571399e-05 1.35747062e-05 1.20278213e-04] [ 2.78572016e-05 -1.35747290e-05 1.20276198e-04]] Final stress: [-1.53021059e-04 -8.47363500e-05 -7.55252353e-05 1.10151946e-12 -3.29795975e-13 6.63727108e-05] Minimization converged after 188 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-3.50561719e-10 1.40030319e-05 7.86403306e-05] [ 1.36962456e-10 -1.40032856e-05 7.86819192e-05] [-5.48323096e-10 -1.40034926e-05 -7.86537682e-05] [ 1.73972781e-11 1.40038661e-05 -7.86595957e-05] [ 1.04291700e-10 -5.71789266e-09 -3.06077141e-09] [ 4.69131266e-09 2.61499514e-09 -2.64768743e-09] [-4.98421798e-09 2.90602337e-09 -2.90894434e-09] [-3.41934336e-10 4.44915682e-09 2.85233948e-10] [-3.53181739e-09 -1.68348924e-09 9.19438303e-10] [ 4.51427812e-09 -2.65312283e-09 2.31044350e-11] [-2.94474611e-10 7.34342707e-05 -4.66978889e-09] [ 8.60688738e-05 6.33435122e-05 -4.25119752e-09] [-8.60682985e-05 6.33428394e-05 -4.72060015e-09] [-2.45756637e-10 -7.34697713e-05 3.44808306e-09] [-8.60378335e-05 -6.33251939e-05 4.27700212e-09] [ 8.60382949e-05 -6.33257420e-05 4.15250716e-09] [ 3.28124472e-11 2.34353508e-05 -2.70686209e-05] [-4.28200808e-11 -2.34353650e-05 -2.70685839e-05] [ 1.79626314e-11 -2.34353127e-05 2.70691232e-05] [-5.59946534e-11 2.34353510e-05 2.70680629e-05] [-5.25775534e-11 -3.54769093e-05 1.67646943e-05] [-1.99944829e-11 3.54769114e-05 1.67648493e-05] [-5.20208864e-11 3.54769089e-05 -1.67643072e-05] [-3.13623572e-11 -3.54768857e-05 -1.67649501e-05]] Final stress: [ 2.05080372e-04 3.47101449e-04 1.85911522e-04 -1.75269704e-12 9.07275615e-13 3.20412844e-15] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 2.78487361e-09 2.01854578e-05 5.49072565e-06] [-5.61690195e-09 -2.01930786e-05 5.08974980e-06] [ 7.05847377e-09 -2.01958506e-05 -5.00964160e-06] [-1.61524646e-09 2.01964165e-05 -5.42729191e-06] [-4.48739217e-09 -2.52427738e-07 -2.05362092e-08] [ 2.14698531e-07 1.29788606e-07 -1.97494120e-08] [-2.04346265e-07 1.18636455e-07 -1.15824476e-08] [ 1.58286494e-09 1.50202957e-07 -6.39782354e-08] [-1.10139268e-07 -7.30360108e-08 -5.61554446e-08] [ 1.02496876e-07 -6.68066586e-08 -4.72450540e-08] [ 2.29324060e-10 1.06148811e-04 8.45137829e-09] [ 2.95046400e-05 5.24067265e-05 1.34390964e-09] [-2.95058506e-05 5.24076219e-05 1.15110379e-08] [ 2.22088387e-09 -1.05081353e-04 6.61740463e-09] [-3.04267214e-05 -5.29419752e-05 1.17137400e-08] [ 3.04229276e-05 -5.29371630e-05 1.28697365e-08] [-9.45644091e-10 1.56685530e-04 5.38662835e-05] [ 2.04116113e-10 -1.56686377e-04 5.38828277e-05] [-5.87659865e-10 -1.56684478e-04 -5.38792966e-05] [ 5.75040293e-10 1.56684346e-04 -5.38632121e-05] [ 2.37946995e-10 -1.18517477e-05 -1.29678235e-04] [ 7.78829198e-11 1.18510955e-05 -1.29670974e-04] [ 5.78777623e-10 1.18510547e-05 1.29679394e-04] [-2.77239343e-12 -1.18513944e-05 1.29686411e-04]] Final stress: [ 2.03926720e-04 2.57953122e-04 2.59674111e-04 -2.33635312e-11 -2.37631783e-11 -1.91021581e-12] Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 3.50434015e-10 9.26661458e-06 1.51957984e-06] [ 6.49707343e-10 -9.26687297e-06 1.36259312e-06] [-8.18410238e-11 -9.26623357e-06 -1.18251184e-06] [ 1.09019027e-09 9.26610650e-06 -1.15323346e-06] [ 1.15155857e-09 -2.18531511e-07 -6.36909071e-08] [ 1.89600487e-07 1.08154425e-07 -6.34667664e-08] [-1.92341759e-07 1.11069542e-07 -6.56204880e-08] [-5.04929591e-10 1.85349766e-07 -6.57129645e-08] [-1.62683792e-07 -9.26028053e-08 -6.66055631e-08] [ 1.63343641e-07 -9.35761952e-08 -6.67458805e-08] [-1.38317413e-10 -1.24755082e-05 -8.46648833e-09] [ 5.79753177e-06 -2.07772237e-05 -8.49742726e-09] [-5.79742313e-06 -2.07774504e-05 -8.63290427e-09] [ 1.13190801e-09 1.26700924e-05 -4.18748384e-08] [-5.96500856e-06 2.06790709e-05 -4.17908096e-08] [ 5.96284950e-06 2.06816395e-05 -4.19370862e-08] [ 1.38406037e-10 -1.80036582e-05 7.08197627e-06] [-7.52850560e-11 1.80036970e-05 7.08286719e-06] [ 1.27072686e-10 1.80034782e-05 -7.08790478e-06] [-6.28207764e-11 -1.80034346e-05 -7.08273776e-06] [ 2.88857827e-12 1.57820215e-05 -1.31914019e-05] [ 1.74738860e-10 -1.57821124e-05 -1.31916685e-05] [ 1.45945414e-10 -1.57821193e-05 1.31913003e-05] [ 3.21911386e-11 1.57820293e-05 1.31941837e-05]] Final stress: [ 5.45921749e-06 -6.46427912e-05 8.62656522e-05 -2.58889800e-13 -4.43544478e-14 -5.76474224e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 7.29206973e-11 1.61592731e-05 2.03610192e-06] [-7.55763996e-10 -1.61599440e-05 2.08176121e-06] [-1.22581769e-10 -1.61595354e-05 -2.05254963e-06] [-4.88381419e-10 1.61598900e-05 -2.07874340e-06] [-8.33731115e-10 3.17899332e-08 6.76972656e-09] [-2.64798397e-08 -1.48353323e-08 5.98101266e-09] [ 2.85824452e-08 -1.70207287e-08 7.71057124e-09] [-1.17717091e-10 5.13707743e-10 -2.37786457e-10] [ 1.53706492e-10 -1.12039267e-11 8.79243345e-11] [ 6.55591137e-11 -2.79097245e-10 -4.25177636e-11] [-2.76900392e-10 -6.39401229e-06 -6.86912937e-09] [ 7.93810075e-06 -2.33982804e-05 -7.49300904e-09] [-7.93746293e-06 -2.33989732e-05 -7.23614332e-09] [ 2.90125757e-10 6.31452887e-06 5.19659538e-09] [-7.86840600e-06 2.34382144e-05 5.58021838e-09] [ 7.86798805e-06 2.34387960e-05 5.76076500e-09] [-9.99061944e-11 -2.22392812e-05 4.41443927e-06] [-9.68086722e-12 2.22392162e-05 4.41385393e-06] [-1.03066333e-10 2.22392764e-05 -4.41333865e-06] [-7.26141369e-13 -2.22392492e-05 -4.41553746e-06] [-3.69285158e-11 1.22661803e-05 3.48708133e-05] [-1.23304473e-11 -1.22662367e-05 3.48709116e-05] [ 2.85055654e-11 -1.22662316e-05 -3.48708938e-05] [-7.55777108e-11 1.22662113e-05 -3.48720264e-05]] Final stress: [-1.68475113e-04 -2.38195861e-04 -2.40574729e-04 -2.96663844e-12 -1.86725312e-13 -2.17815101e-13] Minimization converged after 53 steps. Minimization converged after 56 steps. Minimization converged after 59 steps. Minimization converged after 58 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 2.00413701e-05 1.75903625e-05 2.30728914e-06] [ 1.99495102e-05 -1.76293038e-05 -3.15384775e-05] [-1.98760201e-05 -1.76758384e-05 -1.95240231e-06] [-1.99274349e-05 1.76889508e-05 3.03318749e-05] [ 2.96159003e-08 1.59575262e-07 2.51183729e-07] [-2.40791255e-07 -1.31814998e-07 3.13425167e-07] [ 1.96679825e-07 -7.22704077e-08 2.98316321e-07] [ 4.83782699e-08 5.13723099e-06 -9.11482484e-07] [-4.40217263e-06 -2.60726949e-06 -9.04622056e-07] [ 4.25519575e-06 -2.46643879e-06 -7.60923859e-07] [ 7.61509240e-08 6.01334448e-06 6.26087539e-06] [ 3.93440901e-05 -1.61775380e-05 7.44117972e-06] [-3.94660903e-05 -1.60192202e-05 5.10211055e-06] [ 7.84756352e-08 -9.74833717e-06 -5.61864156e-06] [-3.62126261e-05 1.78799905e-05 -6.77768865e-06] [ 3.60486945e-05 1.80655387e-05 -4.32815256e-06] [ 3.78314197e-05 -7.57306949e-06 7.49411235e-05] [ 3.78407918e-05 7.56700006e-06 7.41301406e-05] [-3.78293334e-05 7.58203915e-06 -7.48054650e-05] [-3.78270676e-05 -7.57989155e-06 -7.40940112e-05] [ 2.04539792e-05 -4.88907754e-05 -2.49711789e-05] [ 2.04534377e-05 4.88871782e-05 -2.56323554e-05] [-2.04305390e-05 4.88870597e-05 2.52314842e-05] [-2.04357145e-05 -4.88865028e-05 2.56863982e-05]] Final stress: [ 1.11981954e-04 1.81916964e-04 9.54924780e-05 -2.23670408e-10 -6.53708160e-05 -2.00407335e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.34958914e-05 2.79942627e-05 3.97517462e-09] [-1.35369012e-05 -2.78782831e-05 -8.26374101e-10] [ 1.35258980e-05 -2.78904529e-05 -8.76555274e-06] [ 1.34905539e-05 2.79472980e-05 2.57732299e-07] [ 2.20780364e-09 -3.92787535e-06 -3.82454296e-07] [ 3.25294639e-06 1.93417172e-06 -3.20195397e-07] [-3.23983496e-06 1.92908697e-06 -2.94911435e-07] [ 3.61910760e-08 2.23684214e-06 6.43503251e-07] [-2.05630076e-06 -1.19296384e-06 5.37981665e-07] [ 1.97125206e-06 -1.10208244e-06 6.02876555e-07] [-5.35254751e-08 -1.29445932e-05 1.90014699e-06] [ 7.82310145e-06 8.87912241e-06 3.29209656e-06] [-7.73727151e-06 8.76763712e-06 5.17225225e-07] [-3.83072550e-08 3.53253449e-06 3.21799875e-07] [ 1.59235745e-07 -4.12478427e-06 -1.13309774e-06] [-9.56992610e-08 -4.20544178e-06 1.67606364e-06] [-3.77297952e-05 -1.29754527e-05 7.01288537e-05] [-3.77236555e-05 1.29850418e-05 6.98747872e-05] [ 3.77285636e-05 1.29857886e-05 -6.97475065e-05] [ 3.77360163e-05 -1.29809173e-05 -6.97941533e-05] [-1.72488705e-05 -4.20445878e-05 -2.26963433e-05] [-1.72514509e-05 4.20610432e-05 -2.27873887e-05] [ 1.72434985e-05 4.20623833e-05 2.30519007e-05] [ 1.72380391e-05 -4.20477777e-05 2.31134870e-05]] Final stress: [ 1.12248974e-04 1.81554523e-04 9.55977996e-05 1.59776668e-10 6.52357380e-05 -4.28765857e-12] Minimization converged after 48 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.51235498e-04 -3.76564295e-04 -1.11531896e-05] [ 1.51235734e-04 3.76564744e-04 -1.12081882e-05] [ 1.51236028e-04 3.76564721e-04 1.16090473e-05] [-1.51235685e-04 -3.76564518e-04 1.12073349e-05] [ 8.97649229e-12 -1.67261492e-07 -3.65274433e-08] [ 1.44712718e-07 8.35749425e-08 -3.64183265e-08] [-1.44692461e-07 8.35774082e-08 -3.62681311e-08] [ 6.05628816e-10 1.74997022e-07 -7.22605281e-08] [-1.53380840e-07 -8.84319301e-08 -7.31996096e-08] [ 1.52177948e-07 -8.70416373e-08 -7.22453602e-08] [-1.77908586e-04 1.08090054e-04 -5.21236171e-08] [ 8.82422671e-05 -1.11912525e-04 -5.20227877e-08] [-2.35428766e-04 -2.32242882e-04 -5.19289487e-08] [ 1.77908370e-04 -1.07579614e-04 1.01881185e-08] [-8.86853893e-05 1.11657295e-04 1.01369905e-08] [ 2.35871919e-04 2.31987394e-04 1.00471726e-08] [-1.07605036e-04 4.35285096e-05 -4.07611689e-06] [ 1.07605044e-04 -4.35284132e-05 -4.06421531e-06] [ 1.07604953e-04 -4.35284580e-05 4.06580542e-06] [-1.07604904e-04 4.35285159e-05 4.06970813e-06] [ 1.93379353e-05 -4.02601962e-05 1.49555086e-04] [-1.93378891e-05 4.02602345e-05 1.49560586e-04] [-1.93379165e-05 4.02602555e-05 -1.49556452e-04] [ 1.93379877e-05 -4.02602363e-05 -1.49556783e-04]] Final stress: [ 1.11805128e-04 1.81899047e-04 9.42531360e-05 9.81790201e-13 -1.02906664e-12 6.69836586e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.44141943e-04 -3.70246579e-04 -1.85041866e-05] [-1.44142428e-04 3.70246248e-04 -1.80235131e-05] [-1.44142750e-04 3.70246288e-04 1.81411022e-05] [ 1.44142089e-04 -3.70246542e-04 1.84614247e-05] [-4.51431680e-10 -4.67495884e-07 -1.33701773e-07] [ 4.06222789e-07 2.34438398e-07 -1.34021708e-07] [-4.05365973e-07 2.33412970e-07 -1.33854635e-07] [-8.25996672e-10 -4.52661888e-07 1.21580561e-07] [ 3.93700106e-07 2.27467486e-07 1.22236090e-07] [-3.92018073e-07 2.25532196e-07 1.21415283e-07] [ 1.29171394e-04 4.34560713e-05 -2.00818999e-08] [ 1.71965139e-04 -1.90265694e-04 -2.00007418e-08] [-1.90623256e-05 -1.29408489e-04 -2.02143994e-08] [-1.29171312e-04 -4.32294139e-05 8.58989198e-09] [-1.72161473e-04 1.90152445e-04 8.62821911e-09] [ 1.92589003e-05 1.29295193e-04 8.63453915e-09] [ 1.14209590e-04 4.79454303e-05 -1.84118001e-05] [-1.14209596e-04 -4.79454463e-05 -1.84064347e-05] [-1.14209557e-04 -4.79454500e-05 1.84072751e-05] [ 1.14209523e-04 4.79454339e-05 1.84089474e-05] [-2.45778836e-05 -3.50107133e-05 1.45043615e-04] [ 2.45776929e-05 3.50106204e-05 1.45057699e-04] [ 2.45776746e-05 3.50106176e-05 -1.45057360e-04] [-2.45778799e-05 -3.50107114e-05 -1.45045978e-04]] Final stress: [ 1.10991936e-04 1.82305216e-04 9.50960217e-05 -1.18483949e-13 7.80902829e-13 -6.84405138e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-5.37734217e-04 1.54104158e-03 5.38731993e-03] [ 4.51852543e-04 -1.55461729e-03 -1.10527500e-02] [ 3.38743398e-04 -1.57822119e-03 -7.52766941e-03] [-3.32231915e-04 1.67227950e-03 7.06094549e-03] [ 1.31861703e-04 -9.54738338e-04 3.23627138e-04] [ 3.62316293e-04 2.49394293e-04 5.90306035e-04] [-6.54340994e-04 5.70023746e-04 3.72256767e-04] [-1.23950600e-04 2.65784641e-03 -1.04186556e-04] [-2.07706703e-03 -1.15556930e-03 3.07702761e-05] [ 2.36668780e-03 -1.46625896e-03 -1.69508679e-04] [-1.54008679e-02 2.60598441e-03 3.55141511e-03] [ 1.31960383e-03 -2.65525968e-03 3.53069026e-03] [ 1.56650021e-03 9.48374078e-03 3.50507320e-03] [ 1.52378508e-02 -2.54232816e-03 -2.11332136e-03] [-1.18935615e-03 2.79987803e-03 -1.99681817e-03] [-1.41728445e-03 -9.68864714e-03 -2.09383136e-03] [-1.50072712e-04 -2.65633311e-03 -1.95194969e-03] [ 1.70585726e-04 2.67490251e-03 -2.32323725e-03] [ 1.87358023e-04 2.68542366e-03 2.10408976e-03] [-2.03630235e-04 -2.68382303e-03 2.47571984e-03] [-1.74999465e-03 7.09385447e-04 9.91302534e-04] [ 1.74520370e-03 -7.02622541e-04 7.27618663e-04] [ 1.70639097e-03 -7.21882590e-04 -7.60310392e-04] [-1.74842413e-03 7.10400955e-04 -5.57552127e-04]] Final stress: [-2.61553096e-04 -5.51478350e-04 -1.88589696e-04 2.09145003e-07 5.56125314e-07 -1.65052083e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.41249830e-04 -2.15569431e-04 2.53290401e-05] [ 1.41249586e-04 2.15569081e-04 2.58650407e-05] [ 1.41249514e-04 2.15569319e-04 -2.56487860e-05] [-1.41249832e-04 -2.15569730e-04 -2.52603275e-05] [-4.57876835e-10 -4.82516332e-07 -1.49331450e-07] [ 4.19503290e-07 2.42058869e-07 -1.50213958e-07] [-4.18663921e-07 2.41025525e-07 -1.50095316e-07] [-2.57353998e-10 -3.17766562e-07 8.83594348e-08] [ 2.75468243e-07 1.59212552e-07 8.85947311e-08] [-2.74912883e-07 1.58596219e-07 8.84242456e-08] [-4.13877462e-05 1.26508466e-04 -2.89750121e-08] [ 2.25289462e-04 -1.34750236e-04 -2.89797026e-08] [-1.44771840e-04 -2.29134247e-04 -2.91171401e-08] [ 4.13877399e-05 -1.26582774e-04 -2.52674933e-09] [-2.25224252e-04 1.34787586e-04 -2.62568239e-09] [ 1.44706783e-04 2.29171518e-04 -2.65990299e-09] [ 6.11021988e-05 -3.77346153e-05 -5.96933233e-06] [-6.11021846e-05 3.77345270e-05 -5.96889906e-06] [-6.11021913e-05 3.77344581e-05 5.96837616e-06] [ 6.11021859e-05 -3.77345455e-05 5.96541827e-06] [-3.01764940e-05 -1.17586802e-05 -1.30308377e-04] [ 3.01763627e-05 1.17586852e-05 -1.30297335e-04] [ 3.01763730e-05 1.17586878e-05 1.30297888e-04] [-3.01765150e-05 -1.17586806e-05 1.30306439e-04]] Final stress: [-8.58633388e-05 -1.52397438e-04 -7.38672219e-05 3.50241459e-14 4.51461610e-13 -6.87134143e-05] Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 6.12453935e-04 1.28725824e-04 2.53961892e-03] [-5.79795053e-04 -1.42997210e-04 1.83515438e-03] [-6.61969441e-04 -1.29365817e-04 -1.84281300e-03] [ 6.92336104e-04 1.33052224e-04 -1.08550462e-03] [ 1.12178524e-04 1.50542158e-03 1.72741139e-04] [-1.40551113e-03 -8.80548648e-04 2.51159629e-04] [ 1.17140710e-03 -6.14468352e-04 6.48560017e-05] [ 5.30876506e-07 3.84413636e-05 -1.56250163e-04] [-5.42692826e-06 -1.40960032e-05 -1.42386430e-04] [ 1.83889726e-05 -2.10752584e-05 -1.62954505e-04] [-7.92098867e-03 -2.75808249e-03 -6.75057238e-05] [-6.63040537e-05 -5.24866943e-03 -6.15265365e-05] [ 9.66558581e-03 1.36746632e-02 -1.01894221e-04] [ 7.87668819e-03 7.96578723e-04 -3.42045708e-04] [ 1.81558239e-03 6.27954712e-03 -3.22016954e-04] [-1.13367365e-02 -1.27404782e-02 -3.59322696e-04] [-9.36622018e-04 6.52670810e-04 9.73522945e-06] [ 9.54420931e-04 -6.53384019e-04 -4.10744421e-05] [ 9.68095312e-04 -6.54922956e-04 -2.03099915e-05] [-9.53091481e-04 6.54760750e-04 -3.61735958e-05] [-1.79118624e-03 1.18190255e-03 -4.37589001e-04] [ 1.78149654e-03 -1.18466158e-03 -4.78087276e-04] [ 1.78670290e-03 -1.18198837e-03 4.01808671e-04] [-1.79823607e-03 1.17897423e-03 3.82380896e-04]] Final stress: [-1.03765488e-04 -4.43033561e-04 -1.72771461e-04 -4.56981744e-08 6.75063005e-08 -4.77866139e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 2.87750415e-05 -3.76583945e-05 2.73379622e-05] [-2.87761452e-05 3.76584128e-05 3.22404254e-05] [-2.87759203e-05 3.76586125e-05 -3.05112245e-05] [ 2.87746630e-05 -3.76586927e-05 -2.57509668e-05] [-2.63129408e-09 -3.90748495e-06 -1.31696027e-06] [ 3.38673456e-06 1.95661885e-06 -1.31746026e-06] [-3.38250503e-06 1.95113948e-06 -1.31707213e-06] [-7.69736864e-10 -1.22730131e-06 4.97053113e-07] [ 1.06310999e-06 6.14411402e-07 4.96947024e-07] [-1.06165835e-06 6.12673065e-07 4.96640276e-07] [ 8.49459833e-05 1.07617188e-05 -1.54995108e-07] [ 7.66365312e-05 -4.09790255e-05 -1.54937799e-07] [-9.15179163e-07 1.44895794e-05 -1.55131331e-07] [-8.49491087e-05 -1.54532658e-05 -1.29472803e-07] [-7.25714485e-05 4.33278047e-05 -1.29604507e-07] [-3.14583212e-06 -1.21467827e-05 -1.29604792e-07] [ 3.50268619e-05 -5.57250266e-06 2.38288377e-05] [-3.50269976e-05 5.57249823e-06 2.37579392e-05] [-3.50269257e-05 5.57243882e-06 -2.37710032e-05] [ 3.50267676e-05 -5.57245196e-06 -2.38451722e-05] [-2.67883976e-05 -2.71800388e-06 -7.65755599e-05] [ 2.67881168e-05 2.71800255e-06 -7.65348177e-05] [ 2.67883226e-05 2.71801136e-06 7.65499207e-05] [-2.67886131e-05 -2.71801598e-06 7.65882578e-05]] Final stress: [ 1.01122048e-04 1.01014238e-04 1.73853088e-04 2.80678826e-13 5.86975914e-13 -7.07910488e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.41574642e-05 -8.13428496e-05 -1.20926952e-06] [-1.41573368e-05 8.13430285e-05 -6.92553908e-07] [-1.41574012e-05 8.13428664e-05 8.64242177e-07] [ 1.41574793e-05 -8.13429222e-05 1.43556880e-06] [ 2.21403868e-10 -4.62312742e-07 -1.54520403e-07] [ 4.00083389e-07 2.30896620e-07 -1.54432293e-07] [-4.00416676e-07 2.31336268e-07 -1.54410199e-07] [ 1.27031861e-10 -1.52166230e-07 5.76246244e-08] [ 1.31576920e-07 7.59323293e-08 5.75624125e-08] [-1.31786564e-07 7.61983496e-08 5.76075218e-08] [-3.31246821e-05 2.35101572e-05 -1.29065041e-08] [ 1.25757110e-05 -3.62704611e-05 -1.27343135e-08] [-6.27324296e-05 -4.65410482e-05 -1.27941515e-08] [ 3.31249507e-05 -2.39924101e-05 -2.25454627e-08] [-1.21583176e-05 3.65113140e-05 -2.26263056e-08] [ 6.23146946e-05 4.67824108e-05 -2.26228237e-08] [-3.53242951e-05 -5.27822765e-06 -1.67283581e-05] [ 3.53243036e-05 5.27824544e-06 -1.67364343e-05] [ 3.53242801e-05 5.27823715e-06 1.67338566e-05] [-3.53242791e-05 -5.27823999e-06 1.67270383e-05] [ 3.22647473e-05 -4.86072748e-06 4.92094567e-05] [-3.22647193e-05 4.86073901e-06 4.92141661e-05] [-3.22647425e-05 4.86073260e-06 -4.92132714e-05] [ 3.22647670e-05 -4.86072932e-06 -4.92076435e-05]] Final stress: [-7.25556640e-05 -7.23171783e-05 -1.52692535e-04 6.75295052e-13 1.91356244e-13 7.18449714e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-6.51981211e-06 -3.06043638e-05 -4.10201617e-05] [ 6.51975424e-06 3.06045788e-05 -4.09989693e-05] [ 6.51989000e-06 3.06044937e-05 4.10529657e-05] [-6.51988112e-06 -3.06045547e-05 4.10115219e-05] [-1.07251187e-10 -6.50883056e-08 -1.48446361e-08] [ 5.64700042e-08 3.26662379e-08 -1.48992836e-08] [-5.62383340e-08 3.24080296e-08 -1.47486406e-08] [ 3.03308526e-11 -3.10964274e-08 4.05836409e-09] [ 2.66205238e-08 1.54421816e-08 3.87123211e-09] [-2.67052697e-08 1.55299373e-08 3.95504316e-09] [ 4.57682395e-05 1.00832042e-04 -7.77044484e-09] [ 6.84423085e-05 -6.03469587e-05 -7.69504187e-09] [-1.63392916e-05 -3.65978648e-05 -7.61509184e-09] [-4.57681157e-05 -1.00690604e-04 3.62001546e-09] [-6.85649749e-05 6.02761025e-05 3.46655450e-09] [ 1.64618216e-05 3.65272288e-05 3.48501262e-09] [ 4.04569406e-05 -4.29220235e-06 -2.52403639e-05] [-4.04569316e-05 4.29222469e-06 -2.52374596e-05] [-4.04569467e-05 4.29220077e-06 2.52379403e-05] [ 4.04569579e-05 -4.29220270e-06 2.52394035e-05] [-2.97856895e-05 -6.89429595e-06 6.51314929e-05] [ 2.97856747e-05 6.89430982e-06 6.51339791e-05] [ 2.97856817e-05 6.89430739e-06 -6.51333320e-05] [-2.97856955e-05 -6.89430320e-06 -6.51319002e-05]] Final stress: [-7.24393403e-05 -7.23844753e-05 -1.52724233e-04 7.89453457e-13 -1.34550443e-13 -7.16588447e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[ 0.00417791 -0.00333144 -0.00461319] [ 0.00237221 0.00789266 -0.00092446] [-0.00760437 -0.00558448 -0.00395093] [-0.00858899 0.00346059 -0.00027568] [ 0.0020851 -0.00014095 0.00961651] [-0.00932641 0.00361317 -0.01444971] [ 0.00765439 0.00500668 -0.01300286] [ 0.00468547 0.01008006 0.01091465] [ 0.00500729 -0.00338925 -0.0179525 ] [-0.00320385 0.00190382 -0.02705283] [ 0.00071425 -0.00267448 0.0043774 ] [ 0.0057862 -0.00397132 0.01630603] [-0.00516373 -0.00277648 0.01032389] [ 0.00081941 -0.00241504 0.01409938] [ 0.0051152 -0.00362264 -0.00044629] [-0.00518128 -0.00181256 0.01730542] [ 0.00037616 0.00170565 0.00131749] [ 0.00141953 -0.0013122 0.0001678 ] [-0.00057958 0.0030711 0.00046532] [ 0.00042841 -0.00205659 0.00234913] [-0.00031735 0.00283291 0.00197208] [ 0.00078182 -0.00073426 -0.0029538 ] [-0.00125962 -0.00205401 -0.00483483] [-0.00019817 -0.00369093 0.00124196]] Final stress: [-2.89518858e-04 -7.40977041e-05 -1.81379677e-04 -1.24924851e-05 5.80221750e-05 5.92488021e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 51 steps. Final forces: [[-5.59732193e-04 -1.69423558e-04 1.42878625e-04] [-7.31689839e-04 8.16531320e-04 1.33586165e-04] [ 2.09757616e-04 8.04752543e-05 8.14865559e-05] [ 1.04608011e-04 8.04006941e-04 6.11104327e-05] [ 5.29854172e-04 -1.06266222e-03 -3.36001371e-04] [ 1.43445517e-04 -1.96767618e-04 -2.16944659e-03] [ 5.08515929e-05 5.51934080e-05 -1.14545101e-03] [ 3.74950002e-04 -4.89910543e-04 1.73862336e-03] [ 1.81052496e-03 -2.04139585e-04 -1.93144627e-03] [-2.38016981e-03 7.62063567e-04 -1.75024617e-03] [ 1.85325574e-04 1.65629091e-03 1.65449624e-03] [-9.49229714e-04 -1.06636098e-03 3.53016198e-04] [ 9.36736830e-04 -9.47541388e-04 8.29471266e-04] [ 1.13232135e-04 1.60782759e-03 1.28273623e-03] [-9.97590182e-04 -8.91244168e-04 1.26443623e-03] [ 1.01465774e-03 -6.15038381e-04 9.15784068e-05] [ 3.98964059e-05 1.33864915e-04 4.70872748e-05] [ 2.06608065e-06 -1.99670170e-04 1.54471772e-04] [ 1.07521181e-04 -7.13950256e-05 7.17079341e-05] [ 6.45674268e-05 -2.44324710e-04 6.78527563e-05] [-3.85088582e-06 9.94697450e-05 -3.33431939e-04] [-1.01788415e-04 4.00943078e-05 -3.16167567e-06] [ 6.45968299e-05 1.81103530e-04 7.59811742e-05] [-2.85410346e-05 -7.84431422e-05 -3.81335595e-04]] Final stress: [-3.43752615e-04 -9.37878947e-05 -2.20818741e-04 1.80683091e-04 -3.90006126e-06 3.18702832e-07] Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[-1.53076644e-03 1.21200148e-03 2.53514341e-03] [-4.18740469e-03 -1.21262902e-03 1.14174011e-03] [ 1.53111783e-03 -1.21192695e-03 -2.42208912e-03] [ 4.18719105e-03 1.21261377e-03 -1.09606851e-03] [-4.72579805e-08 -3.46773255e-05 -1.11878358e-05] [ 3.01822030e-05 1.74554847e-05 -1.13516044e-05] [-2.98980830e-05 1.72336875e-05 -1.10671773e-05] [ 1.22689362e-07 8.29563441e-05 -2.65581486e-05] [-7.22597217e-05 -4.17669545e-05 -2.67462357e-05] [ 7.16589814e-05 -4.12769355e-05 -2.63263276e-05] [-9.36970761e-03 2.64636394e-03 6.33862063e-04] [ 3.70096350e-03 -8.99591333e-03 2.53151328e-03] [ 1.94054620e-03 4.25706053e-03 1.20709181e-05] [ 9.36973390e-03 -2.62968321e-03 -6.48647844e-04] [-3.71548777e-03 8.98752309e-03 -2.54645721e-03] [-1.92610204e-03 -4.26535079e-03 -2.67704942e-05] [-1.60772005e-03 -5.42094611e-04 -2.67775637e-04] [ 3.20169093e-03 -1.65575597e-03 -4.61212698e-04] [ 1.60772921e-03 5.42097052e-04 2.66639470e-04] [-3.20167107e-03 1.65574667e-03 4.60567635e-04] [-1.14544575e-03 -6.67271041e-05 1.06997316e-04] [ 1.75432209e-03 4.37145253e-05 2.18193879e-04] [ 1.14563496e-03 6.67489608e-05 -1.06128256e-04] [-1.75438307e-03 -4.37133467e-05 -2.18340971e-04]] Final stress: [-7.34282538e-05 3.35392823e-05 -1.15475957e-05 1.12892072e-05 1.42728518e-04 6.66574488e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-2.49380230e-02 1.17317275e-02 1.51109355e-02] [-2.93838183e-03 -1.53245198e-02 1.55544608e-02] [ 2.49333148e-02 -1.17305996e-02 -1.46610368e-02] [ 2.95560436e-03 1.53172674e-02 -1.40662739e-02] [ 2.03978639e-06 -9.00400498e-04 -2.99399055e-04] [ 7.76991851e-04 4.46597942e-04 -2.98338805e-04] [-7.93231635e-04 4.58294709e-04 -3.20532569e-04] [-7.05645015e-07 5.89772397e-04 -1.64060231e-04] [-5.07773975e-04 -2.93088252e-04 -1.56980195e-04] [ 5.13613725e-04 -2.97271757e-04 -1.63452965e-04] [ 4.68296162e-02 2.57494585e-02 -2.34647309e-03] [-1.75562825e-03 1.68288402e-02 -2.95261707e-02] [-1.90714632e-02 -4.33530426e-02 4.33887383e-02] [-4.68265778e-02 -2.65426982e-02 2.17299971e-03] [ 2.44111886e-03 -1.64360032e-02 2.93569329e-02] [ 1.83761910e-02 4.37553911e-02 -4.35709318e-02] [ 1.48826944e-03 -1.19637760e-03 -1.37678273e-03] [-1.01188712e-02 -8.99021133e-03 -2.19081327e-03] [-1.48742153e-03 1.19583589e-03 1.37772800e-03] [ 1.01203725e-02 8.99188581e-03 2.16759170e-03] [ 1.93106197e-03 -5.33872827e-03 1.82522207e-04] [-4.41589148e-03 -3.46811471e-03 2.71294146e-04] [-1.93472173e-03 5.33875664e-03 -1.76361115e-04] [ 4.42049691e-03 3.46722767e-03 -2.65596134e-04]] Final stress: [-4.95962819e-04 2.88129263e-04 -1.90605860e-04 6.25836921e-04 -9.77891765e-04 9.29875954e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.57437349e-05 1.52087660e-05 -2.04434733e-05] [ 1.82901972e-05 5.04439407e-05 -2.57597247e-05] [-1.93739328e-05 7.66642069e-06 2.77690921e-05] [ 1.23911474e-05 5.74950066e-06 -2.62979128e-05] [ 2.37318542e-05 -7.55984109e-06 -8.04156439e-06] [-1.59280602e-05 -2.73306243e-05 9.81773636e-06] [ 1.50168067e-05 -9.08292453e-06 2.88123154e-05] [ 1.78918427e-05 5.50827265e-05 5.75023615e-05] [ 2.60753195e-05 5.39967544e-06 3.62890506e-05] [ 3.60053759e-05 -2.27038983e-05 9.27729918e-06] [-3.86612997e-05 -1.14200506e-05 -1.19676623e-05] [-7.08124283e-06 1.04669220e-05 2.87028727e-05] [-8.14049691e-06 1.66987539e-05 1.07706141e-07] [-3.82442927e-05 -3.52098029e-05 -3.93927604e-05] [-2.62332270e-05 -2.19053172e-06 2.60588244e-05] [-2.41553270e-05 2.46791770e-05 -3.85230799e-05] [ 4.86886381e-06 4.47641040e-06 3.60961322e-06] [-1.48503450e-05 5.21789299e-06 -4.68518605e-05] [ 3.06509448e-06 -1.52976126e-05 -1.87248797e-05] [-1.56231198e-05 3.40298384e-06 -1.42974671e-05] [ 9.19194420e-06 -5.78382693e-06 2.36326713e-05] [-1.12687844e-05 -1.68450206e-05 -1.18138271e-05] [ 3.63958496e-05 -3.50643771e-05 -4.54586621e-06] [ 8.92097882e-07 -1.60046595e-05 1.50805354e-05]] Final stress: [0.03275163 0.03331127 0.13515376 0.00081278 0.00049766 0.00060122] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 5.89721531e-07 2.66061509e-06 -5.24866058e-06] [ 7.15130956e-06 1.50402630e-07 -7.11406773e-07] [-1.97286395e-07 7.20771001e-07 -7.03910127e-06] [ 4.18902301e-06 4.26566974e-06 6.34318588e-06] [-1.74433644e-05 -1.22883397e-06 3.42047477e-05] [ 1.01268290e-05 -6.46929207e-06 6.31350818e-06] [-6.90950259e-06 1.10396961e-05 -2.42184395e-06] [ 8.15641042e-06 -7.46776653e-06 -6.43590276e-06] [ 8.76913160e-06 -2.02301705e-06 -3.87599313e-06] [ 6.18639931e-06 -5.26554177e-06 8.00634366e-06] [-5.16291406e-06 -9.31295454e-06 1.22542323e-05] [ 6.82449205e-06 1.69445706e-06 -1.19514090e-05] [ 6.71395311e-06 5.80048145e-07 8.16489842e-06] [ 3.40574397e-06 7.81566929e-07 5.54126270e-07] [ 1.12007955e-05 -3.47560890e-06 -2.14103734e-05] [-1.04832981e-05 6.82081331e-06 -2.76407025e-06] [ 8.27630122e-06 -2.07891412e-06 3.80626795e-06] [ 1.38321793e-05 -5.30207837e-06 -6.73831870e-06] [ 2.49067567e-06 -2.98996059e-06 5.65180221e-06] [ 1.30275029e-05 -4.26164016e-06 -3.25372252e-06] [-2.25165641e-05 2.02387894e-06 -8.14386910e-06] [-2.25281217e-05 8.63537685e-06 -2.26807017e-06] [-1.26996612e-05 -2.55235413e-06 -6.76957209e-06] [-1.29997556e-05 1.30546664e-05 3.73320119e-06]] Final stress: [ 0.03275201 0.03331193 0.1351541 0.00081216 -0.00049719 -0.000601 ] Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.16555966e-06 4.70343659e-06 -3.49047824e-06] [-1.98209951e-06 -9.70587305e-06 6.08365455e-06] [ 4.70863579e-06 -2.96054727e-06 -1.03549452e-05] [-7.02752046e-06 1.10478545e-05 6.26040698e-06] [-4.92200654e-06 1.78689773e-05 -4.83549514e-06] [ 2.29117443e-06 -8.47494821e-06 -1.45685602e-06] [ 1.48744551e-05 -6.13921633e-06 -4.99050169e-06] [ 1.14054454e-06 1.66704912e-05 6.06322632e-06] [-7.25870584e-06 -1.47300774e-05 -7.54148976e-07] [ 5.93935416e-06 -1.17956024e-05 -3.59410984e-06] [ 7.95079544e-06 7.70137902e-06 3.32423320e-06] [-6.13790926e-07 1.58322584e-06 1.93381987e-06] [-1.66755903e-05 1.10323882e-05 2.86475899e-06] [-8.63327940e-06 -6.66957444e-06 3.91218640e-06] [-2.77959055e-06 3.19924754e-06 -3.54905550e-06] [ 8.55721930e-06 -1.60521042e-06 4.17384838e-06] [ 9.10552882e-06 -4.81197498e-06 1.68938416e-06] [-2.74888454e-06 -2.29569652e-06 -8.05256766e-06] [-2.59131190e-06 5.75376036e-07 -2.16815322e-06] [ 4.93506938e-06 -2.53063203e-06 -5.30516703e-06] [-5.71186390e-06 1.27030374e-06 5.16785889e-06] [ 8.20773901e-06 1.87323386e-06 8.19146744e-06] [-1.50692223e-07 5.78576492e-07 -1.65509403e-06] [-5.44962015e-06 -6.38513737e-06 5.41727311e-07]] Final stress: [ 3.35822084e-02 3.24711557e-02 1.35149033e-01 2.51310644e-06 -9.46309299e-04 1.18748953e-04] Minimization converged after 194 steps. Minimization converged after 191 steps. Minimization converged after 199 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.94503967e-05 4.58757902e-04 -4.11515581e-05] [-1.94504015e-05 -4.58757906e-04 -4.11570701e-05] [-1.94504060e-05 -4.58757904e-04 4.11575915e-05] [ 1.94504033e-05 4.58757906e-04 4.11564054e-05] [ 1.56482900e-13 -3.47109952e-10 -5.25424149e-12] [ 3.01310379e-10 1.72392739e-10 -4.86158336e-12] [-3.01841774e-10 1.75361003e-10 -5.18432519e-12] [-8.21620679e-12 4.55824423e-09 -1.40238710e-09] [-3.94181798e-09 -2.27162500e-09 -1.39906697e-09] [ 3.95741995e-09 -2.28691005e-09 -1.40232365e-09] [-5.86100927e-05 -4.52915975e-05 1.88906499e-10] [-1.57404979e-04 1.99389233e-04 1.88307340e-10] [ 7.19133512e-05 1.77879543e-04 1.86133016e-10] [ 5.86100897e-05 4.52940425e-05 -5.89758915e-10] [ 1.57402866e-04 -1.99390452e-04 -5.83547206e-10] [-7.19112330e-05 -1.77880768e-04 -5.86998153e-10] [-8.56974185e-05 2.75577432e-05 1.17218876e-05] [ 8.56974183e-05 -2.75577434e-05 1.17218756e-05] [ 8.56974184e-05 -2.75577431e-05 -1.17219411e-05] [-8.56974187e-05 2.75577435e-05 -1.17218535e-05] [ 6.78899173e-05 1.19694101e-05 5.16313492e-06] [-6.78899179e-05 -1.19694104e-05 5.16305853e-06] [-6.78899187e-05 -1.19694102e-05 -5.16305565e-06] [ 6.78899180e-05 1.19694102e-05 -5.16305908e-06]] Final stress: [ 1.47558030e-05 1.41345099e-05 9.87050640e-06 -2.68017626e-14 -4.13536398e-15 1.44414482e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 9.78259385e-03 -5.38591273e-03 8.76552997e-04] [ 8.31117737e-03 -2.79103251e-03 -2.38144183e-03] [ 1.10478161e-03 -4.82016082e-03 -2.90012597e-04] [ 4.43529268e-04 -3.80930498e-03 -1.60041579e-04] [-7.09953833e-03 -1.23354422e-03 4.76645560e-03] [-1.82577843e-03 8.61378126e-03 1.13110049e-03] [ 3.71427767e-03 -8.74260154e-04 -8.10285306e-03] [-1.01140145e-02 2.12289105e-03 -7.59146266e-03] [-3.26794671e-03 8.84607803e-03 -6.12240025e-03] [ 6.25812382e-03 -5.75964759e-03 5.69669550e-03] [-9.72046813e-03 -2.27480467e-03 5.10048976e-05] [ 3.54435386e-03 -7.57301996e-04 7.77955904e-03] [ 2.71291127e-03 3.33070553e-03 -1.17024103e-03] [ 3.23507630e-03 -2.40430990e-03 9.84963641e-05] [-1.71434131e-03 1.01835602e-02 -1.59083429e-03] [-2.37393273e-03 -3.92941979e-03 7.15743654e-03] [-3.50220008e-04 1.31363185e-03 2.40159366e-04] [-1.27114273e-03 2.01005486e-05 -6.48087688e-05] [-1.59787308e-03 5.02364133e-04 3.60282171e-04] [-1.49080192e-03 7.00942476e-04 7.88083567e-05] [ 1.27433720e-03 -7.08505710e-04 -1.55797759e-03] [ 1.20770736e-04 -4.27022457e-04 -4.49261434e-04] [-2.94848064e-04 2.28039463e-04 -4.23827670e-05] [ 6.18973011e-04 -6.86867035e-04 1.28716653e-03]] Final stress: [-3.67398133e-04 -1.99906974e-04 -1.92659832e-04 1.33344420e-06 4.44962441e-05 -7.72574377e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 2.90941826e-10 1.42014000e-05 9.57248060e-06] [-3.02439376e-10 -1.42007093e-05 9.58364101e-06] [ 9.20122820e-10 -1.41996205e-05 -9.53687698e-06] [-6.13716383e-10 1.42012119e-05 -9.60584934e-06] [-3.31951364e-10 4.17391743e-08 9.51413232e-09] [-3.90689000e-08 -2.10036072e-08 1.04047201e-08] [ 4.00179727e-08 -2.19375041e-08 1.12981866e-08] [ 4.59099667e-10 5.07633187e-08 -1.20086424e-08] [-4.87567254e-08 -2.69692101e-08 -1.48359471e-08] [ 4.75316985e-08 -2.57275724e-08 -1.37415799e-08] [ 8.45287840e-10 -3.44691386e-06 -7.28514514e-09] [ 7.84364491e-06 -2.60751547e-05 -8.60477264e-09] [-7.84514993e-06 -2.60733112e-05 -7.66897962e-09] [-5.16126808e-10 3.40512315e-06 6.54531830e-09] [-7.80600943e-06 2.60958115e-05 6.25494488e-09] [ 7.80693522e-06 2.60946804e-05 6.84446641e-09] [-8.47815984e-11 -2.61348291e-05 -8.98883066e-06] [ 8.38936698e-11 2.61351233e-05 -8.98846604e-06] [-5.76728110e-11 2.61351157e-05 8.98931563e-06] [ 8.49470216e-11 -2.61347385e-05 8.98782199e-06] [ 1.07567177e-10 2.15138574e-05 2.23467063e-05] [-7.45073785e-11 -2.15139005e-05 2.23457228e-05] [-3.91685709e-11 -2.15138506e-05 -2.23450269e-05] [ 8.36821168e-11 2.15138402e-05 -2.23473551e-05]] Final stress: [ 2.22690782e-04 1.34248518e-04 1.19448234e-04 -2.64054953e-12 -9.17949523e-13 6.13988017e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 6.83565093e-10 2.07113059e-05 5.58844590e-05] [-2.70298662e-10 -2.07112779e-05 5.59601428e-05] [ 3.69692342e-10 -2.07113295e-05 -5.58755126e-05] [ 2.54496202e-10 2.07112233e-05 -5.59454634e-05] [ 2.12235161e-10 -2.31454084e-08 -4.80321588e-09] [ 2.04973354e-08 1.14169013e-08 -4.86210944e-09] [-2.09275406e-08 1.19086471e-08 -5.11901943e-09] [ 5.49628379e-10 1.59346378e-08 -4.19904400e-09] [-1.42298987e-08 -8.64500660e-09 -4.71820949e-09] [ 1.29093828e-08 -7.26867649e-09 -3.63627658e-09] [-4.60582850e-10 8.10211195e-05 -1.28241999e-08] [ 2.34837181e-05 1.15481886e-05 -1.29923906e-08] [-2.34829567e-05 1.15472212e-05 -1.24142608e-08] [ 7.03038905e-10 -8.10334735e-05 1.34158179e-08] [-2.34734403e-05 -1.15423461e-05 1.32220413e-08] [ 2.34721030e-05 -1.15407594e-05 1.35690220e-08] [ 3.43255979e-12 3.30598082e-05 9.71441774e-06] [ 7.14010517e-11 -3.30598500e-05 9.71577590e-06] [ 1.65228942e-12 -3.30598707e-05 -9.71386343e-06] [ 9.22122934e-11 3.30598106e-05 -9.71586719e-06] [-3.57013308e-11 -2.08397416e-05 -3.91740724e-05] [ 9.00036467e-11 2.08397602e-05 -3.91725565e-05] [ 9.86950430e-11 2.08397634e-05 3.91744172e-05] [-3.67688657e-11 -2.08397532e-05 3.91734847e-05]] Final stress: [-1.94042350e-04 -1.05594133e-04 -9.80997041e-05 5.03748913e-13 -6.24409613e-13 -5.03678505e-13] Minimization converged after 7 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.82000659e-08 4.89291328e-04 -3.50650367e-04] [-3.18978118e-08 -4.89239732e-04 -3.52284601e-04] [ 1.45588325e-08 -4.89289504e-04 3.52004126e-04] [-2.34230779e-08 4.89312067e-04 3.50087680e-04] [-9.55102208e-08 2.42896215e-06 5.99546672e-07] [-2.22606846e-06 -1.14675559e-06 6.44633160e-07] [ 2.41308799e-06 -1.36556686e-06 7.65208909e-07] [ 9.30212291e-09 1.34221703e-06 -3.82600549e-07] [-1.20032958e-06 -6.88692684e-07 -4.09686585e-07] [ 1.17897111e-06 -6.65320441e-07 -3.92745318e-07] [ 2.98232417e-08 -2.86270020e-04 -3.07202030e-08] [ 7.44990869e-05 2.40295917e-04 -1.18274820e-08] [-7.45469567e-05 2.40358532e-04 -1.57482638e-10] [ 5.34335611e-08 2.85860304e-04 3.75948721e-08] [-7.41695393e-05 -2.40176128e-04 3.15864706e-08] [ 7.40819676e-05 -2.40063410e-04 3.80267690e-08] [-1.15265765e-08 2.82319478e-04 3.01240462e-04] [ 1.04661796e-09 -2.82306421e-04 3.01239764e-04] [-1.14934298e-08 -2.82297743e-04 -3.01239762e-04] [ 1.43637413e-09 2.82308315e-04 -3.01246806e-04] [ 3.14539683e-09 1.68611308e-04 3.21666702e-04] [ 4.65369943e-09 -1.68614945e-04 3.21611035e-04] [ 5.89405338e-09 -1.68614783e-04 -3.21628294e-04] [ 2.13760804e-09 1.68610593e-04 -3.21688797e-04]] Final stress: [ 1.29927984e-04 1.55757107e-04 1.33644772e-04 8.12994970e-11 -1.37875197e-11 -1.34863768e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-5.28164790e-10 1.37162997e-05 8.11381759e-07] [ 5.67098988e-10 -1.37141809e-05 1.27588891e-06] [ 4.59924349e-11 -1.37126891e-05 -9.39920506e-07] [ 1.05416706e-09 1.37154796e-05 -9.78327338e-07] [ 1.22384140e-09 -1.00024338e-07 -4.31371043e-08] [ 8.29146903e-08 4.79682035e-08 -4.08708728e-08] [-8.56276284e-08 5.09554718e-08 -4.28856675e-08] [-9.20377002e-10 3.25621667e-08 2.95423697e-09] [-3.45016246e-08 -1.69607819e-08 -5.19561727e-10] [ 3.61739929e-08 -1.89836017e-08 -1.50996663e-09] [ 5.41196032e-10 -6.06952964e-06 -5.17196383e-08] [ 6.95342457e-06 -1.98322817e-05 -5.25356973e-08] [-6.95439511e-06 -1.98311169e-05 -5.22965915e-08] [ 2.49510412e-10 5.62888840e-06 3.79156974e-08] [-6.57658735e-06 2.00508426e-05 3.83337854e-08] [ 6.57606569e-06 2.00514449e-05 3.74192471e-08] [ 1.27102884e-10 -1.64242752e-05 3.46712922e-06] [-1.46123891e-10 1.64246079e-05 3.46591271e-06] [ 1.75720272e-10 1.64244230e-05 -3.46086594e-06] [-1.01224945e-10 -1.64240161e-05 -3.47366181e-06] [ 5.17275112e-11 8.08706819e-06 7.25581700e-06] [ 5.13260006e-11 -8.08679128e-06 7.25897983e-06] [ 4.00476089e-11 -8.08671720e-06 -7.25408475e-06] [ 1.00946251e-10 8.08702665e-06 -7.25939694e-06]] Final stress: [ 6.33004232e-05 2.11399192e-05 -3.70573963e-05 -2.22878220e-12 -3.04144076e-12 1.91844032e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-7.63853897e-10 -1.56335635e-06 4.02666424e-06] [ 2.26262700e-10 1.56420219e-06 4.05814872e-06] [-8.61554180e-11 1.56601155e-06 -3.79361859e-06] [ 3.59594632e-10 -1.56488477e-06 -3.92520352e-06] [ 3.04647983e-10 -1.01010223e-07 -3.34228802e-08] [ 8.88047074e-08 5.04293475e-08 -3.38116123e-08] [-8.94907112e-08 5.11551379e-08 -3.43202714e-08] [-9.95284455e-10 8.61350509e-08 -3.95949218e-08] [-7.97228122e-08 -4.32063225e-08 -4.19335374e-08] [ 8.21226662e-08 -4.57520197e-08 -4.38071127e-08] [ 1.02351255e-09 1.48383875e-05 -3.58189824e-08] [ 7.81614828e-06 1.62272055e-05 -3.66478694e-08] [-7.81786316e-06 1.62293790e-05 -3.62763268e-08] [ 3.49624718e-10 -1.47423010e-05 -6.78632435e-09] [-7.90012409e-06 -1.62767610e-05 -6.91447459e-09] [ 7.89965883e-06 -1.62760853e-05 -7.42621545e-09] [ 1.07578668e-11 2.12791005e-05 2.89912727e-06] [-1.29921407e-10 -2.12789314e-05 2.90219203e-06] [ 5.36076183e-11 -2.12792963e-05 -2.90349896e-06] [-1.01310710e-10 2.12794860e-05 -2.90418446e-06] [ 5.50773871e-11 -9.90640445e-06 -8.18650259e-06] [ 3.83542554e-11 9.90644721e-06 -8.18390962e-06] [-7.16014227e-12 9.90652108e-06 8.18385306e-06] [ 1.28536681e-10 -9.90647083e-06 8.18369295e-06]] Final stress: [-3.43303739e-05 8.21655318e-06 5.80372214e-05 -7.39903295e-13 -2.34035275e-12 2.59848875e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 7.46411769e-09 -2.35698634e-05 -1.52670272e-04] [-3.05492975e-09 2.35674265e-05 -1.53469462e-04] [ 8.65535231e-09 2.35807729e-05 1.53682430e-04] [-1.42408299e-09 -2.35760821e-05 1.52804308e-04] [-4.49583582e-09 4.02194350e-09 5.99222503e-08] [ 3.38999093e-08 9.69427002e-09 4.19803775e-08] [-2.44148287e-08 -9.57429525e-10 4.86649334e-08] [ 1.22272277e-08 2.92549957e-07 -1.36245077e-07] [-2.91225208e-07 -1.66544234e-07 -1.58481560e-07] [ 2.63136323e-07 -1.36157423e-07 -1.36977568e-07] [ 1.07755171e-09 1.78937770e-04 -1.52147938e-08] [-1.50139990e-04 -4.09819317e-05 -2.29254669e-08] [ 1.50137186e-04 -4.09790517e-05 -1.77173465e-08] [ 1.20097166e-09 -1.77462776e-04 -5.60797510e-09] [ 1.48839666e-04 4.02384617e-05 -5.09075447e-09] [-1.48842904e-04 4.02417538e-05 -2.95243664e-09] [-7.28637484e-10 1.04004960e-04 3.62827734e-05] [ 1.47112583e-09 -1.04005654e-04 3.63060518e-05] [-6.08897210e-10 -1.04007902e-04 -3.63058929e-05] [ 1.59913868e-09 1.04007824e-04 -3.62844127e-05] [ 5.25187727e-10 4.54441283e-06 -2.87419140e-05] [ 6.07993867e-11 -4.54370140e-06 -2.87358501e-05] [ 5.88371211e-10 -4.54310723e-06 2.87390818e-05] [ 8.83554896e-11 4.54408060e-06 2.87438038e-05]] Final stress: [-1.37658031e-04 -1.06466684e-04 -1.48111130e-04 -2.01533175e-11 -8.08583944e-12 1.48499822e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.28780171e-06 7.46160497e-05 -3.37787990e-04] [ 1.36514875e-09 -1.15781300e-04 5.13202912e-04] [-1.20559273e-06 -7.57933303e-05 9.86168762e-04] [-3.71737950e-07 1.15844631e-04 -8.26664020e-04] [ 7.86651972e-08 1.77796143e-04 5.93945297e-05] [-1.50700336e-04 -8.83580796e-05 5.82556123e-05] [ 1.50727895e-04 -8.82825010e-05 5.84267631e-05] [-2.26511031e-06 4.05550706e-04 -1.36513933e-04] [-3.45195158e-04 -1.99101370e-04 -1.33433343e-04] [ 3.50055430e-04 -2.04523969e-04 -1.36913293e-04] [-3.97805071e-08 1.75085072e-04 -4.89597712e-04] [-1.17807033e-04 -1.51611858e-04 -4.61064441e-04] [ 1.18072069e-04 -1.51813601e-04 -4.61438118e-04] [-6.95523684e-07 2.11977778e-04 4.55518027e-04] [-2.21307113e-04 -4.16771936e-05 4.28230265e-04] [ 2.22744232e-04 -4.33094177e-05 4.28172083e-04] [ 2.27633103e-08 2.50546735e-04 4.46445798e-05] [-2.56237856e-07 -5.11720819e-05 1.45101189e-04] [ 1.62829740e-08 -2.50889493e-04 -5.28597561e-05] [-2.75094128e-07 5.09406474e-05 -1.41116829e-04] [-5.89754187e-08 -8.60921886e-05 3.97268646e-05] [-9.11087768e-08 -1.58405312e-04 3.38047444e-05] [-1.38345285e-07 8.59997920e-05 -3.42593625e-05] [-2.37545014e-08 1.58454143e-04 -3.89975355e-05]] Final stress: [ 1.02118040e-04 9.00314153e-05 5.80680400e-05 -4.38733034e-05 8.31986672e-10 2.98540918e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 23 steps. Final forces: [[ 1.34785024e-07 -2.92041435e-06 3.21280001e-05] [ 9.74087886e-08 -9.84754348e-06 -4.22451533e-05] [ 1.39148814e-07 2.54576986e-06 -7.04934726e-06] [ 1.18046121e-07 9.83364635e-06 -4.25394351e-07] [ 9.98944378e-08 2.25440751e-05 7.82919683e-06] [-1.96534375e-05 -1.13993388e-05 7.94272924e-06] [ 1.94150016e-05 -1.11466744e-05 7.75224139e-06] [ 1.72526853e-07 4.98447419e-06 -3.17327204e-06] [-3.72610575e-06 -2.53112167e-06 -2.91407966e-06] [ 3.34099685e-06 -2.10920340e-06 -2.62643436e-06] [ 1.44487775e-07 4.50778657e-05 -2.16647198e-06] [-1.91716164e-05 -8.51792858e-06 1.11076131e-05] [ 1.88933852e-05 -8.19073392e-06 1.11245142e-05] [ 1.68385184e-07 -1.25438805e-08 3.12549560e-06] [-1.97370982e-05 -1.42872107e-05 -1.00358156e-05] [ 1.94162317e-05 -1.39070003e-05 -1.00460973e-05] [ 1.01946792e-08 1.75298113e-06 5.54983600e-05] [ 1.85338087e-08 -2.89120974e-05 5.51751051e-05] [ 1.10755893e-08 -1.74051369e-06 -5.61802055e-05] [ 1.98557760e-08 2.88368085e-05 -5.44576026e-05] [ 2.10655606e-08 2.08927689e-05 -1.02122622e-05] [ 2.26388923e-08 -3.45150782e-05 -1.20591170e-05] [ 2.42104808e-08 -2.09304916e-05 1.01481272e-05] [ 2.03847140e-08 3.44995047e-05 1.17598702e-05]] Final stress: [ 1.18829359e-04 7.64371176e-05 6.29031138e-05 4.06166935e-05 -7.16048237e-11 -1.10635978e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 57 steps. Final forces: [[ 2.00238937e-03 1.32981364e-03 -1.63994053e-03] [ 1.57158859e-04 3.48879768e-03 1.58850328e-03] [-6.70847895e-04 1.19803094e-03 -1.65005389e-03] [-2.26911881e-03 3.60070567e-03 1.66232389e-03] [ 3.44692932e-04 2.21431482e-03 1.33548776e-03] [ 2.44537947e-03 -3.03955677e-03 2.46260082e-03] [-1.95222633e-03 -2.80586735e-03 3.69854976e-03] [-3.69638664e-04 -2.46159004e-03 -4.07578543e-03] [ 2.24606428e-04 -1.79740924e-03 -1.91279677e-03] [-3.38752700e-04 -3.09872396e-03 -1.45487377e-03] [-4.02160720e-04 9.55344753e-04 -3.77299532e-03] [ 4.57123856e-04 4.98340478e-04 2.49295870e-03] [ 3.90722011e-04 -8.20678734e-04 1.28020934e-03] [-1.44943804e-04 1.15785955e-03 -3.82922873e-03] [ 1.85441454e-04 2.71085285e-04 -2.65602506e-04] [ 1.32833208e-04 -1.28945470e-04 4.16938555e-03] [ 9.94937583e-05 -5.15492247e-04 -4.18751353e-04] [ 1.34855519e-04 -6.15436331e-04 7.61504332e-04] [-1.47023534e-04 -6.78182033e-05 -2.93992703e-04] [-1.04831312e-04 -1.32668183e-03 1.56677024e-04] [ 7.63800964e-06 7.55059997e-04 -1.80562463e-03] [-1.14614833e-04 3.47308759e-04 1.55680761e-03] [ 6.48482491e-05 8.63883007e-04 1.14262039e-04] [-1.33024521e-04 -2.34438311e-06 -1.59624463e-04]] Final stress: [-2.71819172e-04 -3.91671724e-04 -2.42723523e-04 -4.41835641e-05 1.53550596e-05 -3.45400109e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.00007001e-06 1.97303205e-05 -9.99613592e-05] [-4.38547729e-07 -3.97490718e-05 -8.41448094e-05] [ 8.33345839e-07 -1.84855388e-05 -9.91851825e-05] [-1.69315373e-07 3.96884568e-05 -6.77392906e-05] [-9.26684974e-07 -1.39383864e-04 -1.90196819e-05] [ 1.20829897e-04 7.06501282e-05 -1.93734043e-05] [-1.18892103e-04 6.84636808e-05 -1.80292563e-05] [ 9.37071579e-07 -4.59897564e-04 1.12135652e-04] [ 3.93456066e-04 2.27983247e-04 1.08899661e-04] [-3.95744595e-04 2.30385523e-04 1.10759149e-04] [ 4.68687400e-07 3.19070129e-04 -6.31418640e-06] [-2.91860158e-04 -1.81109193e-04 1.22554596e-05] [ 2.91013216e-04 -1.80080985e-04 1.28012078e-05] [ 1.09877737e-06 3.60308410e-04 3.28416245e-05] [-2.96638982e-04 -1.60091762e-04 1.32626433e-05] [ 2.94666451e-04 -1.57686159e-04 1.36966418e-05] [-1.29464328e-07 -4.20492055e-05 -6.72726542e-05] [ 1.17227913e-07 -2.68233476e-06 -5.38688052e-05] [-1.30912944e-07 4.22677196e-05 5.79148326e-05] [ 1.27834912e-07 3.05764349e-06 6.53143764e-05] [ 8.62645786e-08 -7.02148801e-05 -9.79712416e-05] [ 1.03252595e-07 2.47958443e-05 -8.83594609e-05] [ 1.58387609e-07 6.99189917e-05 8.43508141e-05] [ 3.42140326e-08 -2.48895377e-05 9.70072705e-05]] Final stress: [-8.80469288e-05 -5.39567655e-05 -3.92230053e-05 4.00976141e-05 -2.93404038e-10 -2.81527983e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 49 steps. Final forces: [[-7.25920621e-04 1.01834934e-03 -1.42812294e-03] [ 1.67139582e-04 -9.92411412e-04 7.81995210e-04] [ 5.11867880e-04 9.96260476e-05 2.08689354e-04] [-6.40269848e-04 -1.51555425e-03 -7.26971430e-04] [ 5.82799514e-04 1.40989701e-04 1.72126220e-03] [-5.65763920e-04 -2.94283277e-04 8.71872906e-04] [ 7.65879625e-04 3.63972957e-05 2.06769609e-03] [-2.92937968e-04 -1.93942129e-04 -3.92918748e-03] [-1.66528735e-03 -7.89132811e-04 1.41638497e-04] [ 2.21571935e-03 -1.51916077e-03 -4.45426353e-05] [ 8.79216991e-04 -4.54736885e-04 8.90635749e-04] [ 1.00634665e-04 -9.57363675e-06 1.72174307e-03] [-1.93360396e-03 1.98633344e-03 1.66804922e-03] [ 3.81521273e-04 -3.93010419e-04 -1.19920119e-03] [ 9.52891592e-04 8.49360735e-04 -1.38890720e-03] [-9.17047143e-04 1.26535278e-03 -1.63660212e-03] [ 5.91428719e-05 1.60031003e-04 1.01932574e-04] [-3.18366092e-05 1.68951705e-04 -8.02378002e-05] [ 8.72232239e-05 -1.10834622e-04 -2.98208049e-04] [-4.86488657e-05 1.50299649e-04 2.60449740e-04] [ 1.30401188e-05 1.52158671e-04 -3.22359885e-04] [-1.26097609e-04 1.31310140e-04 4.00036369e-04] [ 1.42253447e-04 1.11315841e-04 7.59076149e-05] [ 8.80837661e-05 2.16385823e-06 1.42432134e-04]] Final stress: [-2.40157429e-04 -3.81281421e-05 -1.70006582e-04 4.52024722e-06 -3.27127884e-05 -5.24496668e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-6.19115365e-06 -2.35257603e-06 9.55203587e-05] [-5.79767191e-06 2.15352331e-06 -2.03313582e-05] [ 5.92064430e-06 1.51246632e-06 -2.12281326e-05] [ 6.27944561e-06 -1.39447009e-06 9.63112448e-05] [-4.35891653e-08 -1.23369440e-04 -2.99121086e-05] [ 1.05957583e-04 6.14564962e-05 -2.93127095e-05] [-1.06040365e-04 6.14539753e-05 -2.94678590e-05] [-4.26672928e-08 7.44064478e-05 -1.87652426e-05] [-6.15969829e-05 -3.65393721e-05 -1.73086022e-05] [ 6.18757148e-05 -3.67489369e-05 -1.76873782e-05] [ 2.51838802e-07 4.32801268e-05 1.84380565e-05] [-2.98852696e-05 -1.22584197e-05 2.62513011e-05] [ 2.94173386e-05 -1.16970357e-05 1.08858406e-05] [ 3.38703754e-07 2.56137949e-05 -2.35533479e-05] [-3.22005535e-05 -2.31012045e-05 -3.05035803e-05] [ 3.16659456e-05 -2.24010768e-05 -1.57711997e-05] [-1.65016845e-05 1.91888710e-05 5.10837104e-05] [-1.65437660e-05 -1.92925795e-05 4.95641204e-05] [ 1.65243065e-05 -1.91233647e-05 -5.18365034e-05] [ 1.64992909e-05 1.90365770e-05 -4.79833876e-05] [-1.31174337e-05 2.73623587e-05 1.38911128e-05] [-1.30881172e-05 -2.72758625e-05 1.27492198e-05] [ 1.31497488e-05 -2.73275617e-05 -1.19142285e-05] [ 1.31686937e-05 2.74172629e-05 -9.11932661e-06]] Final stress: [ 1.18360482e-04 7.71358201e-05 6.26596535e-05 -6.66611000e-10 3.98923903e-05 -4.69251678e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 48 steps. Final forces: [[-5.23849527e-03 3.15641396e-03 7.14394370e-03] [ 1.02362952e-03 1.27874960e-02 -5.01351064e-03] [ 6.48083278e-04 -3.36013884e-03 -7.57648931e-03] [-1.39534858e-03 7.33600128e-03 1.04678837e-02] [ 2.24518711e-03 -1.81748327e-03 4.85263580e-03] [ 2.45132712e-03 -4.26490510e-03 -2.12596473e-03] [-1.63665584e-03 -1.89850023e-03 1.86541439e-03] [-4.63333402e-04 5.13179193e-03 3.07878583e-03] [ 2.50143593e-03 5.87121512e-03 -1.44722796e-02] [ 8.41756464e-04 6.84256042e-03 -8.41900677e-03] [-5.05929927e-04 -1.80656091e-03 -1.01067712e-02] [ 3.76296342e-03 -5.48853364e-03 -1.29380009e-02] [-5.72121933e-03 -5.16250065e-03 -1.36587045e-02] [-5.68809074e-04 -1.40221153e-03 2.46377443e-02] [ 6.80275168e-03 -4.52242003e-03 1.17892912e-02] [-3.62408550e-03 -6.82001642e-03 9.38157979e-03] [ 7.19946693e-04 -1.53926495e-03 -1.79340109e-03] [-5.59203569e-07 4.20209846e-03 2.46787776e-03] [-4.24797466e-05 -1.53883218e-03 9.64673349e-04] [-7.68809342e-04 7.31611008e-04 -1.75486169e-03] [ 2.98616643e-07 -2.29506723e-03 8.64764180e-04] [-4.14630746e-04 5.17969230e-04 -1.35545292e-04] [-2.25686455e-04 -3.96636219e-03 -2.70525807e-03] [-3.91337419e-04 -6.94360236e-04 3.18519969e-03]] Final stress: [-2.56742522e-04 -3.95210697e-04 -2.49151393e-04 4.61796977e-05 -5.83049198e-05 -4.53555670e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-1.04405640e-05 7.54586931e-05 9.06892336e-04] [-1.11263696e-05 -7.71422166e-05 -6.26608192e-05] [ 1.08842362e-05 -7.87630318e-05 5.38169953e-04] [ 1.06933519e-05 7.55269233e-05 3.74109335e-04] [-3.17209872e-07 -3.67513610e-04 -8.57323947e-05] [ 3.18830619e-04 1.84393986e-04 -8.63741517e-05] [-3.18166035e-04 1.83645746e-04 -8.57510214e-05] [ 6.31743109e-07 1.51792264e-03 -4.15627618e-04] [-1.30976808e-03 -7.58745591e-04 -4.11976351e-04] [ 1.30844848e-03 -7.57254966e-04 -4.11783318e-04] [-8.06564586e-07 -5.11314212e-05 2.17530169e-05] [ 2.37878759e-05 -2.39870069e-06 5.26309057e-05] [-2.24817334e-05 -4.08338448e-06 -7.43530077e-06] [ 3.62519429e-07 -5.45276990e-05 -1.21586941e-04] [ 7.90811166e-05 5.75211340e-05 -1.52273896e-04] [-7.95623683e-05 5.82179800e-05 -9.20029042e-05] [-9.81090720e-06 -1.57681270e-05 -8.95852373e-05] [-9.71379301e-06 1.54789058e-05 -1.00483453e-04] [ 9.71050719e-06 1.58871758e-05 9.01567271e-05] [ 9.88732681e-06 -1.62133627e-05 9.77992669e-05] [-1.01213891e-05 -6.65029080e-05 -9.45147375e-05] [-1.00346733e-05 6.62379715e-05 -1.16436165e-04] [ 1.00877242e-05 6.67349970e-05 1.30526597e-04] [ 9.94419297e-06 -6.69811335e-05 1.22186171e-04]] Final stress: [-8.83275418e-05 -5.69411892e-05 -3.77043089e-05 2.00719432e-09 4.29154131e-05 -3.74088825e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 41 steps. Final forces: [[ 1.44530003e-04 -2.92470319e-04 -1.15247660e-06] [-1.37203214e-04 2.86802014e-04 1.36344428e-04] [-1.43338197e-04 2.90932778e-04 -3.54570556e-06] [ 1.39771296e-04 -2.89721015e-04 -1.32462426e-04] [-1.00798899e-06 4.34751864e-06 -4.76541892e-08] [ 6.41039758e-06 3.85604366e-07 -3.73988152e-06] [-6.87720829e-06 -4.66522189e-07 -5.97054649e-06] [-1.05511245e-06 -6.51943194e-06 -1.33311639e-06] [ 2.97510958e-06 4.04673487e-06 -1.71734244e-06] [-3.06015159e-06 2.63017015e-06 -5.70121501e-08] [-7.55151509e-04 -7.99578260e-05 -1.99268939e-05] [ 2.35517566e-04 -6.07008774e-04 -1.93164662e-05] [ 7.11398032e-04 7.00785821e-04 -2.57832252e-05] [ 7.55112158e-04 8.11150558e-05 2.36511379e-05] [-2.35591332e-04 6.06752541e-04 2.52872801e-05] [-7.12515539e-04 -7.00624239e-04 3.04877852e-05] [-5.96436610e-05 1.82389895e-05 1.22740163e-04] [ 5.96343552e-05 -1.89415246e-05 1.25969456e-04] [ 5.95258879e-05 -1.89730226e-05 -1.22448973e-04] [-6.00871607e-05 1.91894100e-05 -1.25571157e-04] [-2.51174387e-05 1.27231651e-04 3.15806223e-05] [ 2.54031619e-05 -1.27459101e-04 3.36101314e-05] [ 2.56708157e-05 -1.27378062e-04 -3.22921857e-05] [-2.53002714e-05 1.27061548e-04 -3.43059421e-05]] Final stress: [-1.76885399e-04 -1.65923399e-04 -1.45058644e-04 -2.59255622e-08 2.33439310e-08 -3.40450594e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[-2.41539228e-04 -2.52331916e-04 1.50316596e-04] [ 2.42341230e-04 2.36434800e-04 1.84693971e-04] [ 2.43420249e-04 2.45131250e-04 -1.63099060e-04] [-2.41750273e-04 -2.28682809e-04 -1.84206588e-04] [ 3.37321286e-06 1.75466001e-06 -4.57630868e-06] [-5.48916528e-06 -5.01657445e-06 -1.43154766e-06] [ 3.13312803e-07 1.87732782e-06 -3.51351639e-06] [ 1.22586134e-06 -1.21624706e-06 -3.86287774e-06] [-1.82041489e-05 -4.77430698e-07 -2.49328373e-06] [ 1.63379215e-05 1.94841475e-06 -1.65126696e-06] [ 4.16033266e-04 3.99098978e-05 4.98163059e-06] [-6.77418356e-05 9.78924801e-04 -3.54632267e-06] [-4.64194039e-04 -9.38986854e-04 -1.77248607e-06] [-4.14435186e-04 -5.50559098e-05 -5.47962489e-06] [ 6.88928810e-05 -9.74218725e-04 1.75249248e-05] [ 4.60132773e-04 9.47450854e-04 1.78074720e-05] [ 1.44325540e-05 6.74639109e-05 4.24513533e-05] [-1.39909077e-05 -6.76888593e-05 4.30982808e-05] [-1.38862732e-05 -6.65314765e-05 -4.17153798e-05] [ 1.44458985e-05 6.93572201e-05 -4.23413010e-05] [ 7.68120271e-05 5.25521024e-05 -1.29940382e-04] [-7.60254477e-05 -5.28225047e-05 -1.30090959e-04] [-7.72254458e-05 -5.30086777e-05 1.29846751e-04] [ 7.67207632e-05 5.32327447e-05 1.28999925e-04]] Final stress: [-1.89122585e-04 -1.71882476e-04 -1.41617098e-04 -9.63419100e-08 -4.96489352e-09 3.74588063e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 8.11623527e-04 5.35536387e-04 3.44146443e-03] [-8.47819238e-04 -7.04401152e-04 -4.12876463e-03] [-7.63946834e-04 -6.90176874e-04 -3.94914108e-03] [ 8.23433578e-04 6.38093548e-04 2.89327050e-03] [ 6.73459456e-05 -5.86802987e-06 2.20151430e-04] [ 4.09006776e-04 4.41894749e-06 8.60509084e-05] [-5.11645992e-04 1.41791197e-04 5.73098767e-05] [-4.21256838e-05 1.72574267e-04 -6.25279938e-05] [-8.21637586e-05 -1.78768717e-05 2.02769996e-05] [ 1.19869742e-04 -8.84949755e-05 3.65673672e-05] [-3.82616895e-03 -2.74333783e-04 1.48302079e-03] [ 4.00702873e-04 -2.15948303e-03 1.45421376e-03] [ 1.57648374e-03 2.19147212e-03 1.57403964e-03] [ 3.81638040e-03 2.78743078e-04 -1.18362742e-03] [-1.90297381e-04 2.20792353e-03 -1.05614404e-03] [-1.77213202e-03 -2.16156069e-03 -1.04231805e-03] [ 6.72875017e-04 -9.57288083e-05 7.46692969e-05] [-6.67488581e-04 6.76899804e-05 -1.07890767e-04] [-6.62013618e-04 6.12419014e-05 -2.18386954e-05] [ 6.61896391e-04 -7.35970168e-05 1.35837049e-04] [ 2.68386323e-04 -4.37683458e-05 1.28690528e-03] [-2.61015730e-04 2.14901003e-05 1.20015356e-03] [-2.60812161e-04 2.79586550e-05 -1.26950873e-03] [ 2.59625637e-04 -3.36441340e-05 -1.14216949e-03]] Final stress: [-2.36736461e-04 -3.10599914e-04 -2.83051324e-04 -5.39970266e-07 1.68121652e-07 -6.66897076e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 8.36703900e-04 -1.99967555e-04 1.96890520e-03] [-7.85921586e-04 3.20377449e-04 -2.90312400e-03] [-7.03689666e-04 3.26602614e-04 -3.06241809e-03] [ 7.23829477e-04 -2.06022887e-04 2.18158105e-03] [-3.95154316e-05 -4.36162652e-04 -5.69184810e-05] [ 4.34648075e-05 1.95834713e-04 7.03568615e-05] [ 4.17132974e-05 1.01550476e-04 1.35483327e-04] [ 5.80575945e-05 1.65474687e-04 1.75845967e-04] [-3.78464530e-04 -2.08872687e-04 -2.62632822e-06] [ 2.07455065e-04 -4.30665380e-05 1.48654471e-04] [ 1.76758535e-03 -2.07673688e-04 1.12813002e-03] [-3.73673947e-04 7.68307367e-04 1.08316288e-03] [-6.47155336e-04 -8.34185074e-04 1.11790196e-03] [-1.75879183e-03 6.89694543e-05 -6.94022705e-04] [ 2.80186716e-04 -7.55759001e-04 -7.60734784e-04] [ 7.11375973e-04 8.75102691e-04 -6.89599858e-04] [ 1.27628649e-04 -9.33221870e-06 8.81503464e-05] [-1.29467315e-04 2.80020929e-05 -2.72580370e-05] [-1.41007179e-04 3.86983456e-05 -5.36599149e-05] [ 1.45958968e-04 -1.62373057e-05 7.01865096e-05] [ 3.64712940e-05 5.38386153e-05 4.30663095e-05] [-3.46843163e-05 -4.25542642e-05 -4.11071650e-05] [-2.00654467e-05 -3.55542273e-05 6.70347043e-06] [ 3.20055020e-05 5.26295931e-05 7.33409898e-05]] Final stress: [-2.56232598e-04 -3.39754745e-04 -2.72395721e-04 -1.50916671e-07 -2.29052323e-07 5.66488192e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 3.26890182e-11 -1.53007978e-05 6.14029884e-06] [-3.49843358e-10 1.53011330e-05 6.14978676e-06] [ 7.43020884e-10 1.53009820e-05 -5.96859797e-06] [ 1.27244465e-10 -1.53012015e-05 -6.09164706e-06] [ 3.66755278e-10 -3.68163422e-08 -1.24989791e-08] [ 3.20702741e-08 1.80944517e-08 -1.25220583e-08] [-3.25964108e-08 1.88294957e-08 -1.26731602e-08] [ 4.13417252e-11 1.30783148e-07 -4.14086679e-08] [-1.14424153e-07 -6.57429314e-08 -4.21212942e-08] [ 1.13978388e-07 -6.54285354e-08 -4.15091704e-08] [ 3.07448955e-10 -5.18601512e-05 -2.30045481e-08] [ 3.00067228e-07 4.75937801e-05 -2.32688064e-08] [-3.00612277e-07 4.75944490e-05 -2.20756362e-08] [-2.28618569e-10 5.18668266e-05 1.08546342e-09] [-3.05230132e-07 -4.75971396e-05 9.32547081e-10] [ 3.05559781e-07 -4.75975893e-05 8.33440360e-10] [-9.37766531e-12 3.55459169e-05 -2.16764993e-05] [ 2.60386157e-12 -3.55458795e-05 -2.16749361e-05] [ 4.72131223e-11 -3.55459513e-05 2.16751629e-05] [ 5.10706477e-11 3.55459342e-05 2.16736729e-05] [ 4.24742463e-11 -1.87232005e-05 1.38891584e-05] [-3.50292137e-11 1.87231965e-05 1.38892399e-05] [ 4.21334969e-12 1.87232036e-05 -1.38876269e-05] [ 4.40936176e-11 -1.87232304e-05 -1.38897815e-05]] Final stress: [ 1.33746121e-04 2.22257578e-04 1.20476645e-04 1.68646531e-12 -3.41334377e-12 3.22934328e-13] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-2.98747305e-10 1.59662537e-05 -6.21470497e-06] [ 1.67533844e-09 -1.59595808e-05 -6.21088464e-06] [ 3.92323628e-09 -1.59585192e-05 6.07557285e-06] [-2.03286663e-09 1.59660279e-05 6.20165196e-06] [ 3.50135805e-09 7.96043216e-08 1.92746021e-08] [-9.27856999e-08 -4.76725973e-08 2.99562392e-08] [ 8.70724239e-08 -4.03259077e-08 2.73943989e-08] [ 1.71940913e-09 -1.17387582e-08 1.19143496e-08] [ 3.82250909e-09 1.58373303e-09 4.75832229e-09] [-8.52487780e-09 6.32114389e-09 8.98672567e-09] [ 5.19282212e-09 2.48081378e-05 2.03904348e-08] [-1.27281471e-06 5.80637559e-05 1.60797874e-08] [ 1.26335943e-06 5.80753503e-05 1.86380941e-08] [-7.55638790e-09 -2.51653201e-05 -2.05342805e-09] [ 1.57158598e-06 -5.78857185e-05 -5.30679382e-09] [-1.55878808e-06 -5.79018074e-05 -3.29851895e-09] [ 2.51466042e-10 1.31052217e-04 -2.28769415e-07] [ 3.49228757e-10 -1.31051380e-04 -2.36360599e-07] [ 3.89143828e-10 -1.31050741e-04 2.35878800e-07] [ 2.53904620e-10 1.31051662e-04 2.31110215e-07] [ 6.81047441e-10 -1.28795262e-05 -4.56328450e-05] [-8.35504625e-10 1.28804500e-05 -4.56350500e-05] [-7.36457701e-10 1.28804317e-05 4.56339060e-05] [ 5.96024174e-10 -1.28794658e-05 4.56337606e-05]] Final stress: [ 1.35537773e-04 1.62339331e-04 1.66936144e-04 -2.62827102e-12 -1.37449940e-12 6.25397931e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-2.79733597e-10 -2.56829651e-06 -9.15652509e-07] [-4.99931430e-11 2.56879933e-06 -7.27855873e-07] [-4.23825064e-10 2.56989072e-06 9.09551231e-07] [ 2.05246431e-10 -2.56915001e-06 1.00553751e-06] [ 1.07610904e-10 -1.19857744e-07 -4.73857105e-08] [ 1.04495514e-07 5.99594297e-08 -4.76821891e-08] [-1.04910297e-07 6.03269029e-08 -4.81010707e-08] [-7.50809537e-10 6.62637492e-08 -1.56384625e-08] [-5.74548858e-08 -3.26711865e-08 -1.62070326e-08] [ 5.88899138e-08 -3.43752544e-08 -1.70951630e-08] [-5.53321444e-10 1.13027435e-05 -2.05093748e-08] [-6.16757228e-07 1.21584730e-05 -2.12183760e-08] [ 6.17745902e-07 1.21572542e-05 -2.12485722e-08] [-5.38341594e-12 -1.15762797e-05 -4.14917688e-09] [ 8.50765989e-07 -1.20216959e-05 -4.57791573e-09] [-8.50771376e-07 -1.20216820e-05 -4.72833398e-09] [ 1.46337942e-11 2.45666977e-05 3.07372930e-07] [-9.60558300e-11 -2.45667516e-05 3.04131765e-07] [ 1.40627510e-11 -2.45668340e-05 -3.04635801e-07] [-8.58463300e-11 2.45667984e-05 -3.10006234e-07] [-6.78437306e-11 -1.05731722e-05 2.20252691e-06] [ 1.58962745e-11 1.05733624e-05 2.20278541e-06] [-3.61874701e-12 1.05734185e-05 -2.20196695e-06] [-4.45500303e-11 -1.05732215e-05 -2.20324702e-06]] Final stress: [ 2.06811945e-05 6.34706871e-05 -3.67938931e-05 -6.34056894e-13 -3.11632126e-13 -2.40246233e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.06324646e-09 -2.24998492e-06 1.33628812e-05] [ 3.22880288e-10 2.24863211e-06 1.37878780e-05] [ 1.58987725e-09 2.25120950e-06 -1.36295942e-05] [-2.16291318e-10 -2.25248710e-06 -1.32468103e-05] [-2.81667652e-10 -4.50229582e-07 -1.34517966e-07] [ 3.98742499e-07 2.27411012e-07 -1.39382146e-07] [-3.98106411e-07 2.26689411e-07 -1.38906546e-07] [ 1.64575538e-09 -2.30997206e-07 6.98888368e-08] [ 1.94008601e-07 1.12666597e-07 6.66433239e-08] [-1.97790126e-07 1.16724859e-07 6.95649085e-08] [ 1.79445053e-09 -4.89472993e-05 -1.46605066e-08] [-3.20706348e-05 -2.33854965e-06 -1.55770452e-08] [ 3.20673324e-05 -2.33458504e-06 -1.50889246e-08] [ 3.22079030e-10 4.88793394e-05 -7.15493592e-09] [ 3.21296511e-05 2.37066574e-06 -8.00532437e-09] [-3.21302971e-05 2.37141744e-06 -7.50469780e-09] [-6.40698328e-11 -2.13987496e-05 1.64155462e-06] [ 2.09320949e-10 2.13985706e-05 1.64099961e-06] [-5.02851094e-11 2.13979858e-05 -1.64162620e-06] [ 1.94701061e-10 -2.13981570e-05 -1.64315045e-06] [ 2.52444676e-10 1.34586836e-05 -1.52058971e-05] [ 2.96114582e-11 -1.34588218e-05 -1.51974851e-05] [ 8.76478994e-11 -1.34587091e-05 1.51991262e-05] [ 1.94139704e-10 1.34585742e-05 1.52068247e-05]] Final stress: [ 8.21720407e-06 -3.45502502e-05 5.81747761e-05 -2.35308769e-13 2.35543079e-14 6.27039673e-13] Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-1.99593675e-06 2.65216481e-04 1.13726525e-03] [-1.48206851e-06 -1.98188283e-04 4.57620622e-04] [-2.82923623e-06 -2.68632325e-04 1.17214426e-03] [-1.78952545e-06 1.96830663e-04 5.87974038e-04] [-3.70883034e-06 -3.05380518e-04 -1.54527068e-04] [ 2.66712378e-04 1.57252598e-04 -1.56763582e-04] [-2.58904483e-04 1.48469460e-04 -1.51371075e-04] [-3.91139680e-06 2.16804552e-03 -6.45632704e-04] [-1.86161046e-03 -1.07806342e-03 -6.35572740e-04] [ 1.87052079e-03 -1.08770549e-03 -6.42297574e-04] [-3.03087842e-07 -4.78892100e-04 -1.75002823e-04] [ 3.54865199e-04 2.63912637e-04 -2.21773634e-04] [-3.53635610e-04 2.62847091e-04 -2.22999051e-04] [ 4.60359900e-07 -3.51179533e-04 -1.39666260e-04] [ 3.75438108e-04 1.52525610e-04 -9.31467950e-05] [-3.75572703e-04 1.53138016e-04 -9.31251235e-05] [-3.74008849e-07 1.72633044e-04 3.01669140e-04] [-4.52969987e-07 -8.36939397e-05 3.05875443e-04] [-4.32018172e-07 -1.72261155e-04 -3.07501150e-04] [-4.96210807e-07 8.15948108e-05 -3.37202950e-04] [-1.80597057e-07 -2.23695947e-05 -1.64956690e-04] [-5.33172082e-08 1.73001413e-04 -1.93625873e-04] [-1.09803174e-07 2.43378282e-05 1.99938523e-04] [-1.54577161e-07 -1.73438816e-04 1.72677812e-04]] Final stress: [ 8.85273930e-05 9.88542876e-05 4.95224501e-05 -4.07806869e-05 3.30243341e-09 -3.35846445e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[-7.49785179e-08 -9.61528350e-07 -1.62248969e-05] [-1.06932850e-07 -6.54199148e-06 -7.89688469e-06] [ 5.24938822e-08 9.27314861e-07 -1.30816372e-05] [-1.09090921e-07 6.67131925e-06 -1.05738258e-05] [-2.91720013e-07 3.76922881e-05 9.39321072e-06] [-3.25785393e-05 -1.85533747e-05 9.30913812e-06] [ 3.31717573e-05 -1.92320615e-05 9.70576962e-06] [-4.88126272e-08 -6.49825393e-07 2.23598160e-06] [ 1.06005645e-06 4.63651933e-07 2.44896256e-06] [-9.56061423e-07 3.46672199e-07 2.37550628e-06] [ 1.60048409e-07 -3.27465502e-05 -5.80000786e-07] [ 2.38168640e-05 1.34692942e-05 7.17660839e-06] [-2.40761609e-05 1.38034079e-05 7.25544738e-06] [-2.83472288e-08 -2.68961573e-05 4.68714346e-06] [ 2.71367096e-05 1.61240935e-05 -3.08959162e-06] [-2.70599832e-05 1.60473586e-05 -3.14705755e-06] [-3.79598486e-08 -1.99551807e-05 3.37710418e-05] [-7.49573642e-09 -2.91678072e-06 3.27278080e-05] [-3.06366796e-08 1.99618941e-05 -3.26339073e-05] [-3.79717122e-09 2.88103513e-06 -3.34403698e-05] [ 1.45893453e-08 -2.90164736e-05 5.54393204e-06] [-1.04777897e-08 1.58898917e-05 5.30773477e-06] [-4.30731016e-09 2.90494085e-05 -4.99847725e-06] [ 1.27826107e-08 -1.58577059e-05 -6.27163583e-06]] Final stress: [ 7.59297273e-05 1.18745808e-04 6.36558671e-05 3.96225638e-05 -3.60323694e-10 8.50846081e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[-1.00365612e-04 -5.92250910e-05 -3.78754654e-04] [ 1.24568682e-04 1.38146847e-03 -1.59420043e-04] [-2.08551693e-04 -3.06402519e-04 -3.79025247e-04] [ 3.01595299e-05 1.20587150e-03 -1.51704275e-04] [-4.61918429e-05 9.16446457e-04 2.54764524e-03] [-4.25327580e-04 -1.49830494e-03 7.22604280e-04] [ 2.31889773e-05 -1.00712475e-03 2.11660082e-04] [ 1.96862019e-04 1.57338222e-03 -1.36802649e-04] [ 3.27426248e-05 1.67606939e-03 1.01754929e-03] [ 4.34071865e-04 5.53264058e-04 3.04929654e-04] [ 1.22451823e-04 -5.48008192e-04 8.47702061e-04] [-4.14530176e-05 -1.33051975e-03 -1.35827078e-03] [-2.25974396e-04 -4.01008934e-04 -1.13909752e-03] [-5.38511018e-04 -5.21978188e-04 1.29907765e-03] [ 4.89463854e-04 -3.77458483e-04 -1.75150576e-03] [ 2.26383140e-04 -1.44633991e-03 -1.30427175e-03] [-5.02286631e-06 -7.53332717e-05 -3.15031853e-04] [ 9.31356762e-06 4.43557165e-04 1.78813990e-04] [-1.83201631e-05 -1.30147912e-06 1.85068332e-04] [ 3.06156681e-06 3.75272901e-04 -2.90282515e-04] [-1.55868686e-05 -2.99405185e-04 -1.20819614e-04] [-1.66191352e-05 1.95419825e-04 1.36302993e-04] [-1.21135360e-04 -4.81493593e-04 2.80519886e-04] [ 7.07919030e-05 3.31523044e-05 -2.46886809e-04]] Final stress: [-3.89170231e-04 -1.98966659e-04 -2.68072739e-04 -4.52105653e-05 6.84671941e-07 9.84267517e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-2.48888762e-04 1.36214681e-04 -4.24956765e-04] [-1.86161873e-04 4.24774736e-05 -5.07190017e-04] [-2.77058725e-05 1.81690209e-04 -4.16937114e-04] [ 6.15689989e-05 6.85795550e-05 -5.13937216e-04] [ 3.37980979e-05 1.03769575e-03 -8.07596124e-04] [-3.50399379e-04 1.03096843e-04 3.12884810e-04] [ 6.10009496e-04 9.79416791e-05 7.36111051e-04] [ 2.22628370e-04 3.82195778e-05 6.87608572e-04] [ 5.47970399e-04 8.95719082e-04 6.64226710e-04] [-4.24762126e-04 6.96667965e-04 2.25944711e-04] [ 1.79856630e-04 -3.46404304e-04 1.75683135e-04] [ 2.19593936e-05 -6.82156983e-04 -1.73892594e-04] [-3.10844234e-04 -3.92211752e-04 9.28215075e-07] [ 2.49860369e-04 -3.26568953e-04 1.02124564e-04] [-1.42807208e-05 -9.34864877e-04 1.14923570e-04] [-4.15271516e-04 -2.36489157e-04 -2.02696002e-04] [ 4.47520365e-06 -2.33642252e-05 1.97753157e-04] [ 2.93825816e-06 7.65193810e-05 -2.08281893e-04] [ 2.58536077e-05 2.83194823e-05 -1.48768356e-04] [ 2.24689937e-05 7.70252147e-05 1.38331666e-04] [-1.63745313e-05 -1.72866162e-04 2.85299385e-04] [-1.52763319e-06 -1.15597572e-04 -2.87912327e-04] [ 1.39959295e-05 -1.54208311e-04 -1.63654972e-04] [-1.16709910e-06 -9.54345929e-05 2.14003834e-04]] Final stress: [-3.89390495e-04 -1.99126707e-04 -2.68305350e-04 5.28176509e-05 -1.24420552e-06 1.37918786e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 50 steps. Final forces: [[ 3.40154875e-04 5.31613352e-04 1.38731892e-03] [-2.32586791e-04 4.72456486e-04 -6.37374798e-05] [ 4.08903608e-04 -1.71853026e-04 1.76974112e-03] [ 1.08656080e-04 -1.10590375e-04 -4.44594470e-04] [-9.72852013e-05 5.97794570e-04 4.19347364e-03] [ 1.10097305e-03 -3.69247214e-04 -1.26715441e-03] [-8.25087353e-04 -6.93202401e-04 -1.30399491e-03] [ 2.91450986e-04 -2.35841164e-03 1.75951296e-04] [-2.02645080e-03 8.22789095e-04 1.51926139e-03] [ 6.08281230e-04 1.71155590e-03 2.72115067e-03] [-1.74718155e-04 -1.12844289e-04 -3.55838034e-04] [ 3.39524555e-03 2.58309768e-04 -1.10805048e-03] [-3.04777484e-03 -2.83725655e-04 -1.22322793e-03] [-5.12340293e-04 5.48328765e-05 -9.86348637e-04] [ 3.49814724e-03 5.21059447e-04 -2.51173998e-03] [-2.85797873e-03 -4.15651438e-04 -2.75655729e-03] [ 9.36781619e-05 -3.12345787e-04 -8.17021957e-05] [ 1.10582490e-04 2.81790137e-04 -3.09958333e-04] [-1.04036280e-04 -2.56546572e-04 -8.76668947e-05] [-7.84142030e-05 3.07907115e-04 -1.00824423e-05] [ 1.28600119e-04 -2.34227844e-04 1.18457153e-04] [ 2.60445667e-05 -3.22693029e-05 4.14983272e-04] [-4.84040540e-05 -2.16083235e-04 8.89167908e-05] [-1.05641256e-04 6.89003234e-06 1.21399231e-04]] Final stress: [-1.17545401e-04 -2.43749119e-04 -1.40923794e-04 -8.38999356e-07 -6.24718576e-05 1.81858689e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 2.55736176e-05 2.01132380e-04 4.10756175e-03] [ 2.52168191e-05 -2.06880651e-04 -1.60357084e-03] [-8.63272612e-06 -2.21273511e-04 -6.11444704e-04] [-9.75664267e-06 2.07165377e-04 3.38277194e-03] [ 1.17409324e-05 9.14803827e-04 1.07760172e-04] [-8.04335787e-04 -4.71734431e-04 1.15812440e-04] [ 7.78670115e-04 -4.43391601e-04 9.68142544e-05] [ 6.40204819e-06 6.65527250e-03 -1.63715264e-03] [-5.72254883e-03 -3.32921628e-03 -1.60793904e-03] [ 5.70589636e-03 -3.31222077e-03 -1.59691658e-03] [ 7.31333477e-06 -3.72442808e-03 7.18204851e-04] [ 3.00156227e-03 1.93473967e-03 8.05789024e-04] [-3.01784394e-03 1.95253362e-03 6.44455424e-04] [ 1.19721022e-05 -3.54794025e-03 -1.01558107e-03] [ 3.32475463e-03 1.68355393e-03 -1.09813794e-03] [-3.34556611e-03 1.70934982e-03 -9.32792685e-04] [-3.06867975e-05 1.83200390e-04 4.88594309e-04] [-3.06128317e-05 -1.89948854e-04 2.64920057e-04] [ 3.22038258e-05 -1.85092507e-04 -3.78822706e-04] [ 3.30783111e-05 1.80736530e-04 -3.79303266e-04] [-4.08406456e-05 -8.08446388e-05 -1.29617877e-04] [-4.13346676e-05 8.44795158e-05 -3.45167521e-04] [ 4.44569225e-05 8.98058687e-05 3.28127943e-04] [ 4.33176834e-05 -8.38018602e-05 2.75634711e-04]] Final stress: [ 9.13432865e-05 8.89908060e-05 4.54413443e-05 -5.45321328e-08 4.69012748e-05 -7.84165376e-11] Minimization converged after 48 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-3.30337262e-04 7.46779050e-05 1.10152454e-04] [ 3.29181596e-04 -7.38242018e-05 -8.06298001e-05] [ 3.30963049e-04 -7.31961918e-05 -1.67867317e-04] [-3.30883414e-04 7.36331886e-05 -3.70786643e-05] [-1.08537040e-06 3.97483677e-05 2.29081831e-05] [-3.18891209e-05 -1.82989529e-05 2.14080589e-05] [ 3.47096110e-05 -2.11737556e-05 2.30348270e-05] [ 6.54436181e-07 2.55404173e-05 3.54486824e-06] [-2.61967502e-05 -1.42456706e-05 1.35887375e-06] [ 2.49025349e-05 -1.27562719e-05 2.58632552e-06] [-1.45238122e-03 3.90752675e-05 4.38352328e-05] [ 6.19279589e-04 -6.11156753e-04 4.33062100e-05] [ 6.36054881e-04 1.40322613e-03 4.45219950e-05] [ 1.45247949e-03 -6.93477561e-05 -1.38371457e-05] [-5.93813813e-04 6.26067173e-04 -1.41128721e-05] [-6.61194883e-04 -1.38840103e-03 -1.43712118e-05] [-7.83863659e-05 -2.06016843e-04 -1.07160414e-04] [ 7.84854833e-05 2.06025477e-04 -1.11628073e-04] [ 7.81811216e-05 2.05862888e-04 1.10598203e-04] [-7.82744707e-05 -2.05760594e-04 1.13751286e-04] [ 5.29121242e-05 1.15768973e-04 -4.60333495e-05] [-5.29679087e-05 -1.15699753e-04 -4.91291467e-05] [-5.32504052e-05 -1.15523037e-04 4.95772111e-05] [ 5.28570742e-05 1.15775018e-04 5.12642657e-05]] Final stress: [-8.89705955e-05 -1.98703450e-04 -1.66793237e-04 -3.81000795e-09 6.52240954e-09 -5.41763686e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 2.25352518e-04 -1.13557254e-03 -2.63052680e-05] [-2.25351675e-04 1.13557249e-03 -2.63068974e-05] [-2.25352343e-04 1.13557253e-03 2.63326450e-05] [ 2.25352556e-04 -1.13557229e-03 2.62940016e-05] [ 4.38588326e-10 9.76752584e-09 2.27557934e-09] [-8.90383654e-09 -5.52270656e-09 2.83863469e-09] [ 7.63058078e-09 -4.32461678e-09 1.81288284e-09] [ 4.06401430e-10 2.64188338e-09 -3.10833337e-09] [-3.31336392e-09 -1.84127402e-09 -3.47321794e-09] [ 2.63458577e-09 -9.53766510e-10 -3.12586395e-09] [ 2.78656425e-04 3.37522309e-05 -4.86693770e-09] [ 3.09905566e-04 -5.13370157e-04 -4.62728807e-09] [ 3.15398187e-05 -3.92913412e-04 -5.13696373e-09] [-2.78656079e-04 -3.37203866e-05 1.33068021e-09] [-3.09933642e-04 5.13353779e-04 1.50824354e-09] [-3.15123831e-05 3.92897914e-04 1.69069845e-09] [ 1.53010205e-04 1.13951465e-05 2.23070730e-04] [-1.53010080e-04 -1.13951389e-05 2.23071632e-04] [-1.53010100e-04 -1.13951690e-05 -2.23071577e-04] [ 1.53010163e-04 1.13952025e-05 -2.23071468e-04] [ 2.11180407e-05 -4.67161988e-05 -8.17796636e-05] [-2.11179486e-05 4.67162071e-05 -8.17793639e-05] [-2.11180094e-05 4.67161939e-05 8.17792331e-05] [ 2.11180738e-05 -4.67161687e-05 8.17788779e-05]] Final stress: [ 7.89546483e-05 1.06203538e-04 4.95204919e-05 -8.91118597e-13 2.02091558e-12 -2.10013716e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[ 1.34861653e-03 -4.58324874e-03 3.88172431e-04] [-1.34861613e-03 4.58324761e-03 3.88421678e-04] [-1.34861793e-03 4.58324712e-03 -3.87981710e-04] [ 1.34861765e-03 -4.58324852e-03 -3.88384027e-04] [ 3.89631085e-10 3.94366567e-09 -3.90328164e-09] [-3.00538781e-09 -2.54107996e-09 -3.45787543e-09] [ 8.26938351e-10 -7.21055327e-10 -5.87990284e-09] [-1.91202819e-09 1.43205326e-07 -4.73078634e-08] [-1.18727289e-07 -6.86012150e-08 -4.41149400e-08] [ 1.22860628e-07 -7.29491437e-08 -4.68028585e-08] [ 1.21505073e-03 4.83093594e-06 -7.06092215e-08] [ 2.19466551e-03 -3.22555615e-03 -7.04188728e-08] [-3.21345526e-03 -1.18005931e-03 -7.08425592e-08] [-1.21505071e-03 -4.82483312e-06 4.63757046e-08] [-2.19466909e-03 3.22555336e-03 4.62573773e-08] [ 3.21345868e-03 1.18005695e-03 4.65798856e-08] [-2.98494205e-04 -3.86100946e-04 4.59289213e-04] [ 2.98493948e-04 3.86100737e-04 4.59296930e-04] [ 2.98494267e-04 3.86100823e-04 -4.59291056e-04] [-2.98494285e-04 -3.86100932e-04 -4.59298411e-04] [ 8.51462357e-05 -2.43777172e-04 -6.67692589e-04] [-8.51464201e-05 2.43776899e-04 -6.67689022e-04] [-8.51465645e-05 2.43776883e-04 6.67693988e-04] [ 8.51466103e-05 -2.43777038e-04 6.67686699e-04]] Final stress: [-1.06061992e-04 -8.37150141e-05 -6.46586309e-05 -3.67085963e-12 -4.51385167e-12 1.00449506e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-3.89594381e-04 -1.63223002e-03 -7.94762518e-05] [ 3.89592134e-04 1.63223149e-03 -7.94800546e-05] [ 3.89592395e-04 1.63223130e-03 8.02238580e-05] [-3.89593378e-04 -1.63223044e-03 7.92040867e-05] [-1.83344797e-09 -1.52378004e-07 -1.73466856e-08] [ 1.34896345e-07 7.81248112e-08 -1.81729416e-08] [-1.31541562e-07 7.43573406e-08 -1.67276475e-08] [-5.37100191e-10 9.25543326e-08 -7.87341121e-08] [-8.70342185e-08 -4.67549655e-08 -8.02035293e-08] [ 8.82943371e-08 -4.80374866e-08 -8.20852772e-08] [-2.30946910e-04 -1.70744533e-04 -1.19429758e-07] [ 2.93571849e-04 -5.73678465e-04 -1.18275826e-07] [-4.11850937e-04 -7.80172521e-04 -1.18375095e-07] [ 2.30947857e-04 1.72009460e-04 6.26385465e-08] [-2.94666650e-04 5.73045165e-04 6.40710590e-08] [ 4.12946294e-04 7.79540157e-04 6.26825332e-08] [ 5.19901814e-04 -4.00848675e-04 2.99288079e-04] [-5.19901552e-04 4.00848723e-04 2.99319486e-04] [-5.19901701e-04 4.00848383e-04 -2.99311896e-04] [ 5.19901696e-04 -4.00848214e-04 -2.99303839e-04] [ 4.59855459e-05 -6.93976044e-05 -1.02308322e-03] [-4.59857946e-05 6.93977021e-05 -1.02306771e-03] [-4.59858132e-05 6.93976829e-05 1.02307452e-03] [ 4.59852875e-05 -6.93974481e-05 1.02307290e-03]] Final stress: [-8.77659919e-05 -9.94288285e-05 -4.92367048e-05 -3.51565428e-12 5.65356454e-12 -1.89456323e-05] Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. Minimization converged after 15 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 32 steps. Final forces: [[ 6.18298850e-04 -1.85266335e-03 1.14449054e-02] [-8.36638784e-04 1.76533891e-03 -9.84166564e-03] [-8.85176454e-04 1.85882710e-03 -1.33967103e-02] [ 8.73018292e-04 -1.82794804e-03 7.23370622e-03] [ 6.40189384e-05 1.26574802e-03 6.23855088e-04] [-1.02340739e-03 -6.77699555e-04 6.02495122e-04] [ 8.97024551e-04 -5.29623580e-04 4.99078553e-04] [-1.98429241e-04 9.15669226e-04 8.29780547e-05] [-5.76958676e-04 -2.19319132e-04 2.41605621e-04] [ 1.01980374e-03 -7.05949220e-04 -7.52041952e-05] [-1.28084081e-02 6.92603407e-04 4.19550956e-03] [ 4.07064759e-03 -7.18005334e-03 4.12652750e-03] [ 8.40707298e-03 1.31564507e-02 4.18682468e-03] [ 1.27047243e-02 -2.52546336e-03 -3.41470149e-03] [-2.32187309e-03 8.23074226e-03 -3.31818428e-03] [-9.93322841e-03 -1.23528272e-02 -3.48353127e-03] [-1.24260192e-03 1.54525715e-03 1.85938258e-04] [ 1.25848720e-03 -1.53725757e-03 -3.43694254e-04] [ 1.26749645e-03 -1.55431542e-03 -8.27113438e-05] [-1.30303378e-03 1.53827555e-03 3.85983352e-04] [-9.27928536e-04 1.06896950e-03 1.77132964e-03] [ 9.33218387e-04 -1.06822490e-03 1.43567102e-03] [ 8.91285670e-04 -1.06604251e-03 -1.66145681e-03] [-9.47412539e-04 1.05950539e-03 -1.39854844e-03]] Final stress: [-7.02696794e-05 -4.48902956e-04 -2.50086719e-04 -6.42175027e-09 1.01635947e-06 -6.90193167e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.32673480e-05 -4.67214704e-05 3.62437649e-05] [ 6.32663441e-05 4.67228101e-05 3.78792547e-05] [ 6.32673386e-05 4.67225936e-05 -3.47604179e-05] [-6.32687739e-05 -4.67220461e-05 -3.42873472e-05] [-2.51190276e-09 -3.16045869e-06 -9.45052349e-07] [ 2.73916656e-06 1.58323623e-06 -9.44592371e-07] [-2.73270490e-06 1.57661037e-06 -9.43958769e-07] [ 8.10838004e-10 8.64143141e-07 -2.99082218e-07] [-7.51624273e-07 -4.33631936e-07 -3.00295607e-07] [ 7.49892973e-07 -4.31651375e-07 -3.00501266e-07] [ 1.54004623e-05 1.59224147e-04 -3.26435883e-07] [ 2.15236912e-04 -3.26247219e-05 -3.25799984e-07] [-1.58328488e-04 -4.49183171e-05 -3.26289702e-07] [-1.54000739e-05 -1.58795276e-04 -1.17768986e-07] [-2.15609186e-04 3.24098616e-05 -1.18174103e-07] [ 1.58701127e-04 4.47037214e-05 -1.18076768e-07] [ 1.22990035e-04 -5.04054512e-05 2.79208210e-05] [-1.22989852e-04 5.04056120e-05 2.79407335e-05] [-1.22989843e-04 5.04055225e-05 -2.79510616e-05] [ 1.22989843e-04 -5.04054310e-05 -2.79578983e-05] [-1.53892443e-05 -1.21398279e-05 -1.75244645e-04] [ 1.53885455e-05 1.21399390e-05 -1.75203863e-04] [ 1.53895577e-05 1.21399396e-05 1.75232775e-04] [-1.53903843e-05 -1.21398530e-05 1.75253912e-04]] Final stress: [ 6.66548166e-05 6.48803611e-05 1.13914350e-04 2.27594690e-12 4.78111434e-12 -3.61604196e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.69352980e-05 -1.38133658e-04 -3.41856118e-07] [-1.69349564e-05 1.38133669e-04 2.54789211e-06] [-1.69355798e-05 1.38133427e-04 -9.89970998e-07] [ 1.69358300e-05 -1.38133925e-04 1.67635177e-06] [ 9.67117581e-10 -2.32632838e-06 -8.11888470e-07] [ 2.01416384e-06 1.16214277e-06 -8.12076026e-07] [-2.01618038e-06 1.16442754e-06 -8.12223409e-07] [-3.43102461e-10 1.15482699e-08 9.63617265e-08] [-9.25841570e-09 -5.28843003e-09 9.68344092e-08] [ 9.89180438e-09 -6.05138184e-09 9.63749006e-08] [-3.48912625e-05 -1.42475362e-04 -1.44249379e-07] [-9.44312675e-05 -5.02682483e-07 -1.43917591e-07] [ 4.93977326e-05 -1.55205879e-05 -1.44118401e-07] [ 3.48928977e-05 1.38995449e-04 -1.03909114e-07] [ 9.74442350e-05 2.24123695e-06 -1.04092841e-07] [-5.24125892e-05 1.72620998e-05 -1.04218796e-07] [-4.57256324e-05 -9.65305051e-06 -7.04823321e-06] [ 4.57257101e-05 9.65303778e-06 -7.09941101e-06] [ 4.57256955e-05 9.65301072e-06 7.08906469e-06] [-4.57256133e-05 -9.65306890e-06 7.03274435e-06] [ 1.65931709e-05 6.51796037e-06 4.98380083e-05] [-1.65930423e-05 -6.51797388e-06 4.98505811e-05] [-1.65932743e-05 -6.51798031e-06 -4.98364291e-05] [ 1.65934071e-05 6.51794855e-06 -4.98276189e-05]] Final stress: [-3.95990917e-05 -3.95448101e-05 -9.20348882e-05 1.46400050e-12 1.18152249e-14 4.27269334e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-5.68275207e-05 1.81446591e-05 1.75035249e-05] [ 5.68269692e-05 -1.81450456e-05 2.00695147e-05] [ 5.68274716e-05 -1.81450964e-05 -1.86889568e-05] [-5.68279349e-05 1.81446818e-05 -1.64524896e-05] [-1.55926309e-09 -2.87561658e-06 -8.83115959e-07] [ 2.49259189e-06 1.43975986e-06 -8.83633956e-07] [-2.48954895e-06 1.43619794e-06 -8.83400421e-07] [-1.62720700e-10 -9.32682097e-07 2.84842633e-07] [ 8.08874942e-07 4.66682133e-07 2.85127627e-07] [-8.08608840e-07 4.66417154e-07 2.85545401e-07] [ 7.59399811e-06 -1.70373692e-05 -1.35182789e-07] [-1.77114490e-05 4.24997048e-05 -1.35168865e-07] [ 1.06391839e-04 1.05080934e-06 -1.35135130e-07] [-7.59399617e-06 1.62665986e-05 -7.61324022e-08] [ 1.83796045e-05 -4.21141454e-05 -7.61148914e-08] [-1.07059836e-04 -6.65330155e-07 -7.61432349e-08] [ 4.64100591e-05 -1.01891014e-05 -2.96273198e-05] [-4.64100041e-05 1.01890323e-05 -2.96354453e-05] [-4.64100168e-05 1.01890490e-05 2.96280251e-05] [ 4.64100594e-05 -1.01891205e-05 2.96123121e-05] [-1.51769997e-05 6.66087227e-06 -1.62690910e-05] [ 1.51765893e-05 -6.66091415e-06 -1.62225834e-05] [ 1.51768076e-05 -6.66091171e-06 1.62350323e-05] [-1.51772283e-05 6.66086876e-06 1.62759888e-05]] Final stress: [-4.05448155e-05 -4.14996640e-05 -8.98124315e-05 8.20467467e-14 1.53445813e-13 -4.17458773e-05] Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[-5.12321533e-05 -1.11753010e-03 8.88423865e-04] [-3.37813259e-04 8.06576925e-04 -1.48310976e-04] [ 4.99548375e-05 1.11774871e-03 1.49745575e-04] [ 3.37917429e-04 -8.06590390e-04 1.51955456e-04] [ 2.85968699e-08 -6.38185602e-05 -1.46673946e-05] [ 5.51567216e-05 3.18469043e-05 -1.46380700e-05] [-5.52963698e-05 3.19538419e-05 -1.46082081e-05] [-4.57102478e-07 7.68003581e-04 -2.41365497e-04] [-6.63987853e-04 -3.83011970e-04 -2.41591324e-04] [ 6.66502503e-04 -3.84991185e-04 -2.41976419e-04] [-1.12719075e-03 1.93154185e-04 2.60045417e-04] [ 1.01439350e-04 -1.52567015e-03 9.09929896e-05] [ 9.55221025e-04 1.99040210e-04 -1.53078744e-05] [ 1.12698534e-03 1.17154801e-04 -3.50459985e-04] [-3.70123345e-04 1.37067575e-03 -1.81360131e-04] [-6.85996316e-04 -3.54537505e-04 -7.54723403e-05] [ 5.62198486e-04 -2.50683281e-04 3.53647992e-04] [-4.47002620e-04 2.39524075e-04 3.18730456e-04] [-5.62339440e-04 2.50644291e-04 -3.63243133e-04] [ 4.47082677e-04 -2.39459058e-04 -3.18721674e-04] [ 1.70119050e-04 -5.26188572e-05 -4.12420914e-04] [-5.01470979e-05 -1.34909788e-04 -4.23564791e-04] [-1.71254451e-04 5.26021907e-05 4.23699974e-04] [ 5.02347362e-05 1.34895370e-04 4.20467008e-04]] Final stress: [ 3.49088262e-06 5.87180152e-06 -6.96562145e-06 -4.11184026e-05 1.28492352e-05 1.45164489e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.57167656e-06 5.87700012e-06 -1.87075044e-05] [ 2.53635542e-05 -3.20823918e-05 1.62733419e-05] [ 2.17969009e-05 2.71781592e-06 -2.17538526e-05] [-1.52216035e-05 4.60345851e-06 -8.46191994e-06] [ 1.57783714e-05 1.18935311e-05 4.94114712e-06] [-2.54857661e-05 6.29984355e-07 3.54469004e-05] [ 2.32119872e-05 -3.31571072e-07 7.73470779e-06] [-1.43933554e-05 1.75305928e-07 9.14349043e-06] [-2.31428780e-05 2.03841516e-06 1.43875611e-05] [-7.24759715e-06 -1.53071983e-05 3.92339417e-06] [ 2.95420837e-05 5.46545670e-06 -2.17623528e-05] [-4.59796062e-05 -5.92061480e-06 1.45727209e-05] [-4.13642679e-05 2.55775602e-05 -3.05402464e-05] [ 1.50322794e-06 -4.68762609e-05 -1.59094715e-05] [-2.48017694e-05 -8.19498142e-06 9.44475511e-06] [ 1.48611610e-05 1.29074241e-05 -2.41029024e-05] [ 3.40546913e-05 2.26203676e-05 -1.89327741e-05] [ 1.00709808e-05 -6.69247741e-06 4.44905421e-06] [ 1.23050562e-05 1.47627890e-05 1.46878122e-05] [ 1.13459706e-05 -6.38840636e-06 -1.33225213e-05] [-2.60690642e-05 -2.15214006e-05 -4.52799252e-06] [ 7.52613869e-06 1.88538082e-05 1.72324148e-05] [ 1.87002709e-06 5.03626839e-06 8.55890747e-06] [ 9.90408007e-06 1.01561175e-05 1.72253302e-05]] Final stress: [ 0.0327477 0.03330275 0.13515019 -0.00083338 -0.00050047 0.00040458] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.38132907e-06 5.85840511e-06 -2.83908180e-06] [-1.10587418e-06 -9.02567039e-06 -2.81861251e-08] [ 1.36086136e-06 6.97953925e-06 -2.38133959e-06] [ 5.21298644e-07 -9.13198823e-06 4.41664060e-06] [-5.51131043e-06 3.97390177e-06 2.61467530e-06] [-5.31653727e-08 9.80870490e-08 -2.58503851e-07] [ 2.62098718e-06 -1.01919101e-06 -4.21920055e-07] [ 3.28354544e-06 -1.85721022e-06 -7.21318327e-07] [-3.53242333e-06 -1.76010715e-06 4.46198478e-06] [ 7.29636982e-06 -6.05641990e-06 9.44098087e-07] [ 8.31185311e-08 9.00876316e-07 7.28122684e-07] [-2.94670219e-07 4.19121379e-06 -7.00877897e-06] [ 1.13701232e-06 -3.54878435e-06 4.53083512e-06] [-6.90797069e-06 -2.79272641e-06 -1.32780078e-06] [ 1.15878675e-06 -9.01331402e-06 -3.34897325e-06] [ 2.47868730e-08 5.75316426e-06 3.31176603e-06] [-3.94753758e-06 1.38188509e-06 -5.76560182e-06] [-3.34799302e-07 2.59477535e-06 3.93390019e-06] [ 1.85134305e-06 1.52096660e-08 5.55303168e-06] [ 2.78016473e-06 2.89806611e-06 -1.81654041e-06] [ 6.82124129e-06 5.69332962e-06 1.20207245e-06] [-1.45604867e-07 -3.10552632e-06 -2.79206532e-06] [-1.33146975e-06 9.67050448e-06 1.32108412e-06] [-4.39336118e-06 -2.69801987e-06 -4.30810075e-06]] Final stress: [ 3.18820559e-02 3.37445095e-02 1.34817515e-01 -3.42608228e-05 -1.59444275e-07 7.66165856e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[ 8.17216148e-05 5.37879045e-04 3.34278013e-04] [ 3.09412682e-04 -5.44248535e-04 6.02698575e-04] [-8.16122645e-05 -5.37868887e-04 -3.00018152e-04] [-3.09448933e-04 5.44203680e-04 -5.23100744e-04] [ 3.32316375e-09 -2.34995038e-05 -1.11762707e-05] [ 2.04194765e-05 1.17751327e-05 -1.12234280e-05] [-2.03526780e-05 1.17424332e-05 -1.12079900e-05] [ 4.68573643e-08 6.34638018e-05 -1.62745821e-05] [-5.50478816e-05 -3.18122088e-05 -1.62665846e-05] [ 5.48534231e-05 -3.16444889e-05 -1.62323569e-05] [ 4.37392042e-04 7.67699485e-04 -1.61834975e-04] [-9.31097292e-04 4.78615890e-04 1.44736850e-04] [-2.54039045e-04 -5.14522948e-04 -2.04692455e-04] [-4.37576557e-04 -8.68948325e-04 1.51524645e-04] [ 1.01887285e-03 -4.27824144e-04 -1.55099142e-04] [ 1.66435253e-04 5.65001674e-04 1.94383794e-04] [-5.92742846e-04 -3.71939477e-04 4.00831195e-04] [ 5.73435305e-04 2.39195340e-04 4.18424559e-04] [ 5.92720586e-04 3.71922567e-04 -3.99850511e-04] [-5.73482158e-04 -2.39180034e-04 -4.20565623e-04] [-1.94928780e-04 6.39079836e-06 -5.47607315e-04] [ 2.23239611e-04 -1.80382075e-04 -5.44339053e-04] [ 1.95032999e-04 -6.38811341e-06 5.48972962e-04] [-2.23257586e-04 1.80368895e-04 5.43638589e-04]] Final stress: [ 1.14405710e-05 -8.34518934e-07 -9.14750521e-06 4.53906032e-05 4.58938489e-06 -2.39501939e-05] Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 191 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 28 steps. Final forces: [[-2.43029765e-04 1.56039540e-03 -4.62698851e-03] [ 8.95895554e-05 3.64459797e-04 4.69931509e-03] [ 2.28793547e-04 -1.56340736e-03 -9.59284263e-03] [-8.53236733e-05 -3.63753275e-04 3.35599531e-04] [ 1.94089587e-06 -1.98504449e-03 -7.92901942e-04] [ 1.71941109e-03 9.91887125e-04 -7.88357972e-04] [-1.71769833e-03 9.93168006e-04 -7.95625692e-04] [ 1.28697583e-06 -9.33302874e-03 3.05140734e-03] [ 8.09831413e-03 4.67458350e-03 3.05314816e-03] [-8.07381375e-03 4.66194948e-03 3.05663944e-03] [-1.98594336e-03 -5.58008148e-03 2.18137933e-03] [ 5.15515896e-03 -4.88275877e-04 2.22672038e-03] [-2.99665374e-03 6.22728108e-03 3.46889984e-03] [ 1.98329471e-03 -2.41199331e-03 -1.38515050e-03] [ 1.76684514e-03 4.48719515e-03 -1.42711967e-03] [-3.92212627e-03 -2.23541962e-03 -2.67724959e-03] [-2.93625518e-07 -2.94785430e-04 6.85635459e-04] [ 1.99550820e-04 1.91304154e-04 6.00346743e-05] [ 3.41982425e-08 2.95085633e-04 -5.19980781e-04] [-1.99376751e-04 -1.90610212e-04 -1.40280813e-04] [ 1.95155210e-04 1.96258991e-05 -7.78699118e-04] [ 6.39389790e-05 -1.35613887e-04 -3.71797916e-04] [-2.13381311e-04 -2.04908109e-05 6.43025901e-04] [-6.56736415e-05 1.35569266e-04 4.35189994e-04]] Final stress: [-4.63110434e-06 -5.09512149e-06 -4.03629670e-06 -2.34427088e-05 -7.59560864e-05 -1.60698075e-06] Minimization converged after 182 steps. Minimization converged after 166 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 6.07612279e-06 6.88768215e-04 2.00395219e-04] [-6.07611765e-06 -6.88768217e-04 2.00385290e-04] [-6.07611858e-06 -6.88768230e-04 -2.00386631e-04] [ 6.07611327e-06 6.88768237e-04 -2.00387129e-04] [ 2.83108140e-12 -9.95377114e-11 1.71438475e-10] [ 7.65961183e-11 4.30489810e-11 1.78133341e-10] [-8.40266190e-11 4.90880669e-11 1.77961146e-10] [-1.06543741e-11 6.92313917e-09 -2.05938910e-09] [-5.99811356e-09 -3.44977991e-09 -2.06575379e-09] [ 6.01410988e-09 -3.47138357e-09 -2.06654489e-09] [-1.13105654e-04 -1.39782462e-04 6.35170552e-10] [-3.33705660e-04 3.40564427e-04 6.43105495e-10] [ 3.35804644e-04 2.00711796e-04 6.45408219e-10] [ 1.13105657e-04 1.39785922e-04 -1.06076280e-09] [ 3.33702654e-04 -3.40566160e-04 -1.04967769e-09] [-3.35801639e-04 -2.00713525e-04 -1.03271915e-09] [-2.95431068e-05 1.02934723e-06 1.31342428e-04] [ 2.95431079e-05 -1.02934746e-06 1.31342374e-04] [ 2.95431057e-05 -1.02934603e-06 -1.31342490e-04] [-2.95431076e-05 1.02934693e-06 -1.31342326e-04] [ 6.69409333e-05 2.72203671e-05 3.76721772e-05] [-6.69409331e-05 -2.72203666e-05 3.76720320e-05] [-6.69409370e-05 -2.72203669e-05 -3.76720370e-05] [ 6.69409352e-05 2.72203676e-05 -3.76720238e-05]] Final stress: [ 1.58637030e-05 1.50569494e-05 7.79747298e-07 -5.41769649e-14 8.10342206e-14 7.93997950e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.76673843e-05 4.74115414e-04 -3.13887055e-05] [-1.76673613e-05 -4.74115392e-04 -3.14287480e-05] [-1.76673701e-05 -4.74115410e-04 3.14333008e-05] [ 1.76673759e-05 4.74115401e-04 3.14142660e-05] [ 3.69155097e-12 5.11840420e-09 2.23768626e-09] [-4.44802291e-09 -2.56861652e-09 2.24881710e-09] [ 4.43487097e-09 -2.55498400e-09 2.24412103e-09] [ 3.37155498e-11 3.15573689e-08 -9.97074567e-09] [-2.73843780e-08 -1.58223046e-08 -9.98153593e-09] [ 2.73218732e-08 -1.57464687e-08 -9.97992492e-09] [ 3.65764529e-04 -2.87997279e-04 6.85481984e-10] [-3.36810213e-04 -2.39481448e-06 7.13388158e-10] [ 1.36975021e-04 5.39529725e-04 6.99738538e-10] [-3.65764513e-04 2.88019343e-04 -3.05574340e-09] [ 3.36791092e-04 2.38376290e-06 -3.06351133e-09] [-1.36955924e-04 -5.39540738e-04 -3.06297967e-09] [ 6.51275249e-05 1.75441608e-05 6.28230336e-05] [-6.51275241e-05 -1.75441584e-05 6.28231335e-05] [-6.51275220e-05 -1.75441597e-05 -6.28234787e-05] [ 6.51275239e-05 1.75441593e-05 -6.28228961e-05] [-1.12050790e-05 2.55796173e-05 5.15842437e-05] [ 1.12050863e-05 -2.55796162e-05 5.15837235e-05] [ 1.12050931e-05 -2.55796166e-05 -5.15837109e-05] [-1.12050846e-05 2.55796165e-05 -5.15838767e-05]] Final stress: [ 1.57257591e-05 1.51931781e-05 6.08396471e-06 8.80059670e-14 -5.52066952e-15 -8.23915220e-05] Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 3.64639485e-10 -6.74001987e-06 -1.35256539e-07] [-1.23176744e-09 6.73838238e-06 -1.24865159e-07] [ 1.05715152e-09 6.73808228e-06 1.41052114e-07] [-1.06135462e-10 -6.73883030e-06 1.21541601e-07] [-5.48470375e-10 2.48162102e-09 1.10249615e-09] [-4.95230815e-10 -2.97987503e-10 -5.42149659e-12] [ 1.90990290e-09 -1.76869253e-09 1.21508595e-09] [ 6.51289894e-11 8.27180857e-09 -3.01913605e-09] [-2.04283912e-09 -3.27827543e-09 -9.71539182e-10] [ 9.75313885e-10 -2.59760552e-09 4.90803866e-10] [-5.70017533e-10 1.23383878e-05 -2.59720877e-09] [-2.14225615e-06 1.62796188e-05 -3.94579698e-09] [ 2.14319200e-06 1.62784041e-05 -2.03961017e-09] [ 2.15070461e-10 -1.23353260e-05 2.11117327e-09] [ 2.13946605e-06 -1.62806861e-05 2.58709078e-09] [-2.13987066e-06 -1.62801899e-05 2.51484852e-09] [-1.39324136e-10 2.56424430e-05 3.63622118e-06] [-4.51233495e-12 -2.56427588e-05 3.63660746e-06] [-6.57982002e-11 -2.56425248e-05 -3.63630297e-06] [ 8.20253310e-11 2.56422860e-05 -3.63658255e-06] [-2.10502726e-11 -1.08674701e-05 -1.99578273e-05] [-8.47501336e-12 1.08674148e-05 -1.99576557e-05] [ 9.81462878e-11 1.08673814e-05 1.99579851e-05] [-6.49945098e-11 -1.08674055e-05 1.99576400e-05]] Final stress: [-1.15158791e-04 -6.11724484e-05 -5.71754180e-05 -2.52905005e-12 -5.22897252e-12 -4.23935814e-13] Minimization converged after 6 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.54751612e-09 -7.96727006e-05 -1.01020271e-04] [-1.78617539e-09 7.96668777e-05 -1.00660305e-04] [-4.16895110e-10 7.96688019e-05 1.00970598e-04] [-1.02155270e-09 -7.96706771e-05 1.00710065e-04] [-2.13201973e-09 4.61015494e-08 -2.37768694e-10] [-2.96732656e-08 -1.88948660e-08 -5.63300398e-09] [ 3.50153607e-08 -2.44175107e-08 -1.27085042e-09] [-8.57237658e-10 -9.72367740e-08 1.76816919e-08] [ 8.72745246e-08 4.99557515e-08 1.89492776e-08] [-8.66623771e-08 4.85593926e-08 1.94440002e-08] [-9.04217479e-10 9.13106603e-05 -6.11271955e-08] [-8.51155482e-05 4.01780252e-05 -6.23315867e-08] [ 8.51175111e-05 4.01758517e-05 -6.20986620e-08] [ 2.58566313e-09 -9.13231860e-05 4.79547729e-08] [ 8.51447485e-05 -4.01702922e-05 4.97828794e-08] [-8.51492137e-05 -4.01646706e-05 5.13232089e-08] [-2.32996566e-10 1.55919815e-04 1.25433105e-04] [-7.29603045e-11 -1.55920370e-04 1.25440063e-04] [-3.22729565e-10 -1.55920409e-04 -1.25434651e-04] [-8.92214636e-11 1.55920117e-04 -1.25442057e-04] [-4.12098133e-11 -3.13547029e-06 2.14283267e-04] [ 1.85229102e-10 3.13447350e-06 2.14288807e-04] [ 3.36748176e-10 3.13447430e-06 -2.14288107e-04] [-2.29848918e-10 -3.13538792e-06 -2.14292950e-04]] Final stress: [ 1.79801103e-06 3.51738616e-05 -1.50013905e-06 -9.26321456e-12 3.45186942e-12 -1.39061802e-12] Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 2.61566013e-09 6.42802327e-05 -3.74994464e-05] [ 1.97568503e-08 -1.95512420e-05 7.50208049e-05] [-7.67147609e-08 -6.42047465e-05 3.79567021e-05] [ 1.07140144e-07 1.93718675e-05 -7.14995366e-05] [-1.54463723e-07 2.95404521e-07 -2.99453084e-07] [-7.90398539e-08 4.18316863e-08 -4.22313636e-07] [ 2.83959207e-07 -2.57546521e-07 -3.84169827e-07] [ 1.63592758e-07 -2.56584417e-07 -6.37345186e-08] [ 1.16414628e-07 -4.42061063e-08 -1.35558038e-07] [-3.38323704e-07 2.68733436e-07 -8.45712180e-08] [-7.42629984e-08 -2.43089818e-06 -1.21928990e-04] [ 7.38757350e-05 -2.31185002e-05 -8.42432679e-05] [-7.37394897e-05 -2.32879712e-05 -8.44245112e-05] [ 1.62431837e-07 -4.35717663e-07 1.21308683e-04] [-7.12121946e-05 2.45026135e-05 8.36081191e-05] [ 7.09231782e-05 2.48576309e-05 8.34181982e-05] [-9.44293696e-09 1.13977397e-04 9.11799772e-05] [ 9.57808272e-09 -5.21285113e-05 1.12034080e-04] [-1.13592547e-08 -1.13986513e-04 -9.12093993e-05] [ 1.21666784e-08 5.21342494e-05 -1.12149407e-04] [-1.05575950e-08 5.12315849e-05 -4.58034928e-06] [ 1.97429182e-08 1.44895639e-05 -1.29626204e-05] [ 1.63173490e-08 -5.12394747e-05 4.51303675e-06] [-6.78018980e-09 -1.45091983e-05 1.28477270e-05]] Final stress: [ 7.38837619e-05 6.08797040e-05 3.99236735e-05 -2.56669993e-05 -2.30721308e-11 -1.06338461e-10] Minimization converged after 58 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[ 9.26403656e-04 -4.08363432e-04 -3.21637036e-04] [-9.35918253e-04 4.26853447e-04 -5.85169862e-05] [-9.08041736e-04 4.04743015e-04 1.80130118e-04] [ 9.15444926e-04 -4.11585280e-04 4.34879485e-05] [ 1.20112194e-05 -7.73872678e-05 -6.23359783e-06] [ 9.14059447e-05 2.84635098e-05 -5.81272955e-06] [-9.85101954e-05 4.59994619e-05 5.08486032e-06] [-3.07812645e-06 9.75580825e-05 9.34080005e-06] [-1.00651348e-04 -4.96630634e-05 -2.11245192e-07] [ 1.00938288e-04 -5.37378792e-05 6.77992030e-06] [-2.74477001e-04 -3.34277760e-04 -3.26434599e-05] [ 4.51880479e-04 -1.12692437e-03 -2.30926409e-05] [ 3.81068568e-04 1.18236556e-03 7.61492759e-06] [ 2.81311207e-04 1.86544936e-04 5.50010074e-05] [-3.24890173e-04 1.19324286e-03 4.99472205e-05] [-5.16926378e-04 -1.10311919e-03 6.16040606e-05] [-5.00272499e-05 1.72515214e-05 1.00800195e-04] [ 5.01899557e-05 -1.74864007e-05 1.03233155e-04] [ 5.11784181e-05 -1.99483698e-05 -9.38925834e-05] [-4.88106335e-05 1.76511524e-05 -1.00809567e-04] [ 1.11484193e-05 1.14346677e-04 1.27684938e-04] [-1.16624066e-05 -1.13730270e-04 1.29673377e-04] [-1.17650994e-05 -1.15703723e-04 -1.16714377e-04] [ 1.17775177e-05 1.16906779e-04 -1.20818304e-04]] Final stress: [-2.17033868e-04 -1.86093449e-04 -1.63854243e-04 7.03984616e-08 -6.29660509e-08 -5.10612478e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-1.28502330e-04 1.61355091e-04 -1.16924370e-03] [ 1.20791372e-04 -1.59105883e-04 1.74712069e-03] [ 1.36208006e-04 -1.65839698e-04 1.54348122e-03] [-1.07029763e-04 1.48208851e-04 -1.25763613e-03] [ 5.84660530e-06 -1.62282368e-04 -8.97389822e-05] [ 1.56691866e-04 7.75531816e-05 -9.29691543e-05] [-1.75148506e-04 9.52347839e-05 -1.13129330e-04] [ 1.19213678e-07 -1.14338859e-04 -1.83366425e-05] [ 1.04582441e-04 5.70773068e-05 -1.87869232e-05] [-1.11157768e-04 6.09619838e-05 -8.62847149e-06] [ 7.55995548e-04 5.40845166e-04 -5.98161662e-04] [-3.26078816e-04 1.21022977e-03 -5.99542885e-04] [-4.21037202e-04 -1.18607265e-03 -5.82973116e-04] [-7.54084692e-04 -1.62362956e-04 4.43294619e-04] [ 7.36189137e-06 -1.40002509e-03 4.43806767e-04] [ 7.33231483e-04 1.00226235e-03 4.25717227e-04] [-1.81714810e-05 6.04883001e-05 -9.72283535e-05] [ 2.22666337e-05 -6.39153780e-05 -2.20728512e-05] [ 2.05530178e-05 -6.32993237e-05 7.55272366e-05] [-2.25175273e-05 6.33407950e-05 1.49406076e-05] [ 4.32366012e-05 6.49918016e-05 -1.88613342e-04] [-4.02057207e-05 -6.66931237e-05 -1.41741744e-04] [-4.34348756e-05 -6.49702204e-05 1.72250519e-04] [ 4.04840028e-05 6.63561621e-05 1.32664393e-04]] Final stress: [-2.25527118e-04 -1.96959638e-04 -1.55343691e-04 -3.68210003e-08 7.48146357e-08 5.53373913e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.50517286e-04 -5.83128182e-04 -2.07879603e-04] [ 1.50516084e-04 5.83127369e-04 -2.04433083e-04] [ 1.50516461e-04 5.83124276e-04 2.00572467e-04] [-1.50518022e-04 -5.83125223e-04 2.03047820e-04] [-4.74953097e-10 1.85003719e-06 4.88372588e-07] [-1.60672885e-06 -9.25401589e-07 4.90353031e-07] [ 1.60907185e-06 -9.27349657e-07 4.90318258e-07] [-1.94303407e-09 -5.46821038e-06 1.70110530e-06] [ 4.74547382e-06 2.73796276e-06 1.70635845e-06] [-4.74487667e-06 2.73528575e-06 1.70021445e-06] [-2.36537258e-04 -1.33270864e-04 2.68863549e-07] [ 1.29280107e-04 -5.18255346e-05 2.69690144e-07] [-1.29871839e-04 -3.23144609e-04 2.69823298e-07] [ 2.36536399e-04 1.30991943e-04 4.42690210e-07] [-1.27303368e-04 5.29665266e-05 4.43259400e-07] [ 1.27897600e-04 3.24283196e-04 4.43701918e-07] [-7.54950371e-05 1.62807019e-05 3.92316127e-05] [ 7.54946245e-05 -1.62807430e-05 3.92075663e-05] [ 7.54955093e-05 -1.62804836e-05 -3.91621527e-05] [-7.54958404e-05 1.62803692e-05 -3.92084945e-05] [-1.41306115e-05 -2.31568081e-05 -1.10875797e-04] [ 1.41312411e-05 2.31563013e-05 -1.10834361e-04] [ 1.41332654e-05 2.31551507e-05 1.10797122e-04] [-1.41325522e-05 -2.31557119e-05 1.10822153e-04]] Final stress: [-4.98827689e-05 -2.88092230e-05 -2.35574524e-05 1.67603771e-12 -2.01560695e-12 1.72100145e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[-3.24912616e-05 -9.65477001e-05 7.67615510e-03] [ 4.34839632e-04 2.47641315e-05 -8.35676799e-03] [ 1.76242452e-04 1.08357136e-04 -8.76711579e-03] [-1.82473060e-04 -9.30888394e-05 7.38306743e-03] [ 1.82648010e-04 -2.75817068e-04 1.44396171e-04] [-1.29679477e-04 -9.85059874e-05 3.07858989e-04] [-2.83118392e-04 3.49917659e-04 1.12258266e-06] [ 9.15236179e-05 3.45963053e-05 1.33874521e-04] [ 1.55105470e-04 -9.62614931e-05 1.18123950e-04] [-3.71808995e-04 1.32979606e-04 2.92614752e-04] [ 1.46232869e-03 6.76853923e-04 3.13254285e-03] [-1.43547690e-03 2.39537327e-03 3.14267146e-03] [-2.01165433e-03 -2.66814032e-03 2.89103539e-03] [-1.34507091e-03 -8.77999563e-04 -2.71377623e-03] [ 1.53753760e-03 -2.42535940e-03 -2.87447892e-03] [ 1.64747851e-03 2.92312721e-03 -2.66065907e-03] [ 4.13823402e-04 -1.74809727e-04 9.50927368e-05] [-3.81659390e-04 1.59495178e-04 -2.93456825e-04] [-3.70918256e-04 1.85445656e-04 -5.78377686e-05] [ 3.97856293e-04 -1.80768056e-04 3.15385839e-04] [-1.15514508e-04 1.08919268e-04 4.12311299e-04] [ 1.25306801e-04 -1.29702234e-04 1.86509405e-04] [ 1.44670399e-04 -1.09831039e-04 -3.78211527e-04] [-1.09495405e-04 1.27002073e-04 -1.30458337e-04]] Final stress: [-2.27436203e-04 -3.63466828e-04 -2.92084657e-04 -7.13209261e-07 1.18854817e-07 4.79040357e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-6.31855346e-10 -9.68155775e-06 -8.69457282e-06] [ 7.11843913e-10 9.67918072e-06 -8.71252245e-06] [ 1.47393319e-10 9.67698670e-06 8.73161067e-06] [ 1.21374910e-10 -9.67990412e-06 8.67762835e-06] [ 1.93750739e-10 3.52549315e-08 8.50634879e-09] [-3.32993345e-08 -1.81569473e-08 9.21682389e-09] [ 3.28519155e-08 -1.76776099e-08 8.85701901e-09] [-8.46959875e-10 1.20095489e-09 -7.11432546e-09] [ 6.99245695e-09 2.33568631e-09 -1.87714422e-09] [-5.10280318e-09 2.72071365e-10 -3.26282673e-09] [ 2.00279382e-09 1.95711800e-05 -5.72150677e-09] [ 4.73767080e-06 1.93613797e-05 -5.03630890e-09] [-4.74112100e-06 1.93656657e-05 -5.18589003e-09] [ 9.84723414e-11 -1.95302241e-05 1.00260729e-09] [-4.76621184e-06 -1.93824156e-05 1.28065222e-09] [ 4.76619044e-06 -1.93822681e-05 9.25872759e-10] [ 1.45480294e-11 5.10822354e-05 -1.58823103e-05] [-1.06139653e-10 -5.10822954e-05 -1.58814053e-05] [ 4.14940859e-11 -5.10819137e-05 1.58812349e-05] [-1.16504473e-10 5.10818049e-05 1.58813267e-05] [ 1.90291893e-10 -1.20925776e-05 1.24862340e-05] [ 6.10914303e-12 1.20920460e-05 1.24864061e-05] [-1.92295773e-11 1.20919068e-05 -1.24873881e-05] [ 2.21980545e-10 -1.20924587e-05 -1.24878331e-05]] Final stress: [ 9.08302290e-05 1.42496997e-04 7.91702895e-05 1.56986618e-12 -5.39858442e-13 8.15684819e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-4.94437269e-10 9.33434681e-06 1.00189663e-06] [ 3.55628653e-10 -9.33455516e-06 9.93023321e-07] [-2.84426435e-12 -9.33404737e-06 -9.91081677e-07] [ 3.69164699e-11 9.33427939e-06 -9.92324822e-07] [ 2.71905815e-10 3.13163495e-09 5.84261250e-10] [-2.84401731e-09 -1.77543430e-09 5.18129678e-10] [ 2.27373437e-09 -1.13139675e-09 1.09672882e-10] [-7.22490867e-10 -7.03252923e-09 -5.75551495e-10] [ 5.84240112e-09 4.14429380e-09 -5.84838178e-10] [-4.47149240e-09 2.50790533e-09 -1.42796088e-09] [ 7.69696473e-10 -1.22515264e-05 -5.71542075e-10] [ 1.03471379e-06 -1.49495850e-05 -8.18525495e-10] [-1.03605662e-06 -1.49479301e-05 -8.72380294e-10] [-4.92959396e-10 1.22535278e-05 -2.16280502e-09] [-1.03651036e-06 1.49483182e-05 -1.90267561e-09] [ 1.03738203e-06 1.49472686e-05 -2.14499932e-09] [ 2.74577583e-11 -2.44163909e-05 5.66241262e-06] [-8.98616181e-11 2.44164168e-05 5.66224075e-06] [ 4.64590033e-11 2.44163956e-05 -5.66262840e-06] [-9.35642119e-11 -2.44163317e-05 -5.66263704e-06] [ 7.97635846e-11 1.11602441e-05 -1.73874735e-05] [-5.35732434e-11 -1.11602670e-05 -1.73872491e-05] [-5.69114787e-11 -1.11602331e-05 1.73866553e-05] [ 8.93591312e-11 1.11602250e-05 1.73870152e-05]] Final stress: [-6.10964343e-05 -1.15067944e-04 -5.73313346e-05 -1.24121882e-12 -5.01665131e-13 5.96312670e-13] Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.54137567e-08 1.30884382e-04 -5.89648131e-05] [ 1.08216419e-08 -1.30879324e-04 -5.17894924e-05] [-1.71361135e-09 -1.30904049e-04 5.42758700e-05] [-8.76740877e-09 1.30917136e-04 5.86900367e-05] [ 2.99392216e-09 -6.14059714e-06 -1.80916122e-06] [ 5.24019358e-06 3.04771404e-06 -1.76817841e-06] [-5.24715093e-06 3.05524862e-06 -1.77335455e-06] [-1.28381676e-08 -4.18824434e-06 1.20686164e-06] [ 3.68029549e-06 2.11829857e-06 1.24180028e-06] [-3.64990106e-06 2.08588548e-06 1.21808114e-06] [ 2.17456659e-08 -6.69323354e-05 -3.41183924e-07] [ 2.44873520e-04 4.52366224e-05 -3.31350827e-07] [-2.44911355e-04 4.52835567e-05 -3.36702623e-07] [-2.58036288e-08 6.58901613e-05 1.48400134e-07] [-2.43967674e-04 -4.47122631e-05 1.62637275e-07] [ 2.44015023e-04 -4.47694125e-05 1.63672253e-07] [ 3.24368282e-10 -5.52693649e-05 7.78532458e-05] [-1.16074722e-09 5.52694985e-05 7.78639782e-05] [ 5.15199772e-10 5.52752052e-05 -7.78405808e-05] [-1.86602139e-09 -5.52741257e-05 -7.78933643e-05] [ 1.95390770e-09 -1.52886172e-05 -4.93113450e-05] [-2.73743898e-09 1.52913874e-05 -4.91548779e-05] [-3.48058179e-09 1.52898642e-05 4.91899402e-05] [ 2.47476334e-09 -1.52866275e-05 4.92998815e-05]] Final stress: [-6.52048999e-05 -7.62273505e-05 -8.90475609e-05 -2.91927829e-11 1.67772031e-11 2.13032434e-11] 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: [[ 3.36072533e-08 -4.18006327e-06 -1.32534007e-05] [ 2.26024078e-10 6.16720661e-06 8.38995887e-07] [ 8.95233179e-09 4.16925754e-06 1.52711534e-06] [ 3.65588879e-09 -6.05125169e-06 1.59168178e-05] [ 1.73214239e-08 -7.54644996e-06 -3.03993751e-06] [ 6.24115909e-06 3.69126794e-06 -2.88455681e-06] [-6.25886960e-06 3.72212785e-06 -2.88227125e-06] [-6.23942153e-08 -6.54204355e-06 2.17983308e-06] [ 5.65414618e-06 3.32151798e-06 2.17442895e-06] [-5.56395252e-06 3.19788349e-06 2.14515804e-06] [ 4.11858107e-08 -3.50040584e-06 1.55131204e-05] [ 4.04818763e-06 1.68938806e-05 5.94905472e-07] [-4.11813879e-06 1.69811288e-05 6.21821848e-07] [ 7.93553688e-08 -1.15435738e-05 -1.63607746e-05] [ 9.01940888e-06 -9.48947369e-06 -1.42939681e-06] [-9.15887004e-06 -9.31510858e-06 -1.37940172e-06] [ 8.03468764e-10 3.97465865e-05 -5.14006408e-05] [-5.64474645e-09 -1.24142465e-05 -5.29592658e-05] [-5.06351738e-10 -3.97203919e-05 5.15602170e-05] [-6.20540547e-09 1.24161515e-05 5.26559524e-05] [ 5.25435323e-09 3.16394621e-05 4.74929220e-06] [ 8.41144991e-09 -1.97563934e-05 6.68759240e-06] [ 9.25185331e-09 -3.16453603e-05 -4.90808435e-06] [ 3.65466885e-09 1.97582916e-05 -6.66752038e-06]] Final stress: [-2.56043829e-05 -5.02668959e-05 -2.09376880e-05 -2.57206833e-05 6.08218599e-11 -1.68413450e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[-7.33223215e-04 4.86855594e-04 -3.60491027e-05] [-1.78515945e-04 7.17580227e-04 -2.69224025e-03] [ 7.45281011e-04 -5.62652391e-05 3.31905020e-05] [ 1.53950526e-03 1.03137084e-03 -2.60675277e-03] [-4.97876743e-03 3.50888233e-03 -1.49727250e-04] [-3.84797895e-03 -3.74124834e-03 2.77528920e-03] [ 3.43337958e-03 -3.41248145e-03 -2.61952493e-03] [ 7.87658707e-04 1.04539777e-03 -1.39750788e-03] [ 2.05908755e-03 -6.19297818e-04 4.16958661e-04] [ 6.24249564e-04 2.99129117e-03 -3.45739224e-03] [-5.21472923e-04 -2.07087156e-03 4.86193258e-03] [ 2.44715838e-03 -2.47158759e-03 -3.18471775e-03] [-2.06783147e-03 2.79862491e-03 3.61226088e-03] [-1.75431935e-03 -2.28984131e-03 4.84355797e-03] [ 3.05340234e-03 1.68186225e-04 -1.46467837e-03] [-9.74707060e-04 1.90098449e-03 1.86179546e-03] [-6.93355839e-04 2.38513429e-04 4.58025265e-04] [ 5.30785621e-04 1.40500730e-04 -5.62341040e-04] [-5.60195102e-04 -8.16553065e-04 -9.16616367e-05] [ 6.81854670e-04 5.56183825e-04 6.01313756e-04] [-5.29985643e-04 -3.78148060e-04 5.36889251e-05] [ 6.05410016e-04 2.74401100e-04 -3.37195880e-04] [-5.78032396e-04 -1.25150797e-04 -4.83186893e-04] [ 9.10612609e-04 1.22672614e-04 -4.35037201e-04]] Final stress: [-3.88622839e-04 -1.52161080e-04 -2.49814412e-04 2.45598551e-05 -9.45580156e-06 4.42750894e-07] Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 20 steps. Minimization converged after 191 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[ 1.38103213e-04 -7.24611161e-04 8.37943778e-04] [-1.30892915e-04 7.22214782e-04 -7.55826130e-04] [-1.37882191e-04 7.15901065e-04 -6.30511845e-04] [ 1.35158309e-04 -7.20188832e-04 7.24336932e-04] [ 3.42518149e-06 -2.35591582e-05 1.96591983e-07] [ 1.44004482e-05 6.93632877e-06 4.85486236e-06] [-2.20131022e-05 1.52867357e-05 -1.00599085e-06] [-2.49419092e-07 3.27026519e-04 -7.91303685e-05] [-2.64243043e-04 -1.59894635e-04 -6.60813633e-05] [ 2.62771901e-04 -1.59400706e-04 -6.87931301e-05] [ 1.41991113e-03 8.83129525e-05 2.66891064e-04] [-2.24343872e-03 3.60469366e-03 2.74163490e-04] [-1.45554878e-03 -2.48011881e-03 2.66735561e-04] [-1.42026253e-03 -9.91244684e-05 -2.63638699e-04] [ 2.25504238e-03 -3.59856890e-03 -2.65445266e-04] [ 1.44334035e-03 2.48619295e-03 -2.60313385e-04] [ 1.22349816e-04 -6.58947425e-04 -1.58484646e-04] [-1.23294020e-04 6.57508612e-04 -1.93335476e-04] [-1.21475337e-04 6.59318955e-04 1.60044606e-04] [ 1.22607632e-04 -6.59637549e-04 1.95340098e-04] [ 1.47366533e-04 5.14780094e-04 -9.69319430e-05] [-1.47956376e-04 -5.15418020e-04 -1.23227621e-04] [-1.45287155e-04 -5.14004686e-04 1.07808034e-04] [ 1.48066689e-04 5.15301694e-04 1.24410846e-04]] Final stress: [-1.21967242e-04 -3.24707896e-04 -2.38216374e-04 -4.24652215e-08 -7.24117855e-08 5.08433748e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 4.05588696e-04 -8.88678796e-04 2.71291367e-05] [-4.05588597e-04 8.88678814e-04 2.73557797e-05] [-4.05587117e-04 8.88677358e-04 -2.59426570e-05] [ 4.05588063e-04 -8.88678511e-04 -2.69257966e-05] [-7.23492650e-10 -3.58222099e-07 -1.16825456e-07] [ 3.10773335e-07 1.79770136e-07 -1.17418700e-07] [-3.09595042e-07 1.78152761e-07 -1.15990819e-07] [ 1.31526897e-09 6.94261890e-07 -2.48349660e-07] [-5.99775618e-07 -3.47772752e-07 -2.48491147e-07] [ 5.97411776e-07 -3.44863033e-07 -2.45426493e-07] [ 2.53341948e-04 -3.37717236e-05 -1.92192232e-07] [ 2.35754673e-04 -5.64924119e-04 -1.91894669e-07] [-2.09156063e-04 -2.83866467e-04 -1.90980423e-07] [-2.53341758e-04 3.41888852e-05 2.49207287e-08] [-2.36115465e-04 5.64715407e-04 2.47418384e-08] [ 2.09516191e-04 2.83658269e-04 2.47152175e-08] [-1.66866060e-04 -1.25175815e-04 2.88280902e-05] [ 1.66865948e-04 1.25175709e-04 2.88481203e-05] [ 1.66865683e-04 1.25175731e-04 -2.88451845e-05] [-1.66865507e-04 -1.25175833e-04 -2.88529495e-05] [ 4.03740260e-05 -2.51180369e-05 -2.20670464e-04] [-4.03741514e-05 2.51178863e-05 -2.20661667e-04] [-4.03743538e-05 2.51176781e-05 2.20671204e-04] [ 4.03744376e-05 -2.51177617e-05 2.20659579e-04]] Final stress: [-3.86703625e-05 -4.82230666e-05 -2.32490429e-05 -2.41887305e-14 -7.52179078e-12 1.59007480e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.36371427e-03 -2.24466188e-03 -4.69101099e-04] [ 1.36371537e-03 2.24466215e-03 -4.68201308e-04] [ 1.36371620e-03 2.24466219e-03 4.68347588e-04] [-1.36371371e-03 -2.24466261e-03 4.68323919e-04] [-1.24302727e-10 9.08115653e-08 1.44413669e-08] [-7.63984768e-08 -4.50023670e-08 1.39427007e-08] [ 7.60062068e-08 -4.50153181e-08 1.34058347e-08] [ 2.18313595e-09 -3.62492039e-07 1.34305260e-07] [ 3.09645998e-07 1.78250618e-07 1.31371983e-07] [-3.13846186e-07 1.83128122e-07 1.35536631e-07] [ 8.72245703e-04 -3.05972740e-03 -5.26820169e-08] [-2.57803458e-03 -1.20320990e-03 -5.22103740e-08] [ 4.20227880e-04 1.05210879e-03 -5.23115904e-08] [-8.72245802e-04 3.05902126e-03 1.13135213e-07] [ 2.57864520e-03 1.20356283e-03 1.13971251e-07] [-4.20839638e-04 -1.05175539e-03 1.12386978e-07] [ 8.14239787e-05 -2.11392439e-04 1.24470346e-04] [-8.14238224e-05 2.11392442e-04 1.24469768e-04] [-8.14242231e-05 2.11392369e-04 -1.24455385e-04] [ 8.14241384e-05 -2.11392263e-04 -1.24477284e-04] [ 6.90336390e-05 1.85109367e-04 -7.62575704e-04] [-6.90334585e-05 -1.85109345e-04 -7.62567560e-04] [-6.90338401e-05 -1.85109106e-04 7.62574393e-04] [ 6.90337735e-05 1.85109252e-04 7.62567033e-04]] Final stress: [-6.83631569e-05 -5.92836792e-05 -2.36123792e-05 -3.18312841e-12 3.95813796e-12 4.07594170e-06] Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 1.21141675e-05 -1.33861430e-04 1.19746117e-05] [-1.21140689e-05 1.33861623e-04 1.19178679e-05] [-1.21139694e-05 1.33861775e-04 -1.19084204e-05] [ 1.21140275e-05 -1.33861750e-04 -1.19050866e-05] [-9.04754647e-11 1.09489717e-09 -1.94576261e-09] [-6.83060011e-10 -3.83558255e-10 -2.14420268e-09] [ 8.58351445e-10 -6.01285188e-10 -2.03075134e-09] [ 2.44334931e-10 3.20457381e-08 -1.27195066e-08] [-2.88723889e-08 -1.64692309e-08 -1.32989972e-08] [ 2.83947320e-08 -1.59236929e-08 -1.29754616e-08] [-2.71718716e-05 6.32865383e-05 2.17020950e-10] [ 1.01454377e-04 -6.99167302e-05 2.18262202e-10] [-1.30846965e-04 -8.44987716e-05 2.01727354e-10] [ 2.71719274e-05 -6.32651103e-05 -1.04335373e-08] [-1.01473222e-04 6.99059540e-05 -1.06145539e-08] [ 1.30865702e-04 8.44880497e-05 -1.05829691e-08] [-3.83855456e-05 -8.77252318e-06 -1.32674141e-06] [ 3.83855671e-05 8.77256315e-06 -1.32707934e-06] [ 3.83855230e-05 8.77250409e-06 1.32556438e-06] [-3.83855081e-05 -8.77247872e-06 1.32660821e-06] [ 1.17899620e-05 -1.24062682e-05 -3.45867203e-05] [-1.17899559e-05 1.24062833e-05 -3.45875685e-05] [-1.17899547e-05 1.24062893e-05 3.45864534e-05] [ 1.17899570e-05 -1.24062801e-05 3.45866198e-05]] Final stress: [4.75452430e-05 4.82631387e-05 7.50669481e-05 4.78121160e-13 1.84041995e-13 2.51837381e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[-1.55706784e-05 -1.10145166e-04 -9.10155010e-06] [ 1.55700975e-05 1.10143798e-04 -9.89964819e-06] [ 1.55702623e-05 1.10144566e-04 1.00736850e-05] [-1.55696858e-05 -1.10143748e-04 9.29299199e-06] [ 5.18821220e-10 3.59279861e-07 1.19882409e-07] [-3.11864408e-07 -1.80265900e-07 1.20110708e-07] [ 3.10749452e-07 -1.79045570e-07 1.19736040e-07] [-2.89632889e-10 6.00767824e-07 -2.03118162e-07] [-5.19196156e-07 -2.99816183e-07 -2.01942026e-07] [ 5.19687452e-07 -3.00461559e-07 -2.02972920e-07] [ 4.86387378e-05 2.92201354e-04 -1.65872307e-08] [ 2.39469148e-04 -1.41808708e-04 -1.76898609e-08] [-1.43284748e-04 -1.40590947e-04 -1.72126731e-08] [-4.86385224e-05 -2.91591265e-04 -2.10363018e-08] [-2.39997469e-04 1.41503619e-04 -1.94461918e-08] [ 1.43812896e-04 1.40286118e-04 -2.02326827e-08] [ 6.03042515e-05 -3.19610721e-05 -1.31713507e-05] [-6.03042955e-05 3.19609599e-05 -1.31621714e-05] [-6.03041183e-05 3.19611071e-05 1.31595461e-05] [ 6.03041783e-05 -3.19610264e-05 1.31691158e-05] [-9.77001671e-06 -2.26074002e-05 -4.86698380e-05] [ 9.77016864e-06 2.26073398e-05 -4.86786751e-05] [ 9.77021322e-06 2.26073608e-05 4.86784709e-05] [-9.77002558e-06 -2.26073477e-05 4.86699327e-05]] Final stress: [ 4.67941843e-05 4.66848388e-05 7.50808916e-05 -6.29067945e-12 -3.38009768e-12 -2.01033325e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 8.78492072e-06 -6.98640459e-05 -7.84512229e-07] [-8.78451333e-06 6.98640266e-05 -1.07471531e-06] [-8.78450779e-06 6.98642348e-05 1.31465301e-06] [ 8.78481771e-06 -6.98639924e-05 9.61725061e-07] [ 1.65354638e-10 -5.79842662e-08 -5.33127975e-09] [ 5.00111982e-08 2.87986135e-08 -5.21282467e-09] [-5.03700484e-08 2.91937519e-08 -5.46233053e-09] [ 5.89883951e-10 2.42254735e-07 -9.26828181e-08] [-2.11115700e-07 -1.21908441e-07 -9.33309585e-08] [ 2.10021485e-07 -1.20594027e-07 -9.25932176e-08] [-1.81308856e-05 2.45555850e-06 -2.54037485e-08] [ 4.97340970e-06 -2.93676660e-05 -2.54497069e-08] [-3.46930780e-05 -3.32690802e-05 -2.55750555e-08] [ 1.81310311e-05 -1.95030091e-06 -1.43294922e-08] [-5.41138389e-06 2.91148262e-05 -1.41797201e-08] [ 3.51306498e-05 3.30165846e-05 -1.42017146e-08] [-2.49611171e-05 -3.65798899e-06 -3.32911627e-06] [ 2.49612000e-05 3.65801728e-06 -3.32059876e-06] [ 2.49611395e-05 3.65799566e-06 3.31893418e-06] [-2.49610634e-05 -3.65794415e-06 3.32600714e-06] [ 1.16225113e-05 -3.07044121e-06 2.08228696e-05] [-1.16224710e-05 3.07044381e-06 2.08237488e-05] [-1.16224864e-05 3.07045085e-06 -2.08225325e-05] [ 1.16225245e-05 -3.07043894e-06 -2.08227098e-05]] Final stress: [-1.94615028e-05 -1.91685070e-05 -5.32878048e-05 -7.58475383e-13 2.55001182e-13 2.68351154e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-3.44339977e-05 -2.79763639e-04 -4.08207906e-05] [ 3.44340446e-05 2.79764596e-04 -4.08188096e-05] [ 3.44312103e-05 2.79764594e-04 4.12210808e-05] [-3.44325538e-05 -2.79762919e-04 4.08246686e-05] [ 6.11645015e-10 -3.33141799e-07 -7.46486372e-08] [ 2.82458926e-07 1.64877940e-07 -7.15230047e-08] [-2.84003063e-07 1.66343052e-07 -7.35056992e-08] [-1.34087978e-09 -9.72867298e-08 -1.36896748e-08] [ 8.39308165e-08 5.00126722e-08 -1.32028791e-08] [-8.04757648e-08 4.65495962e-08 -1.60418922e-08] [-2.03501513e-05 1.94463192e-05 -5.79006871e-08] [ 1.57867454e-04 -3.18874346e-05 -5.72975154e-08] [-1.60079442e-05 -1.33411507e-04 -5.93722514e-08] [ 2.03509712e-05 -1.84898914e-05 1.30146943e-08] [-1.58698013e-04 3.14082227e-05 1.35331331e-08] [ 1.68382120e-05 1.32933401e-04 1.29796915e-08] [ 2.14014772e-04 -1.23246072e-04 8.07234495e-05] [-2.14014583e-04 1.23246377e-04 8.07426434e-05] [-2.14014322e-04 1.23246546e-04 -8.07412344e-05] [ 2.14014319e-04 -1.23246179e-04 -8.07312120e-05] [ 9.68372558e-06 -5.64627992e-06 -2.92134491e-04] [-9.68396778e-06 5.64637864e-06 -2.92120413e-04] [-9.68404202e-06 5.64636880e-06 2.92122700e-04] [ 9.68368491e-06 -5.64623602e-06 2.92130063e-04]] Final stress: [-2.38579420e-05 -2.70848731e-05 -5.33406819e-05 -2.03919960e-12 5.79921114e-12 -1.26131442e-05] Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 114 steps. Final forces: [[ 0.00690182 -0.00472413 -0.0020048 ] [ 0.00979086 -0.01263391 0.00806868] [-0.00071823 -0.00670015 -0.01231373] [ 0.00782281 -0.01213996 0.01066876] [ 0.00438718 -0.02583728 0.01174882] [-0.01166023 0.01031164 0.02974801] [ 0.04277681 0.0107991 -0.03744892] [ 0.01860339 -0.01311403 0.01420905] [-0.03345373 0.00439035 -0.01099702] [ 0.01459569 0.01408241 0.00914163] [-0.02075396 0.01916601 -0.01245927] [ 0.02473708 0.01495592 -0.01415535] [-0.0275706 -0.01378241 -0.00287091] [-0.01870439 0.01868713 -0.00205154] [ 0.02563173 0.01381339 0.00763287] [-0.02705867 -0.00555705 0.0033132 ] [-0.00474671 0.00382482 -0.03529489] [ 0.01980708 -0.00433883 0.04467241] [-0.0133244 -0.00183855 0.02890875] [-0.00174545 -0.00286038 -0.04456423] [-0.00573041 0.0007078 -0.00425374] [-0.00106342 -0.00636365 0.00336125] [-0.00563347 -0.00071513 0.01291205] [-0.00289078 -0.0001331 -0.0059711 ]] Final stress: [ 3.49862802e-02 3.53203764e-02 1.42240115e-01 -7.07018719e-04 4.50313895e-04 -1.16468100e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 4.07239852e-05 -5.10774358e-05 2.74307218e-04] [-7.00006912e-05 8.56289395e-05 -2.82428975e-04] [-4.07238239e-05 5.10808224e-05 -2.73873990e-04] [ 7.00005776e-05 -8.56290711e-05 2.82405321e-04] [-1.91783686e-09 1.41858601e-07 3.03861504e-08] [-1.18059660e-07 -6.90383178e-08 2.94997804e-08] [ 1.20563517e-07 -7.22591357e-08 3.11690193e-08] [ 6.19920200e-10 4.71160879e-07 -1.29017966e-07] [-4.11665858e-07 -2.35458639e-07 -1.32380338e-07] [ 4.10946952e-07 -2.38963677e-07 -1.31478994e-07] [ 5.18013985e-05 -9.98272500e-07 1.29138884e-04] [-1.48809315e-04 1.01024487e-04 7.62799408e-05] [-1.79348875e-04 -1.55649662e-04 1.09078910e-04] [-5.18012397e-05 7.94960613e-07 -1.29174707e-04] [ 1.48984887e-04 -1.00922295e-04 -7.63162481e-05] [ 1.79172807e-04 1.55750092e-04 -1.09114671e-04] [-2.21178375e-04 1.99880748e-06 1.50843398e-04] [ 2.28145076e-04 1.32015845e-04 1.35595356e-04] [ 2.21177875e-04 -1.99922298e-06 -1.50842451e-04] [-2.28145400e-04 -1.32015819e-04 -1.35600060e-04] [-1.26828929e-04 2.39636442e-05 -1.30056733e-04] [ 1.22287094e-04 -6.87031821e-06 -1.39180583e-04] [ 1.26829351e-04 -2.39632525e-05 1.30068017e-04] [-1.22286890e-04 6.87045019e-06 1.39173197e-04]] Final stress: [ 1.35921408e-05 1.29098206e-05 4.94059185e-06 -2.87201269e-05 -1.37255252e-06 -1.91120616e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.15797271e-05 4.45351377e-05 1.05932836e-04] [ 4.30100916e-05 1.07172791e-05 7.03389832e-05] [ 1.34561106e-04 -4.34673343e-05 -1.16376866e-04] [-2.77269599e-05 6.83319844e-05 -3.56403434e-05] [-4.93381506e-05 5.56513551e-05 2.41268513e-06] [ 3.32226490e-05 1.38615423e-05 1.90499404e-05] [-8.25300000e-05 -1.10452961e-04 -5.07836396e-06] [ 8.24299597e-05 -1.36466302e-05 8.58177434e-05] [-3.08993780e-06 8.18066666e-05 -1.03300706e-04] [ 5.45677282e-05 6.20191529e-05 5.39079923e-05] [ 8.14929742e-05 2.08589008e-05 9.32829003e-05] [-9.22235061e-05 2.69711731e-05 -1.30172244e-05] [-6.84986009e-05 4.95625360e-05 -9.39896050e-05] [-3.43573620e-05 -9.26185599e-05 4.16487247e-05] [ 1.00745265e-04 -9.69402160e-05 -2.60294353e-05] [-3.58594201e-05 8.04702175e-06 -8.03507449e-05] [ 3.41543690e-05 -8.66479441e-07 2.91933658e-05] [-7.23079775e-05 -2.59806599e-05 1.59929812e-05] [ 9.39084741e-05 1.09333855e-05 4.28619184e-05] [ 4.59754770e-05 -4.26375911e-05 4.58093583e-05] [-3.76046739e-05 5.95838606e-05 3.31641298e-05] [-9.70241632e-05 -5.42103402e-05 -9.62176008e-05] [-4.83277361e-05 2.24671343e-05 4.81321825e-06] [-6.67593322e-05 -5.45263585e-05 -7.42258876e-05]] Final stress: [ 3.32819603e-02 3.23517618e-02 1.34820596e-01 -2.14099955e-05 -8.81587867e-07 8.53375634e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 40 steps. Final forces: [[ 9.09933803e-05 2.28714487e-03 -5.43784225e-03] [ 7.83243010e-04 -2.45409198e-03 7.68260792e-03] [-8.97841201e-05 -2.28691211e-03 5.12923301e-03] [-7.82103396e-04 2.45445890e-03 -7.74141036e-03] [ 4.33240490e-07 1.11356415e-05 1.16553262e-05] [-1.13139375e-05 -6.48121784e-06 1.26466409e-05] [ 1.00123905e-05 -5.15086592e-06 1.16975229e-05] [ 1.21427710e-06 -1.58281411e-04 6.12048155e-05] [ 1.35860529e-04 7.76276714e-05 5.94228669e-05] [-1.37534663e-04 8.04219856e-05 6.27720790e-05] [ 1.58936023e-02 5.77081380e-04 -1.51493517e-03] [-5.74607368e-03 1.18299074e-02 -6.19111736e-04] [-4.37640461e-03 -1.11834277e-02 -2.47736828e-03] [-1.58934584e-02 -6.87172299e-04 1.56053025e-03] [ 5.84046671e-03 -1.17756147e-02 6.64759791e-04] [ 4.28094119e-03 1.12389937e-02 2.52273013e-03] [ 3.31043198e-03 -8.23171328e-04 1.04833309e-03] [-2.60647787e-03 2.21898640e-03 1.16410630e-03] [-3.31042928e-03 8.23326076e-04 -1.04304733e-03] [ 2.60688651e-03 -2.21891549e-03 -1.16216821e-03] [ 2.46718118e-03 -6.47648307e-04 -3.15392687e-03] [-1.99934393e-03 8.92943789e-04 -2.83660166e-03] [-2.46769624e-03 6.47758400e-04 3.15468657e-03] [ 1.99935344e-03 -8.92918722e-04 2.84002555e-03]] Final stress: [-7.39544173e-05 -2.30714003e-04 -1.17525887e-04 8.17390614e-06 3.03897158e-05 1.41894368e-04] Minimization converged after 18 steps. Minimization converged after 18 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.88260374e-05 -6.71388311e-05 5.38975296e-05] [-5.26111376e-05 1.73180164e-05 2.27661582e-05] [ 7.98048933e-05 -1.10317157e-04 1.58180886e-05] [-7.99202806e-05 7.57223176e-05 2.13744866e-05] [ 2.50804275e-05 7.20059317e-05 6.76056981e-05] [-4.62208995e-06 -9.26375349e-05 9.85680205e-05] [ 1.22669018e-04 -9.30395782e-05 2.88267686e-05] [ 6.70755752e-05 6.25508175e-06 3.99425096e-05] [-3.61087554e-05 1.49406141e-04 -4.20876334e-05] [-7.79956096e-05 -4.31228404e-05 4.62059571e-05] [-6.75828103e-05 -3.63979165e-06 -2.45349997e-05] [-5.00628425e-05 2.17134371e-05 -3.55035323e-05] [ 5.41262658e-05 -1.19579066e-05 -4.26156648e-05] [ 3.25675291e-05 6.60734201e-05 2.68216754e-05] [-2.32825979e-05 2.68158656e-05 -6.12497734e-05] [-4.10445846e-05 -1.49759700e-05 -3.49910402e-05] [ 1.40402381e-05 -6.36569397e-06 3.51287131e-06] [ 4.17145513e-05 -4.58584931e-05 -1.00667547e-04] [ 9.04135562e-06 3.66466298e-06 -1.53235018e-05] [ 6.24862616e-05 1.86739361e-05 -6.11362146e-05] [-8.40653460e-05 3.42071633e-05 1.03045285e-05] [ 1.60370365e-06 -2.08000187e-05 -1.75797023e-05] [-5.64764557e-05 3.99665442e-05 -3.33705588e-05] [ 1.47366538e-05 -2.19687029e-05 3.34158760e-05]] Final stress: [ 3.32752403e-02 3.23445065e-02 1.34814713e-01 -2.94555609e-06 1.98957926e-05 -7.59414589e-04] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 2.31310754e-04 2.30339081e-04 1.75585045e-04] [-1.08984137e-04 -7.53466995e-05 -1.61635000e-04] [ 1.14804438e-05 -2.39898045e-04 -1.71548412e-04] [-8.42582561e-04 -3.16326030e-04 -7.06399402e-05] [ 5.06370710e-06 -8.65065999e-05 4.46533281e-06] [-6.97308562e-05 2.43586589e-04 -8.24381249e-04] [-7.99026631e-05 3.25930936e-04 4.01115610e-04] [-1.74502816e-06 -3.40913604e-04 5.31078805e-05] [ 2.91999113e-04 -1.25832244e-04 3.22044840e-04] [-1.53554316e-04 -1.08025079e-04 2.68436525e-04] [-7.55266893e-04 -4.11815381e-04 7.55344992e-05] [ 5.10858408e-04 5.68033155e-04 -1.40334556e-04] [ 5.46524639e-05 3.68830160e-04 -4.29427806e-04] [ 3.64718080e-05 -1.73982256e-04 -2.25149512e-04] [ 3.56119102e-04 3.35369430e-04 1.30522215e-04] [ 1.30069863e-04 3.01407026e-04 -9.53695767e-05] [ 1.51458442e-05 -2.15261784e-04 4.63398762e-05] [-1.83015293e-04 8.59024449e-05 2.88025552e-04] [-1.00287122e-04 -1.50830482e-04 2.41553953e-04] [ 3.88287253e-05 1.19769756e-04 3.00377152e-04] [ 2.84060624e-04 -1.24113047e-04 -2.55816737e-05] [ 1.68806022e-04 -6.96536223e-05 3.08631895e-05] [ 3.03309070e-04 -1.80536253e-04 -2.57795600e-04] [-1.43107078e-04 3.98725492e-05 6.38916553e-05]] Final stress: [ 3.35842695e-02 3.24706231e-02 1.35159484e-01 -8.02923747e-06 -9.72216277e-04 -4.56115242e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.93465309e-05 -1.21590761e-05 -4.15022071e-05] [ 1.72349259e-05 -1.05074481e-05 -2.04871063e-05] [ 1.63219230e-05 -3.27842314e-05 -3.78117144e-05] [-2.14663019e-05 2.63197020e-05 1.86031876e-05] [ 2.39846963e-05 -6.89704148e-05 5.82682633e-06] [-8.46260548e-05 -4.70823889e-05 1.07586485e-05] [ 3.03968140e-05 2.38917765e-06 2.09901878e-05] [-1.48390157e-05 -2.74066115e-05 -1.46909084e-05] [-3.51126779e-05 1.34322853e-05 -3.56608180e-05] [ 4.10288393e-06 1.74596780e-05 -2.84050599e-06] [ 6.74089377e-05 1.14571143e-04 -2.40286709e-05] [-9.21300245e-05 1.21574108e-05 -2.18932528e-06] [-7.44326644e-06 -1.06487795e-05 4.65219341e-05] [-5.65728479e-06 2.80908522e-05 1.22332032e-05] [-4.72522814e-05 1.08351251e-04 2.50714115e-05] [ 3.76060835e-05 -9.25680010e-05 2.97366823e-05] [ 5.64056178e-05 5.13883534e-06 9.88156563e-07] [-6.69956728e-06 -6.38055289e-06 1.87529567e-05] [ 3.70731801e-05 1.37067606e-06 1.45933298e-05] [ 4.28000059e-05 6.87643338e-05 -6.68676645e-06] [-4.05686479e-05 -7.49234770e-05 5.64291430e-06] [-6.39123661e-06 -8.38730885e-06 7.54820622e-06] [ 2.17387466e-05 2.40967149e-05 -4.15274968e-05] [-1.22339865e-05 -3.03237706e-05 1.01578747e-05]] Final stress: [ 3.35831814e-02 3.24747420e-02 1.35154365e-01 -1.28752361e-06 9.78943872e-04 4.63011475e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-9.48197643e-06 3.31135197e-05 -1.04513701e-05] [ 1.25374842e-06 -3.41212847e-06 9.62614556e-06] [ 1.54424536e-06 -6.29923963e-06 -2.77137005e-06] [ 6.12489164e-06 -1.37440862e-05 -4.30520902e-06] [-7.61317541e-08 -2.46435831e-05 -1.17152703e-07] [ 1.58777390e-06 -6.35674649e-06 1.81063649e-05] [-1.91126135e-05 -4.69609329e-06 -1.24954057e-05] [ 2.21969237e-05 -1.25205639e-05 -1.88372208e-05] [ 2.04479173e-05 1.52823322e-05 -8.10950824e-06] [ 1.99242431e-07 5.33965422e-06 -1.96219093e-06] [-1.96922052e-06 -1.06445833e-05 2.93177219e-05] [-2.52127177e-05 2.14422491e-05 -1.90867181e-06] [ 1.62306642e-05 3.08760668e-05 -2.40045658e-06] [-1.86285014e-05 1.45942021e-05 1.36482472e-05] [ 2.55523075e-05 -3.77344598e-05 -1.83315868e-06] [-2.13754795e-05 -7.06178263e-06 7.42650038e-06] [-8.71562668e-06 -2.52763363e-05 -9.82108273e-07] [-1.71270621e-06 4.82705925e-06 -2.27013600e-06] [-1.27898472e-05 2.45466074e-05 5.85439641e-06] [ 7.49828454e-06 1.10600473e-05 1.06786055e-05] [-6.25505444e-06 4.35334118e-06 -7.33044910e-06] [ 1.72896475e-05 -3.03266083e-06 -7.89635806e-06] [-5.80872641e-06 -6.06832807e-06 -1.28569419e-05] [ 1.12129552e-05 -3.94448722e-06 1.86972628e-06]] Final stress: [ 3.32759878e-02 3.23433494e-02 1.34814710e-01 -1.58617316e-06 -2.05083979e-05 7.59691880e-04] Minimization converged after 173 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-5.16538180e-04 3.44190481e-04 -6.31015808e-04] [ 5.05285140e-04 -3.37816483e-04 1.17086963e-03] [ 5.19404318e-04 -3.44682912e-04 4.98353645e-04] [-5.00055051e-04 3.40010837e-04 -9.79950813e-04] [ 1.62790981e-06 -1.17469766e-04 -4.46274141e-05] [ 9.98605460e-05 5.59350458e-05 -3.99178240e-05] [-1.04666948e-04 6.05481709e-05 -4.62162950e-05] [ 5.13034241e-06 -2.80669822e-04 6.20934091e-05] [ 2.36758620e-04 1.34487186e-04 5.70776459e-05] [-2.45269274e-04 1.45467476e-04 6.48697953e-05] [ 4.86178178e-03 -2.96536934e-04 -3.14736585e-04] [-2.10772228e-03 3.10390149e-03 -3.16697873e-04] [-2.15480579e-03 -3.94922505e-03 -3.02694303e-04] [-4.85936336e-03 3.83984087e-04 2.81515028e-04] [ 2.02900351e-03 -3.15067316e-03 2.87978220e-04] [ 2.22922168e-03 3.90790658e-03 2.70164541e-04] [-4.50493546e-04 2.23010120e-04 1.05099945e-03] [ 4.52629568e-04 -2.23332494e-04 1.09094890e-03] [ 4.51330627e-04 -2.23169294e-04 -1.05587310e-03] [-4.51378785e-04 2.23498899e-04 -1.09307025e-03] [-2.33101213e-04 5.13039095e-04 9.99519107e-04] [ 2.33746796e-04 -5.12560658e-04 1.03003790e-03] [ 2.31502604e-04 -5.12855004e-04 -1.01041302e-03] [-2.33889012e-04 5.13012118e-04 -1.02921399e-03]] Final stress: [-1.58366446e-04 -2.23761004e-04 -2.52950107e-04 2.21768818e-08 2.50317914e-08 4.23601231e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-5.70749670e-10 8.61817067e-06 -8.05004364e-06] [ 8.00401624e-10 -8.62050246e-06 -7.98934877e-06] [ 1.79198429e-10 -8.62008584e-06 8.00594914e-06] [-1.18772936e-10 8.62027904e-06 7.97269394e-06] [ 9.16301884e-10 5.92909288e-09 3.14841198e-09] [-4.91173387e-09 -3.81722775e-09 3.32400868e-09] [ 2.88116514e-09 -1.58417701e-09 1.84937418e-09] [-3.54850512e-10 -4.41889032e-08 1.25213611e-08] [ 3.89485822e-08 2.28165378e-08 1.35977365e-08] [-3.82951660e-08 2.19913457e-08 1.32182421e-08] [ 7.78515696e-10 -2.03167506e-05 -6.03326948e-09] [ 6.30278557e-07 -1.42292265e-05 -6.20133468e-09] [-6.31751303e-07 -1.42274846e-05 -6.32044841e-09] [-1.69293063e-09 2.03361838e-05 9.09784765e-09] [-6.42242180e-07 1.42212155e-05 1.12234430e-08] [ 6.45158503e-07 1.42175876e-05 1.12897126e-08] [ 9.78006565e-11 -2.25058649e-05 -5.93737300e-06] [-2.59863797e-11 2.25057228e-05 -5.93604907e-06] [ 1.13271337e-10 2.25058727e-05 5.93731187e-06] [-5.66895142e-11 -2.25057884e-05 5.93649807e-06] [ 9.09226028e-11 6.24677181e-06 2.67559882e-05] [-1.53762900e-10 -6.24705430e-06 2.67573823e-05] [-1.88120523e-10 -6.24700553e-06 -2.67567599e-05] [ 1.19028509e-10 6.24681256e-06 -2.67569642e-05]] Final stress: [ 9.48292494e-05 6.27482701e-05 5.29467803e-05 -7.35106076e-12 5.00483201e-13 1.13126015e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-3.09705844e-10 5.85315086e-07 7.22523497e-05] [-1.00630985e-09 -5.84238127e-07 7.22283123e-05] [-5.62472794e-10 -5.85632994e-07 -7.22162764e-05] [ 2.65379679e-09 5.84401619e-07 -7.22489462e-05] [ 3.11198566e-09 5.44195146e-08 9.34564853e-09] [-5.13881249e-08 -3.09696291e-08 1.17069966e-08] [ 4.45078164e-08 -2.34312872e-08 6.78657727e-09] [-9.70205177e-11 3.96212649e-08 -1.00429282e-08] [-3.11895423e-08 -1.91053664e-08 -8.67707184e-09] [ 3.16876498e-08 -1.95323113e-08 -9.20293034e-09] [-5.08172077e-09 3.68120095e-05 -3.50573489e-09] [-4.94494343e-05 -1.84564579e-05 -3.65008414e-09] [ 4.94581059e-05 -1.84673589e-05 -1.37879427e-09] [ 1.00238529e-09 -3.68062645e-05 -6.09957880e-10] [ 4.94440330e-05 1.84573834e-05 -1.07428959e-09] [-4.94460562e-05 1.84597164e-05 -2.51208155e-09] [ 2.88007673e-10 3.97670505e-05 2.31635983e-06] [-7.97963917e-11 -3.97670366e-05 2.31705449e-06] [ 3.82361198e-10 -3.97669521e-05 -2.31744037e-06] [ 1.26210153e-10 3.97667626e-05 -2.31691995e-06] [-6.18056495e-10 -1.06246939e-05 5.20052289e-05] [ 2.12708466e-10 1.06248856e-05 5.20031604e-05] [ 1.20340491e-10 1.06248646e-05 -5.20039203e-05] [-4.09023926e-10 -1.06247566e-05 -5.20061477e-05]] Final stress: [-6.46451641e-05 -3.28375963e-05 -3.36004374e-05 6.63928833e-12 -9.80734584e-12 -2.92161771e-12] Minimization converged after 7 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 8 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 17 steps. Minimization converged after 16 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 39 steps. Final forces: [[ 1.16423502e-04 -8.69474503e-05 -7.09000588e-03] [-2.34416517e-04 1.97103576e-05 8.95619404e-03] [-2.13458137e-04 1.61936380e-04 8.87025321e-03] [-5.38761846e-05 -2.77278717e-04 -7.07033830e-03] [-2.02420132e-04 8.35219142e-04 -4.04954999e-05] [-2.39140691e-04 -8.96381055e-05 -4.15117713e-04] [ 7.03010145e-04 -5.90869155e-04 -5.77929308e-05] [ 5.30426814e-05 3.57287954e-04 -2.85197567e-04] [-3.12938458e-04 -2.45690047e-04 -3.48381258e-04] [ 2.58671745e-04 -1.54543255e-04 -3.50157318e-04] [-2.71292349e-03 4.76566325e-05 -3.13264003e-03] [ 1.82639907e-03 -1.67328504e-03 -3.19287014e-03] [ 9.30003944e-04 2.94094020e-03 -3.26370872e-03] [ 2.47582819e-03 -6.63737472e-04 2.64993738e-03] [-6.83563842e-04 2.31512460e-03 2.49494539e-03] [-1.61058198e-03 -2.83834556e-03 2.56067330e-03] [-2.39548181e-04 1.47299554e-04 -2.35045807e-04] [ 2.08759779e-04 -1.69362518e-04 1.34971786e-04] [ 1.99841386e-04 -1.70960474e-04 1.81326300e-04] [-1.92983302e-04 1.74401528e-04 -2.06382794e-04] [-5.28517564e-05 1.04866286e-04 -5.02881304e-05] [-4.41210790e-06 -1.34623435e-04 1.59744552e-04] [ 2.05211840e-05 -1.10948055e-04 1.47131633e-06] [-3.93868465e-05 1.01786660e-04 -2.71095196e-04]] Final stress: [-2.28899312e-04 -2.21006165e-04 -1.74182610e-04 -4.13980975e-07 -5.53058751e-07 -6.54916560e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 36 steps. Final forces: [[-2.78299615e-03 -3.35762115e-03 -5.85612966e-02] [ 1.75863575e-03 2.62953512e-03 3.51106358e-02] [-6.61814751e-04 4.45386482e-03 3.11329742e-02] [ 5.51621708e-05 -2.08268826e-03 -5.18072418e-02] [-8.32976996e-04 1.64936747e-02 3.22628981e-03] [-1.40484554e-02 -7.68975247e-03 3.76637950e-03] [ 1.51775121e-02 -9.30699441e-03 4.25547876e-03] [-4.34074648e-03 -3.34672627e-02 1.04125048e-02] [ 2.59977438e-02 2.04797606e-02 1.04934740e-02] [-1.60150900e-02 9.68951801e-03 2.99907374e-03] [ 1.79258014e-02 1.08369985e-02 -1.38827162e-02] [-1.59533160e-02 9.13434066e-03 -1.42408191e-02] [-8.68074600e-03 -1.25328599e-02 -1.48940922e-02] [-9.94855134e-03 8.94114000e-03 1.59154505e-02] [ 1.07455845e-03 -2.62177660e-02 1.89804259e-02] [ 1.10447347e-02 1.19334970e-02 1.78416749e-02] [ 2.33697754e-03 2.94532629e-03 3.39578846e-04] [-2.78482626e-03 -2.89195594e-03 2.71637821e-03] [-2.49642403e-03 -2.84808551e-03 -5.46044178e-04] [ 1.81024249e-03 3.40992633e-03 -2.32304159e-03] [ 3.14436686e-04 -8.30835870e-04 1.16958676e-03] [ 5.55972504e-04 4.60666742e-04 2.19772572e-03] [ 8.33646670e-05 6.46001522e-04 -1.39054541e-03] [ 4.10801069e-04 -8.28428072e-04 -2.91183448e-03]] Final stress: [-1.05683135e-04 -2.66330902e-04 -3.01648647e-04 -1.39799145e-05 3.38642328e-06 3.68845610e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 43 steps. Final forces: [[-4.48362478e-03 -1.22998122e-02 -5.69594278e-03] [ 4.83988974e-03 1.25684958e-02 -4.91755486e-03] [ 4.99382934e-03 1.23555625e-02 7.46853469e-04] [-5.48221120e-03 -1.28341522e-02 3.70788661e-04] [ 1.82142810e-04 -8.79717446e-04 5.13263628e-04] [ 1.09098653e-03 3.95455383e-04 2.05852799e-04] [-1.10614050e-03 6.05668802e-04 5.26575233e-04] [-4.92424172e-04 1.63717000e-03 4.07412266e-04] [-5.27210690e-04 -3.38570977e-04 4.39740513e-04] [ 1.00470747e-03 -1.19377804e-03 5.74252970e-04] [-9.13410529e-03 -1.77054878e-02 7.66396473e-04] [-1.16723441e-02 -1.00047144e-02 8.36335353e-04] [ 1.61267828e-02 1.99970727e-02 1.05667031e-03] [ 9.00848332e-03 1.80942624e-02 1.42698969e-03] [ 1.18581050e-02 9.99801106e-03 3.66162430e-04] [-1.61182420e-02 -2.02661215e-02 1.50319739e-03] [ 6.61746982e-05 -3.25589480e-03 -2.24662564e-04] [-6.21800843e-05 3.23729150e-03 -2.01628432e-04] [-8.34587092e-05 3.20658195e-03 4.15015593e-04] [ 9.29329621e-06 -3.29018980e-03 4.11558208e-04] [ 4.61782422e-05 2.28991492e-03 1.02562017e-03] [-3.05722828e-05 -2.26400895e-03 1.02089726e-03] [-4.67850152e-05 -2.32178639e-03 -7.74543833e-04] [ 1.27256821e-05 2.26874760e-03 -7.99249948e-04]] Final stress: [-1.42672550e-05 -5.60363767e-04 -2.94588909e-04 2.01192811e-06 2.35336715e-06 -3.16490623e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 4.05894685e-05 -2.92452664e-03 7.77148753e-04] [-4.02791781e-05 2.92464423e-03 7.44673700e-04] [-4.07334949e-05 2.92451378e-03 -7.73284801e-04] [ 4.06211086e-05 -2.92442699e-03 -7.53171086e-04] [ 1.77312354e-07 -4.28599856e-06 -2.11834470e-07] [ 3.16456672e-06 1.82535146e-06 2.01251085e-07] [-3.61990875e-06 2.29344694e-06 -2.05498963e-07] [-2.83865208e-08 -3.33867079e-06 4.90911503e-07] [ 2.84461676e-06 1.70412738e-06 5.14579030e-07] [-2.73719561e-06 1.61694901e-06 4.20428116e-07] [-1.88714606e-03 -4.32813918e-03 5.14836969e-06] [-8.42289775e-04 1.82395921e-03 5.44186968e-06] [ 3.86205445e-03 -2.07895861e-03 5.05264879e-06] [ 1.88727367e-03 4.35031954e-03 -4.23581568e-06] [ 8.22722778e-04 -1.83521428e-03 -4.22530172e-06] [-3.84266550e-03 2.06795825e-03 -4.15048893e-06] [-1.30435266e-04 -4.45932673e-05 1.43195589e-04] [ 1.30466458e-04 4.46076100e-05 1.42927368e-04] [ 1.30497523e-04 4.46258404e-05 -1.43438693e-04] [-1.30474706e-04 -4.45997846e-05 -1.42490742e-04] [-2.70556118e-04 1.39435607e-04 -8.57889792e-04] [ 2.70545885e-04 -1.39438510e-04 -8.58100377e-04] [ 2.70544613e-04 -1.39434621e-04 8.57768169e-04] [-2.70536859e-04 1.39452617e-04 8.58420793e-04]] Final stress: [-7.66469992e-05 -9.98896745e-05 -5.30396788e-05 -2.93524616e-10 3.26894864e-10 4.17241229e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-1.85160054e-10 -5.82490090e-06 2.30846364e-05] [ 1.10563196e-09 5.82559081e-06 2.31396435e-05] [ 2.06400591e-10 5.82356480e-06 -2.30812731e-05] [ 3.55923846e-10 -5.82388004e-06 -2.31368162e-05] [ 1.42790055e-09 6.88700325e-09 -1.51313695e-09] [-9.68802021e-09 -5.70490037e-09 9.37767003e-10] [ 6.70385253e-09 -2.35386821e-09 -1.12068674e-09] [-5.03437117e-11 -1.75421928e-08 1.54239477e-09] [ 1.65840646e-08 9.28479560e-09 2.73925405e-09] [-1.63786316e-08 9.11392312e-09 2.53145857e-09] [ 1.13527815e-09 -2.27830765e-06 -1.21494533e-08] [ 3.26311553e-05 3.82160032e-05 -1.05948819e-08] [-3.26332333e-05 3.82185503e-05 -1.09167588e-08] [-5.23495636e-10 2.29813223e-06 8.11584666e-09] [-3.26497986e-05 -3.82267518e-05 8.52281625e-09] [ 3.26506827e-05 -3.82278573e-05 8.59004846e-09] [ 1.66459929e-10 2.61644741e-05 1.10664644e-05] [ 5.67873526e-12 -2.61643835e-05 1.10680845e-05] [ 1.66670400e-10 -2.61642274e-05 -1.10672204e-05] [-2.59686717e-11 2.61642251e-05 -1.10681044e-05] [ 1.23521082e-10 -5.83245331e-06 2.34842899e-05] [-2.36086447e-11 5.83251471e-06 2.34853237e-05] [-6.92460953e-11 5.83243601e-06 -2.34854297e-05] [ 1.56977709e-10 -5.83241409e-06 -2.34862833e-05]] Final stress: [6.39611704e-05 9.41817267e-05 5.23119341e-05 2.99745908e-12 1.02215555e-12 7.58719544e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.05434253e-09 1.97505222e-05 9.12051263e-06] [-2.31293772e-10 -1.97516571e-05 9.19619481e-06] [ 2.96110056e-09 -1.97488899e-05 -9.07246962e-06] [-1.10084880e-09 1.97482047e-05 -9.11127633e-06] [-1.94186322e-09 -4.03539593e-08 -1.29128288e-08] [ 4.52594461e-08 2.43349213e-08 -1.87021751e-08] [-4.08196341e-08 1.95244198e-08 -1.53567471e-08] [ 2.08669109e-09 5.21436148e-08 -1.46436038e-08] [-5.07078135e-08 -2.94446102e-08 -1.84136010e-08] [ 4.57421260e-08 -2.41863439e-08 -1.44537318e-08] [ 3.86138588e-09 -1.65378542e-05 -1.57984297e-08] [-2.45388076e-06 -5.85430368e-06 -1.76166757e-08] [ 2.44692568e-06 -5.84584343e-06 -1.61063296e-08] [ 4.27189117e-10 1.64722142e-05 4.34431548e-09] [ 2.50748313e-06 5.88265671e-06 3.51550623e-09] [-2.50806581e-06 5.88348673e-06 3.89989686e-09] [-3.05977438e-10 -2.21564785e-05 1.68962090e-06] [ 2.60170774e-10 2.21562410e-05 1.68979387e-06] [-2.24954000e-10 2.21557293e-05 -1.68921950e-06] [ 2.69796102e-10 -2.21559246e-05 -1.69166093e-06] [ 4.91120200e-10 6.41846389e-06 -2.27850850e-05] [-3.55613260e-11 -6.41853323e-06 -2.27843461e-05] [ 1.22063082e-10 -6.41841594e-06 2.27856914e-05] [ 3.70265485e-10 6.41836385e-06 2.27844883e-05]] Final stress: [-3.36339159e-05 -6.59373237e-05 -3.14877572e-05 -1.34114110e-12 -2.95755831e-12 1.30451936e-12] Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 15 steps. Minimization converged after 17 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 19 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-4.17224383e-04 -8.79762656e-04 3.25370323e-05] [ 4.17210337e-04 8.79768211e-04 3.57348876e-06] [ 4.17186115e-04 8.79778953e-04 2.15157297e-05] [-4.17200595e-04 -8.79770228e-04 -1.40382580e-05] [ 3.41833204e-09 -3.75622226e-06 -5.81553909e-08] [ 3.24582454e-06 1.87369303e-06 -5.51225929e-08] [-3.25394527e-06 1.88220175e-06 -5.17426322e-08] [-9.94926518e-09 3.07518181e-05 -1.06375459e-05] [-2.66209311e-05 -1.53614720e-05 -1.06291528e-05] [ 2.67078209e-05 -1.54234678e-05 -1.06172965e-05] [-4.49863705e-04 1.25876857e-04 -2.49598472e-06] [ 7.55791120e-05 -1.93497405e-04 -2.49817521e-06] [-3.80138557e-04 -5.31789219e-04 -2.50493475e-06] [ 4.49827779e-04 -8.56086776e-05 -1.31714482e-06] [-1.10474327e-04 1.73392916e-04 -1.31591520e-06] [ 4.15064389e-04 5.11625220e-04 -1.32226385e-06] [-3.27012331e-04 9.16451586e-05 1.56273434e-04] [ 3.27008554e-04 -9.16433400e-05 1.56971242e-04] [ 3.27005576e-04 -9.16411516e-05 -1.57100768e-04] [-3.27007901e-04 9.16424667e-05 -1.56554848e-04] [-3.85833949e-05 -4.98855935e-05 7.51075478e-05] [ 3.85665103e-05 4.98940568e-05 7.50350746e-05] [ 3.85454162e-05 4.99046540e-05 -7.48167351e-05] [-3.85608324e-05 -4.98967734e-05 -7.49995059e-05]] Final stress: [ 4.27447894e-05 3.86449039e-05 1.44661161e-05 1.09228050e-11 -4.46379833e-11 -9.57931874e-06] Minimization converged after 156 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 42 steps. Final forces: [[-1.48220517e-03 -2.09076107e-04 -5.24514486e-03] [ 1.49007066e-03 1.80174491e-04 -5.71884209e-03] [ 1.45972041e-03 2.47478154e-04 5.22182888e-03] [-1.46959842e-03 -2.14426741e-04 5.59412830e-03] [-4.45535295e-06 -1.09455037e-04 8.32615943e-06] [ 5.78046713e-05 5.83945731e-05 4.48026790e-06] [-6.31826771e-05 5.63920673e-05 -1.07621618e-05] [-2.97913098e-06 4.69806248e-07 6.75956809e-06] [ 1.51247996e-05 -2.76148394e-07 -2.72547460e-06] [-1.15664866e-06 -1.21539606e-05 -1.93836368e-05] [-1.17497382e-02 3.88553153e-03 1.43784356e-04] [-3.51172176e-03 -1.02065940e-02 9.32599011e-05] [ 4.72783069e-03 1.43746961e-02 6.40959722e-05] [ 1.17453351e-02 -3.85528245e-03 -4.81997455e-05] [ 3.48618966e-03 1.01952423e-02 -4.98562640e-05] [-4.69578428e-03 -1.43941633e-02 -5.82512674e-05] [ 5.08774086e-04 -3.15346386e-03 -2.34812346e-03] [-5.08194128e-04 3.15220467e-03 -2.35939153e-03] [-5.07963152e-04 3.15504446e-03 2.35404859e-03] [ 5.05374886e-04 -3.15120386e-03 2.36294979e-03] [-9.60944131e-04 7.89333823e-04 1.67134727e-03] [ 9.61196201e-04 -7.88820203e-04 1.66947204e-03] [ 9.59207691e-04 -7.85873337e-04 -1.67228627e-03] [-9.58705791e-04 7.85827052e-04 -1.66151434e-03]] Final stress: [-1.96824943e-04 -4.79715859e-04 -1.97325518e-04 -1.70191756e-07 8.36315045e-08 -1.74023484e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 22 steps. Final forces: [[-3.76375119e-04 -8.49664593e-04 -7.40537316e-06] [ 3.76376234e-04 8.49665531e-04 -7.42867264e-06] [ 3.76375114e-04 8.49664456e-04 7.40650388e-06] [-3.76374627e-04 -8.49664384e-04 7.42366201e-06] [-1.03289969e-09 -5.01642472e-09 -1.46317608e-09] [ 5.00732357e-09 2.64837478e-09 3.82877785e-10] [-5.05057696e-09 1.51385626e-09 -1.27592778e-09] [-1.13078587e-11 -3.80588006e-09 5.15992804e-10] [ 3.36585926e-09 1.85253535e-09 2.48193466e-10] [-3.66875952e-09 1.95632172e-09 6.99277268e-10] [-6.48186065e-05 -4.15060434e-04 4.06192936e-09] [-1.74593838e-04 -3.09340306e-04 5.26463919e-09] [-7.28958595e-05 -2.43135906e-04 4.28262323e-09] [ 6.48180904e-05 4.15078489e-04 -2.99013159e-09] [ 1.74579228e-04 3.09331554e-04 -2.95940122e-09] [ 7.29108341e-05 2.43126551e-04 -3.24471366e-09] [ 1.53814804e-04 -1.07065024e-04 8.45419660e-06] [-1.53814925e-04 1.07064937e-04 8.45396411e-06] [-1.53815028e-04 1.07064832e-04 -8.45433247e-06] [ 1.53814856e-04 -1.07064999e-04 -8.45354856e-06] [ 1.64083782e-06 -7.87659579e-06 -2.83159982e-04] [-1.64071276e-06 7.87668373e-06 -2.83160049e-04] [-1.64082294e-06 7.87656744e-06 2.83159771e-04] [ 1.64093191e-06 -7.87650871e-06 2.83160339e-04]] Final stress: [-2.24373304e-05 -2.47795631e-05 -6.64981290e-06 2.62075032e-12 1.77720483e-12 -7.64647182e-06] Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 5.19845493e-03 -2.70768374e-02 1.42922218e-01] [-4.55823089e-03 2.54345470e-02 4.21297157e-02] [-5.53388374e-03 2.45333424e-02 4.82532221e-02] [ 6.00446366e-03 -2.41979211e-02 9.57901768e-02] [-3.96812531e-04 -1.26133031e-01 -3.82326761e-02] [ 1.06997616e-01 6.25788747e-02 -3.54255876e-02] [-1.08122585e-01 6.27523225e-02 -3.41365833e-02] [ 1.43819516e-03 1.59480739e-01 -5.05906207e-02] [-1.34043311e-01 -7.97214639e-02 -4.65226748e-02] [ 1.33400902e-01 -7.76385965e-02 -4.34317530e-02] [-4.39706890e-02 4.23699730e-02 -1.01831577e-04] [ 2.29008330e-02 -5.05607096e-02 4.99871087e-04] [ 4.55231160e-02 8.40960347e-02 -4.09361812e-04] [ 4.43878107e-02 -2.18854702e-02 -2.77225207e-02] [-4.06423167e-02 3.99643137e-02 -2.57727443e-02] [-2.86922194e-02 -9.36310865e-02 -2.69825992e-02] [-9.02816345e-03 4.55703524e-03 -2.14762264e-03] [ 9.28985149e-03 -4.60258091e-03 -3.66510569e-03] [ 8.73546751e-03 -4.52857556e-03 2.22075597e-04] [-8.77295905e-03 4.34272078e-03 2.23621161e-03] [-1.55504427e-02 -4.89870967e-03 -3.16528406e-03] [ 1.56407864e-02 4.86457330e-03 -4.30397603e-03] [ 1.42863741e-02 4.74561205e-03 4.93159421e-03] [-1.44922577e-02 -4.84510596e-03 5.62585620e-03]] Final stress: [ 9.87318199e-04 -1.51816283e-03 -4.32139537e-04 1.89079470e-06 6.17569540e-06 -1.76158968e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 1.14211095e-03 -8.69910894e-04 3.32070019e-03] [-6.34548236e-04 8.82667156e-04 1.39019280e-02] [-1.68228150e-03 7.82683387e-04 1.06744126e-02] [ 2.23553323e-03 -8.45586003e-04 3.93783300e-03] [ 1.28929728e-03 -8.36651192e-03 -3.21407560e-03] [ 5.72026681e-03 2.60393843e-03 -2.07931254e-03] [-8.43346203e-03 5.67281994e-03 -4.14431835e-03] [-7.60196415e-04 1.80320760e-02 -4.88364522e-03] [-1.47591028e-02 -8.12885467e-03 -4.15094582e-03] [ 1.61830482e-02 -9.83754704e-03 -5.31963442e-03] [ 1.39618822e-02 -5.39476874e-03 -2.93355575e-03] [ 3.37624230e-03 2.10898404e-02 -2.70423109e-03] [-1.66319804e-02 -2.38301373e-03 -3.03237973e-03] [-1.34158319e-02 -9.62950241e-03 2.26794670e-04] [ 9.29115067e-03 -1.41888255e-02 4.25141850e-04] [ 2.79899320e-03 1.05822490e-02 5.33459993e-05] [ 1.34806472e-03 3.41519425e-04 -2.97768486e-03] [-1.30985691e-03 -3.32787796e-04 -3.00566257e-03] [-1.05427193e-03 -3.08562514e-04 3.03252911e-03] [ 1.06851361e-03 3.24223504e-04 2.58580186e-03] [ 1.51267939e-03 1.37673897e-03 -2.98814313e-03] [-1.36691590e-03 -1.39173300e-03 -3.08906649e-03] [-1.33465132e-03 -1.42296830e-03 3.36157499e-03] [ 1.45531682e-03 1.41181628e-03 3.00259329e-03]] Final stress: [-1.34129828e-04 -6.31450303e-04 -5.64650972e-05 7.63207482e-08 5.35122250e-07 1.19421503e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.52453069e-05 -5.88831918e-05 2.22930706e-05] [-1.52442212e-05 5.88827778e-05 2.21969485e-05] [-1.52456310e-05 5.88834645e-05 -1.76201566e-05] [ 1.52468227e-05 -5.88835208e-05 -1.72002950e-05] [ 2.27171759e-09 -5.65746796e-06 -1.58358194e-06] [ 4.89868552e-06 2.82637201e-06 -1.58335373e-06] [-4.90364396e-06 2.83181906e-06 -1.58544169e-06] [ 2.42433410e-10 2.03971238e-06 -7.91618732e-07] [-1.76706851e-06 -1.02013636e-06 -7.92051651e-07] [ 1.76706202e-06 -1.01984233e-06 -7.91805892e-07] [-2.91936842e-05 2.37938801e-05 -3.74715310e-07] [-3.57839200e-07 -2.56867249e-05 -3.74755291e-07] [-2.03825693e-05 -4.74468153e-05 -3.75380063e-07] [ 2.91931942e-05 -1.96734083e-05 -4.67358729e-07] [-3.21031057e-06 2.36268141e-05 -4.67018816e-07] [ 2.39505241e-05 4.53864153e-05 -4.67735723e-07] [-1.89582575e-05 -3.01224705e-06 -7.40209433e-06] [ 1.89583325e-05 3.01218875e-06 -7.34439716e-06] [ 1.89583575e-05 3.01209295e-06 7.29364753e-06] [-1.89582879e-05 -3.01211955e-06 7.36322048e-06] [ 3.27493535e-06 -3.27039693e-06 6.93039643e-06] [-3.27457518e-06 3.27035930e-06 6.99290551e-06] [-3.27502533e-06 3.27038882e-06 -6.95981792e-06] [ 3.27537889e-06 -3.27041373e-06 -6.88861046e-06]] Final stress: [-6.93843232e-06 -6.65097588e-06 -2.90401162e-05 -1.01068219e-12 1.69736810e-14 1.57706796e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[ 3.49608249e-04 -8.71052672e-04 -1.21910021e-03] [-5.11814578e-05 9.90660617e-04 3.48401472e-03] [ 1.00984315e-03 1.01628897e-03 4.37331708e-03] [-6.88963511e-04 -9.03240657e-04 -4.01271807e-03] [-3.24901670e-04 -6.18869919e-03 -1.32027108e-03] [ 5.65896707e-03 3.48747771e-03 -1.52062392e-03] [-4.85985561e-03 2.65032566e-03 -9.37694961e-04] [ 1.50267740e-03 -6.86260180e-03 1.17060578e-03] [ 4.05158969e-03 1.56991193e-03 -1.26346411e-04] [-7.23167481e-03 5.14999007e-03 2.18117740e-03] [ 6.65339159e-03 1.14373583e-02 -1.47462093e-03] [-1.25904363e-02 4.29417218e-03 -1.68256603e-03] [ 4.41831428e-03 -1.18941259e-02 -1.31365930e-03] [-7.37410629e-03 7.45553243e-03 8.84396791e-04] [-3.55385830e-03 -1.30475819e-02 6.90938221e-04] [ 1.29206897e-02 1.62221181e-03 1.03753490e-03] [-8.57424435e-05 -5.28727040e-04 -6.18674556e-04] [ 2.56818798e-04 5.35892943e-04 -1.55928743e-04] [ 2.06189762e-05 5.22358902e-04 2.61344920e-04] [ 1.33843893e-04 -5.09945066e-04 4.13798284e-04] [-7.99748325e-04 1.16900208e-03 3.86202771e-05] [ 7.00513064e-04 -1.13368422e-03 4.27764906e-04] [ 7.32479171e-04 -1.11151963e-03 -3.87266529e-04] [-8.48886291e-04 1.14999457e-03 -1.94042533e-04]] Final stress: [-1.09550875e-04 -3.71630114e-04 -2.24507775e-04 -1.75289207e-08 3.83843825e-07 4.17937199e-05] Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[-2.34885011e-05 -7.02244386e-06 1.30770082e-04] [ 2.88568445e-05 2.10712434e-05 -1.18246438e-04] [ 2.34789612e-05 7.01623902e-06 -1.20312051e-04] [-2.88581621e-05 -2.10786667e-05 1.24008650e-04] [-1.51773979e-09 -4.04251044e-06 -1.30619146e-06] [ 3.51815975e-06 2.02570973e-06 -1.31529461e-06] [-3.51642871e-06 2.02354138e-06 -1.31237438e-06] [-6.27853874e-09 8.71990910e-06 -2.65690212e-06] [-7.53136792e-06 -4.34809962e-06 -2.64871937e-06] [ 7.54856876e-06 -4.36630110e-06 -2.65808810e-06] [ 1.66848456e-05 3.67526215e-06 5.66461130e-05] [ 5.78573611e-05 -2.50837780e-05 3.97989962e-05] [ 4.70456596e-05 1.11641291e-05 3.70712003e-05] [-1.66865988e-05 -4.09795180e-06 -5.80738291e-05] [-5.74730366e-05 2.53003627e-05 -4.12262868e-05] [-4.74246420e-05 -1.09525922e-05 -3.85011044e-05] [ 1.01890442e-04 2.19584060e-05 7.04983833e-05] [-1.04608343e-04 4.69609554e-05 6.44297486e-05] [-1.01891123e-04 -2.19597230e-05 -7.05686418e-05] [ 1.04607740e-04 -4.69617750e-05 -6.45136036e-05] [ 6.18204366e-05 5.65609733e-06 -3.80632650e-05] [-6.07536687e-05 -4.67164017e-07 -4.21956260e-05] [-6.18237694e-05 -5.65712523e-06 3.81815432e-05] [ 6.07544172e-05 4.66275738e-07 4.21936993e-05]] Final stress: [ 1.50843791e-05 1.50701675e-05 7.99222168e-06 -1.73714909e-05 2.96709990e-07 1.38052161e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.24597827e-05 -4.86726132e-05 9.22272492e-05] [-3.28203004e-05 6.09831947e-05 -8.71388365e-05] [-1.24557249e-05 4.86644165e-05 -8.36917135e-05] [ 3.28185149e-05 -6.09779717e-05 9.70504848e-05] [-2.99680489e-10 -7.21883623e-06 -2.33967492e-06] [ 6.24444793e-06 3.60696690e-06 -2.33286208e-06] [-6.24099041e-06 3.60669719e-06 -2.33335322e-06] [ 1.85098445e-09 6.27500126e-06 -2.03376950e-06] [-5.41473489e-06 -3.13708967e-06 -2.02678124e-06] [ 5.40773887e-06 -3.12881504e-06 -2.02523822e-06] [-1.49874670e-05 2.45608676e-05 4.39363156e-05] [-1.21525767e-05 -1.16746647e-05 1.47282607e-05] [-9.08568371e-05 -5.62152217e-05 3.97520334e-05] [ 1.49891067e-05 -2.49383888e-05 -4.56784610e-05] [ 1.24833844e-05 1.18614706e-05 -1.64683999e-05] [ 9.05232474e-05 5.64065644e-05 -4.14906100e-05] [-1.06047022e-04 2.14136560e-05 7.15449869e-05] [ 1.05852224e-04 4.92470870e-05 6.68885233e-05] [ 1.06047902e-04 -2.14128282e-05 -7.16421858e-05] [-1.05852374e-04 -4.92491832e-05 -6.69973547e-05] [-6.32190739e-05 -1.84689528e-06 -3.99307457e-05] [ 6.05465517e-05 -6.39504689e-08 -4.28175050e-05] [ 6.32212479e-05 1.84636760e-06 3.99567751e-05] [-6.05485991e-05 6.41683546e-08 4.28628622e-05]] Final stress: [ 1.48532532e-05 1.52060478e-05 7.92376547e-06 -1.73493673e-05 -5.27670681e-07 -1.34014197e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.62811001e-06 7.45997980e-05 -1.73299700e-04] [ 4.66402275e-05 -8.72872116e-05 1.76163586e-04] [-1.63142568e-06 -7.45911461e-05 1.82811685e-04] [-4.66396680e-05 8.72793924e-05 -1.63986930e-04] [-1.78289153e-09 -8.79605537e-06 -2.83945350e-06] [ 7.63436552e-06 4.40234821e-06 -2.85049636e-06] [-7.63522815e-06 4.40089667e-06 -2.84830650e-06] [-1.63172140e-09 7.26770222e-06 -2.30995911e-06] [-6.31191462e-06 -3.63505458e-06 -2.31765062e-06] [ 6.31841964e-06 -3.64253116e-06 -2.31908132e-06] [-2.20418484e-06 -6.20447963e-06 -7.57542357e-05] [ 3.17766081e-05 6.38021046e-06 -4.74233382e-05] [ 6.93895723e-05 6.94004064e-05 -7.36875991e-05] [ 2.20227332e-06 5.12474778e-06 7.37342460e-05] [-3.08373830e-05 -5.83818368e-06 4.54003310e-05] [-7.03255418e-05 -6.88608801e-05 7.16632153e-05] [ 9.29568734e-05 -4.49616899e-05 5.88187888e-05] [-9.35388513e-05 -2.15062748e-05 6.75891455e-05] [-9.29582991e-05 4.49599061e-05 -5.89205240e-05] [ 9.35393524e-05 2.15081114e-05 -6.77230738e-05] [ 5.72457174e-05 9.01626682e-06 -4.05405942e-05] [-6.20503664e-05 -6.72743109e-06 -3.48914168e-05] [-5.72484302e-05 -9.01590422e-06 4.05781783e-05] [ 6.20531880e-05 6.72705568e-06 3.49531828e-05]] Final stress: [ 1.50373584e-05 1.45670893e-05 8.04506082e-06 1.72509469e-05 -6.64665260e-07 1.26089900e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 2.68866217e-07 9.05893859e-05 -2.35604076e-04] [-8.08869078e-05 -1.11339840e-04 2.16949303e-04] [-2.67768170e-07 -9.05912654e-05 2.40434589e-04] [ 8.08835134e-05 1.11334147e-04 -2.05182103e-04] [ 2.48570001e-09 -7.97420194e-06 -2.63708869e-06] [ 6.92146830e-06 3.98806158e-06 -2.64602520e-06] [-6.91886965e-06 3.99135129e-06 -2.64639662e-06] [ 3.60147241e-09 3.78668016e-06 -1.22921945e-06] [-3.27848529e-06 -1.89607507e-06 -1.22756081e-06] [ 3.27194175e-06 -1.88911577e-06 -1.22803587e-06] [-1.07358491e-05 1.06524400e-05 -1.00089351e-04] [-6.05921664e-05 9.08062181e-05 -1.09198878e-04] [-8.96703666e-05 7.65160251e-06 -4.20192955e-05] [ 1.07354739e-05 -1.33331938e-05 9.84797842e-05] [ 6.29207150e-05 -8.94646288e-05 1.07587055e-04] [ 8.73431596e-05 -6.30901261e-06 4.04091615e-05] [-1.50344671e-04 -8.17518903e-05 1.04857576e-04] [ 1.43808045e-04 -1.84489301e-05 1.16182951e-04] [ 1.50346356e-04 8.17503031e-05 -1.04914790e-04] [-1.43808165e-04 1.84486646e-05 -1.16322413e-04] [-8.20342014e-05 2.53141263e-06 -8.85809240e-05] [ 8.36175890e-05 -1.97539974e-05 -8.11287926e-05] [ 8.20357197e-05 -2.53165279e-06 8.85655425e-05] [-8.36214844e-05 1.97535366e-05 8.11889868e-05]] Final stress: [ 1.51055550e-05 1.39447381e-05 6.44386109e-06 1.82315989e-05 5.05780965e-07 -1.05777304e-05] Minimization converged after 13 steps. Minimization converged after 12 steps. Minimization converged after 195 steps. Minimization converged after 184 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-6.18990659e-05 2.71920141e-05 -2.83548039e-05] [-4.82629268e-07 4.14568703e-06 -1.21627873e-05] [-5.05906936e-05 -6.70063467e-05 3.84161833e-05] [ 3.87467615e-05 4.51824894e-05 1.49813805e-05] [ 3.54586868e-05 -1.15682480e-05 9.16650446e-06] [-4.98685747e-05 -5.78415194e-05 1.60388162e-05] [ 3.03868072e-05 3.27960165e-05 -2.12057430e-05] [ 2.58364349e-05 -4.06333243e-05 -3.45559280e-05] [-8.82669999e-06 -2.92715914e-06 1.57810574e-05] [ 1.56946089e-06 -9.47863566e-06 3.49816467e-05] [-3.52944265e-05 5.43267970e-05 -5.33541123e-06] [ 2.19744279e-05 -1.12200066e-05 2.43424110e-05] [ 1.56488805e-05 3.10593846e-05 1.74474432e-05] [-3.65129745e-06 -3.65047261e-05 3.02637808e-05] [-1.70928738e-05 6.41915278e-05 3.31814381e-05] [-7.85290621e-05 -4.53238283e-06 4.83585552e-05] [-8.10748688e-06 -2.56214271e-06 -1.27554641e-05] [ 1.10634542e-05 -1.20014116e-05 -3.15687771e-05] [-5.87228879e-06 5.55112044e-05 -6.84015812e-06] [ 2.35406562e-05 -6.82262408e-06 3.39914032e-06] [ 4.04166267e-05 -9.75480527e-06 1.23184166e-06] [ 3.92629973e-05 -3.09487504e-05 -4.73356021e-05] [ 1.45137380e-05 6.08682501e-07 -5.98663822e-05] [ 2.17961670e-05 -1.12117206e-05 -2.76091418e-05]] Final stress: [ 3.35845357e-02 3.24772623e-02 1.35159416e-01 6.36837501e-08 -1.01384122e-03 2.92331166e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 4.56968959e-06 3.55525948e-06 -2.43502165e-06] [-8.97236081e-06 -1.46152313e-05 -2.40369794e-05] [ 1.86844759e-05 -2.01296420e-05 -1.61816985e-05] [ 2.62423507e-05 4.38561692e-07 -2.43053792e-05] [ 2.17317610e-05 5.09561265e-05 -2.01353394e-05] [-2.66386531e-05 -1.98824440e-05 3.47307837e-05] [ 2.92403368e-05 4.46278672e-06 5.40184386e-06] [ 2.53894399e-05 -3.64715862e-05 1.79572112e-05] [-2.15438411e-05 -1.46916860e-05 6.05246919e-06] [-5.94548603e-05 4.39300759e-05 -2.50990251e-06] [ 4.12211197e-05 3.01630287e-05 -1.22915521e-05] [-1.20604142e-05 -9.99859531e-06 1.21022389e-05] [-3.18542847e-05 2.08332499e-06 3.43721548e-05] [-4.65030191e-05 5.05450955e-06 -1.57564621e-05] [ 3.26266400e-05 5.98508057e-06 9.23529052e-07] [-1.25968142e-05 -2.44033076e-05 1.39550792e-05] [ 1.61695318e-05 4.51434892e-06 -1.41609047e-05] [ 8.88774747e-06 -2.95402269e-05 -1.84096882e-05] [ 3.38429234e-06 -2.78144036e-06 -1.02382816e-05] [ 1.89042285e-05 -2.91569153e-06 -1.98408904e-05] [-2.24968041e-05 1.44791497e-05 9.49361241e-06] [ 6.36602425e-06 2.07290666e-05 6.18848083e-06] [-7.90836525e-06 9.45417593e-07 -2.61327127e-06] [-3.38822096e-06 -1.18668856e-05 4.17379678e-05]] Final stress: [ 3.32804253e-02 3.23505539e-02 1.34819626e-01 8.86151512e-07 -1.30934896e-05 -8.35889196e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 8.03080914e-05 3.92474725e-05 1.20855537e-03] [-3.64050037e-05 -5.95480241e-05 -2.79370036e-03] [ 2.06088144e-05 -5.75404807e-05 -2.82020422e-03] [-1.09726801e-05 6.63582798e-05 1.34880166e-03] [-8.81092446e-07 -3.44283513e-04 1.37116336e-04] [ 3.33322746e-04 1.80509402e-04 1.17913474e-04] [-3.10539198e-04 1.65919072e-04 1.55207136e-04] [ 3.60013732e-05 2.64533468e-04 1.61281013e-04] [-2.76935878e-04 -1.78311508e-04 1.24144653e-04] [ 1.70200332e-04 -7.48499422e-05 2.25967086e-04] [-1.81283289e-03 -3.19644353e-04 1.04695051e-03] [ 8.08500600e-04 -1.64348251e-03 1.03352204e-03] [ 6.55302942e-04 9.25034857e-04 1.06601170e-03] [ 1.82789108e-03 2.53576346e-04 -4.41866957e-04] [-7.66108575e-04 1.65885784e-03 -4.53542015e-04] [-7.31785856e-04 -8.72527518e-04 -3.80010515e-04] [-2.51753541e-05 3.98456647e-04 3.31948771e-04] [ 3.65111794e-05 -3.98769623e-04 2.34186808e-04] [ 2.20415183e-05 -3.98527594e-04 -2.70047129e-04] [-2.59116955e-05 3.96575701e-04 -1.74447583e-04] [ 5.11112211e-05 4.82369726e-04 4.54978112e-04] [-4.17013979e-05 -4.81098155e-04 3.94798336e-04] [-4.95983690e-05 -4.86267665e-04 -3.84756658e-04] [ 4.70480984e-05 4.83412078e-04 -3.22807572e-04]] Final stress: [-2.08178771e-04 -2.46235748e-04 -2.15116490e-04 -6.71948976e-08 3.81096678e-07 -6.42363995e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 4.05086221e-05 -7.94960776e-04 -8.32951749e-05] [-4.05080666e-05 7.94960776e-04 -8.33903939e-05] [-4.05084962e-05 7.94960579e-04 8.33702927e-05] [ 4.05080356e-05 -7.94960926e-04 8.33922386e-05] [-5.56927527e-11 -1.96789832e-08 -3.83340887e-09] [ 1.66671645e-08 9.88371919e-09 -3.83818341e-09] [-1.66102601e-08 9.81571457e-09 -3.92792787e-09] [ 4.05251366e-11 5.13367791e-08 -1.63739338e-08] [-4.49044040e-08 -2.56443607e-08 -1.61087533e-08] [ 4.47561344e-08 -2.55276177e-08 -1.61237677e-08] [ 2.12704379e-04 -1.96724971e-04 7.48878973e-09] [ 5.38251148e-04 -2.84376213e-04 7.84149942e-09] [-6.20384577e-05 -3.07342891e-04 7.39315140e-09] [-2.12704337e-04 1.96768436e-04 -1.32656348e-08] [-5.38289153e-04 2.84354456e-04 -1.38001680e-08] [ 6.20763868e-05 3.07321253e-04 -1.31607392e-08] [ 1.79561341e-04 -2.41051590e-04 5.32686335e-04] [-1.79561314e-04 2.41051673e-04 5.32685661e-04] [-1.79561347e-04 2.41051643e-04 -5.32687236e-04] [ 1.79561320e-04 -2.41051591e-04 -5.32685221e-04] [-7.32428103e-06 -3.91061793e-05 4.47294977e-04] [ 7.32430431e-06 3.91061601e-05 4.47293829e-04] [ 7.32434631e-06 3.91061408e-05 -4.47294205e-04] [-7.32432356e-06 -3.91061637e-05 -4.47293394e-04]] Final stress: [ 2.25503354e-05 2.29052229e-05 -3.03373020e-05 1.09375436e-12 1.94093252e-12 -6.75155939e-06] Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 17 steps. Minimization converged after 19 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 8 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 11 steps. Minimization converged after 16 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 17 steps. Minimization converged after 17 steps. Minimization converged after 18 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.26622309e-05 -1.46517491e-03 -5.70935707e-05] [-1.26613736e-05 1.46517815e-03 -5.54994888e-05] [-1.26610192e-05 1.46517709e-03 5.60606855e-05] [ 1.26614065e-05 -1.46517805e-03 5.62310399e-05] [-2.75494216e-10 -4.61430034e-07 -1.55960549e-07] [ 3.96427893e-07 2.30480044e-07 -1.55466504e-07] [-3.96530683e-07 2.30282022e-07 -1.54662620e-07] [ 7.72102348e-10 -7.86667967e-07 2.42516010e-07] [ 6.77989795e-07 3.91415735e-07 2.40533546e-07] [-6.80783170e-07 3.93976771e-07 2.41125109e-07] [-1.28761554e-04 1.96179457e-04 -1.20122779e-07] [ 3.98417870e-04 -6.91084601e-04 -1.19070265e-07] [-5.08155728e-04 -7.74453276e-04 -1.19179170e-07] [ 1.28761639e-04 -1.96653422e-04 1.38068789e-07] [-3.98009514e-04 6.91320944e-04 1.35154370e-07] [ 5.07747112e-04 7.74689922e-04 1.35472615e-07] [-1.26367335e-04 -1.80076508e-04 2.90102311e-04] [ 1.26367186e-04 1.80076920e-04 2.90111432e-04] [ 1.26367242e-04 1.80076770e-04 -2.90094862e-04] [-1.26367114e-04 -1.80076736e-04 -2.90118622e-04] [ 3.18360613e-07 -7.26560335e-05 9.52415113e-05] [-3.17803224e-07 7.26562027e-05 9.52664681e-05] [-3.17473312e-07 7.26561987e-05 -9.52582185e-05] [ 3.18265639e-07 -7.26561699e-05 -9.52570940e-05]] Final stress: [ 1.43406921e-05 1.91204001e-05 -9.60564017e-06 1.12551197e-11 -7.02631989e-12 1.44721699e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-8.14285739e-06 -5.71246853e-05 -3.56761397e-06] [ 8.14288086e-06 5.71249335e-05 -2.94255867e-06] [ 8.14274569e-06 5.71247200e-05 2.90526414e-06] [-8.14281641e-06 -5.71246499e-05 3.17829963e-06] [-3.38655776e-11 8.66674149e-09 -1.71186456e-08] [-7.39813724e-09 -4.35633919e-09 -1.69431170e-08] [ 7.42275064e-09 -4.40880682e-09 -1.69913895e-08] [-6.29710209e-11 -3.74816348e-07 1.28320824e-07] [ 3.24191324e-07 1.87422911e-07 1.28144957e-07] [-3.24000554e-07 1.87225552e-07 1.28155676e-07] [ 2.90733351e-05 -7.91035604e-08 -1.56634873e-08] [ 3.49879680e-05 -3.39567710e-05 -1.53409561e-08] [-9.08587457e-07 -1.98991389e-05 -1.54746977e-08] [-2.90735059e-05 -4.92500325e-07 4.74940911e-08] [-3.44930070e-05 3.42426771e-05 4.75905703e-08] [ 4.13811405e-07 2.01847261e-05 4.75776505e-08] [ 2.97685072e-05 -4.43850938e-06 2.63902184e-05] [-2.97685141e-05 4.43852823e-06 2.63854573e-05] [-2.97685353e-05 4.43850048e-06 -2.63800985e-05] [ 2.97685034e-05 -4.43849738e-06 -2.63929585e-05] [-9.71938969e-06 -2.92202056e-06 7.46823143e-05] [ 9.71937430e-06 2.92204190e-06 7.46868234e-05] [ 9.71932582e-06 2.92203220e-06 -7.46867372e-05] [-9.71935705e-06 -2.92201681e-06 -7.46881618e-05]] Final stress: [ 1.58663084e-05 1.61713480e-05 7.72055690e-06 5.00598922e-13 6.50271544e-13 -1.87587430e-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]: [[ 1.15874 0.65726 -0.1683 0. 0. 0. ] [ 0.65726 1.13364 1.27308 -0. 0. 0.00182] [-0.1683 1.27308 1.11943 -0. 0. 0.01818] [ 0. -0. -0. -0.34021 -0. -0.00001] [ 0. 0. 0. -0. -0.42717 -0. ] [ 0. 0.00182 0.01818 -0.00001 -0. 37.33581]] 95%% Error estimate [ASE units]: [[ 0.22256 0.34481 0.51815 0.00002 0.00001 1.7755 ] [ 0.34481 0.09648 0.49182 0.02587 0.02032 0.62313] [ 0.51815 0.49182 0. 0. 0. 0.29855] [ 0.00002 0.02587 0. 0.01405 0.00002 0.00199] [ 0.00001 0.02032 0. 0.00002 0.0509 0. ] [ 1.7755 0.62313 0.29855 0.00199 0. 788.31192]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 394.155961 is too big compared to maximum elastic constant component 37.335808 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 37.085066 WARNING: Maximum deviation from material symmetry according to space group 194 is too big compared to maximum elastic constant component 37.335808 [ASE units] and requested fractional tolerance 0.010000. 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 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 1.06913256e-10 1.86200302e-05 -2.43599966e-06] [ 1.23045609e-09 -1.86191480e-05 -2.29204710e-06] [-2.09570275e-09 -1.86196173e-05 2.43858264e-06] [-3.19902466e-10 1.86206221e-05 2.29560355e-06] [-5.89934077e-11 -6.23145296e-09 -1.10612253e-09] [ 3.33159565e-09 2.72849770e-09 5.62605518e-11] [-4.03506739e-09 3.01049879e-09 -1.09648612e-09] [-1.75047132e-11 2.02612720e-08 -4.32713820e-09] [-1.74674529e-08 -9.75104952e-09 -3.38043127e-09] [ 1.84434664e-08 -1.03465232e-08 -4.82333641e-09] [-1.76963560e-09 -2.19010499e-05 -2.49028641e-08] [ 1.88695595e-06 -2.21749724e-05 -2.30670880e-08] [-1.88402025e-06 -2.21787018e-05 -2.61677895e-08] [-1.35105815e-11 2.18712332e-05 2.66861358e-08] [-1.86777794e-06 2.21905157e-05 2.66145403e-08] [ 1.86790392e-06 2.21905183e-05 2.75950750e-08] [ 1.22905519e-10 -5.58596191e-05 2.90722990e-06] [ 3.96920274e-11 5.58597250e-05 2.91013610e-06] [-5.49040258e-11 5.58598237e-05 -2.90647865e-06] [-1.13643650e-10 -5.58596877e-05 -2.91024964e-06] [-2.09469275e-10 1.03213094e-05 -1.64204999e-05] [ 8.37504172e-11 -1.03209906e-05 -1.64183582e-05] [-8.43993151e-11 -1.03209946e-05 1.64213299e-05] [-1.80263859e-10 1.03213326e-05 1.64186703e-05]] Final stress: [ 1.24560187e-04 8.38241276e-05 7.05208876e-05 -8.31626432e-13 1.07839088e-11 -1.14482861e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-2.30849911e-09 -6.35676078e-05 6.16995163e-05] [ 5.68031791e-09 6.35672329e-05 6.18875807e-05] [-2.63662599e-09 6.35692297e-05 -6.16406520e-05] [ 1.68037576e-09 -6.35689611e-05 -6.18923838e-05] [ 4.05637953e-09 2.34327154e-08 5.04214204e-09] [-2.33756082e-08 -1.63297661e-08 7.66157018e-09] [ 1.28084745e-08 -5.54717322e-09 -1.41322870e-09] [ 1.49182788e-09 4.64849659e-08 -1.35710774e-08] [-4.49315701e-08 -2.51636193e-08 -1.47941064e-08] [ 4.46513733e-08 -2.33502131e-08 -1.69732249e-08] [ 7.59350360e-10 3.69457681e-05 -4.21246771e-08] [-6.50686639e-05 2.28416143e-05 -3.93993323e-08] [ 6.50669128e-05 2.28434211e-05 -4.62002155e-08] [-4.61612931e-09 -3.69503700e-05 3.64500637e-08] [ 6.50769074e-05 -2.28350567e-05 3.74077492e-08] [-6.50690889e-05 -2.28449259e-05 3.53140861e-08] [ 7.25541766e-10 4.67949188e-05 -3.67590456e-06] [ 1.24761423e-10 -4.67948007e-05 -3.67082885e-06] [ 5.86151405e-10 -4.67950447e-05 3.67545301e-06] [-1.15910531e-10 4.67951914e-05 3.67036711e-06] [ 2.98565062e-11 2.31539131e-06 -2.26189426e-05] [-2.81969790e-10 -2.31546016e-06 -2.26163652e-05] [-6.41757117e-10 -2.31531959e-06 2.26197869e-05] [ 2.46299148e-10 2.31525229e-06 2.26149733e-05]] Final stress: [-9.57688894e-05 -5.67772524e-05 -4.91997283e-05 -1.21013622e-12 1.24034836e-11 2.41509810e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-4.70150002e-10 -1.03083019e-05 2.69517964e-06] [-7.17434228e-10 1.03074796e-05 2.72148697e-06] [-8.11219172e-10 1.03076230e-05 -2.63255778e-06] [ 1.31841094e-10 -1.03077790e-05 -2.70654568e-06] [-4.33501977e-11 7.23188115e-09 -5.45572809e-10] [-4.57223066e-09 -3.21440788e-09 -1.40214032e-09] [ 4.78686246e-09 -3.38382811e-09 -1.15606216e-09] [-6.04383545e-10 3.94390425e-08 -1.52564428e-08] [-3.02712285e-08 -1.82864954e-08 -1.31960671e-08] [ 3.18542361e-08 -1.99323236e-08 -1.45353851e-08] [-1.63415503e-09 8.26382798e-06 -1.35088029e-08] [-5.55614960e-06 1.72154325e-05 -1.39550739e-08] [ 5.55910945e-06 1.72118272e-05 -1.37437734e-08] [ 2.01590467e-10 -8.26985709e-06 4.00250894e-09] [ 5.56006256e-06 -1.72111375e-05 4.45610379e-09] [-5.56033737e-06 -1.72107289e-05 4.11381603e-09] [-1.89137594e-12 2.12626403e-05 2.80351268e-06] [-8.69332939e-11 -2.12628799e-05 2.80455681e-06] [ 3.66989772e-12 -2.12627882e-05 -2.80416395e-06] [-4.75106898e-11 2.12626046e-05 -2.80542064e-06] [-2.21261842e-10 -1.09217855e-05 1.11385342e-05] [ 1.10986473e-11 1.09218660e-05 1.11388991e-05] [-6.63385620e-12 1.09218656e-05 -1.11387113e-05] [-1.85951532e-10 -1.09217628e-05 -1.11400432e-05]] Final stress: [ 8.13897258e-05 1.28339366e-04 7.01499739e-05 -1.86014801e-12 -1.46693316e-12 -8.81399969e-13] Minimization converged after 28 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.25295509e-05 -3.67615270e-06 4.70640904e-06] [ 1.36299662e-07 1.05131613e-06 -4.95642457e-06] [-8.93806226e-06 -3.71123713e-06 1.72124522e-06] [ 5.17447880e-06 1.13212130e-06 2.49770176e-07] [-2.27166555e-06 -1.73684114e-06 -4.08208927e-06] [-2.40797164e-06 5.05082322e-06 1.17656175e-05] [-9.29009335e-06 -5.23091695e-07 -1.23982465e-05] [-2.63686767e-06 1.90932805e-06 -4.83876350e-07] [ 2.73451959e-06 -2.38341600e-06 -6.82819999e-06] [ 1.57921401e-06 5.12153132e-06 5.85090176e-06] [ 1.82640225e-06 -4.21424558e-06 7.36716850e-06] [-4.23527264e-06 -6.66531226e-07 -1.39409900e-06] [ 2.08765315e-06 -3.83771191e-06 -8.89533552e-06] [-8.53584580e-07 -4.88014802e-06 3.11124074e-06] [-1.47844070e-06 1.78603794e-06 8.95795034e-06] [ 2.75524360e-06 -5.27487027e-06 6.79324663e-06] [ 4.11951609e-06 -4.58638928e-07 -6.26376535e-06] [ 1.79342641e-06 5.81749315e-06 3.53482653e-06] [ 8.77087312e-06 8.89239222e-07 8.49894063e-06] [ 7.10011216e-06 8.35920805e-06 -1.04631274e-05] [-2.78108964e-07 -2.30335319e-06 -4.64586932e-06] [-4.04790335e-06 8.86296177e-06 2.24818696e-06] [ 6.04404191e-06 -7.80014414e-06 -8.69238871e-06] [ 4.84574084e-06 1.48632178e-06 4.29791803e-06]] Final stress: [ 3.35841138e-02 3.24760849e-02 1.35157037e-01 -1.77727943e-06 1.00014859e-03 8.16492885e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 30 steps. Final forces: [[ 2.27192617e-05 4.36161347e-05 -3.09035260e-04] [-2.60823929e-05 -4.07906512e-05 6.81473042e-04] [-2.45081050e-05 -4.64011697e-05 4.20384951e-04] [ 2.58619790e-05 4.14627044e-05 -5.54259411e-04] [-1.01898902e-06 1.25918292e-04 -2.43980368e-06] [-1.06249525e-04 -6.21638768e-05 -2.97030181e-06] [ 1.06680902e-04 -6.35859579e-05 -2.39028068e-06] [-1.48286013e-06 -1.36578523e-04 1.38358162e-06] [ 1.24607886e-04 7.11761015e-05 3.97603079e-06] [-1.20562958e-04 6.71442363e-05 2.30707877e-06] [ 3.13383686e-03 -1.14621128e-03 -2.12920597e-04] [-1.99600664e-03 2.05926105e-03 -2.09909980e-04] [-7.51014613e-04 -3.38932959e-03 -2.08069521e-04] [-3.13470903e-03 1.15780349e-03 1.44971970e-04] [ 1.99066663e-03 -2.06341546e-03 1.44385750e-04] [ 7.58088061e-04 3.38309842e-03 1.41951832e-04] [ 1.64493541e-04 5.13095395e-04 3.68183726e-04] [-1.63507879e-04 -5.13588396e-04 3.91601829e-04] [-1.64761300e-04 -5.13498315e-04 -3.75716619e-04] [ 1.63231018e-04 5.13282996e-04 -3.98685863e-04] [-4.64107686e-05 3.27170154e-04 6.18809859e-04] [ 4.74421823e-05 -3.27494768e-04 6.33617882e-04] [ 4.45292893e-05 -3.27398516e-04 -6.31033743e-04] [-4.58425420e-05 3.27427527e-04 -6.45616152e-04]] Final stress: [-2.12499329e-04 -2.43097125e-04 -2.36802655e-04 1.90393501e-08 5.59758528e-08 4.71723395e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.00546674e-09 6.98941118e-05 7.66380545e-06] [-1.29912618e-08 -6.99046628e-05 9.01195862e-06] [ 4.53586094e-09 -6.99076374e-05 -5.80419501e-06] [-1.54245534e-08 6.98884071e-05 -6.94823632e-06] [-1.91929436e-08 -2.21390381e-06 -6.21263016e-07] [ 1.98008507e-06 1.13942600e-06 -6.59759624e-07] [-1.93496584e-06 1.09112608e-06 -6.24242855e-07] [ 1.24824290e-09 7.74404006e-07 -3.17866573e-07] [-6.54584766e-07 -3.84563770e-07 -3.09772333e-07] [ 6.49998824e-07 -3.80549675e-07 -3.04691071e-07] [ 1.70246361e-09 2.22245926e-05 -4.05422660e-07] [ 3.51508788e-05 -4.66060775e-05 -4.04158555e-07] [-3.51524970e-05 -4.66031979e-05 -3.94904014e-07] [-3.74214260e-09 -2.06559137e-05 4.65702358e-08] [-3.64746601e-05 4.58311003e-05 3.97762837e-08] [ 3.64834755e-05 4.58217259e-05 4.89288268e-08] [-2.59765617e-09 -3.13502855e-05 6.21813223e-05] [ 5.53542379e-10 3.13480864e-05 6.22335100e-05] [-2.53255428e-09 3.13468004e-05 -6.22248559e-05] [ 4.96168967e-10 -3.13495892e-05 -6.22300796e-05] [ 1.92805993e-10 -3.63344446e-06 -1.38326456e-05] [-1.08993807e-09 3.63181285e-06 -1.37841428e-05] [-4.23296808e-10 3.63147847e-06 1.38169345e-05] [-4.70646688e-10 -3.63324620e-06 1.38234297e-05]] Final stress: [ 8.02896590e-05 6.30428081e-05 4.50350364e-05 2.05110692e-11 -2.39984077e-13 1.75289308e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-4.05833131e-08 9.80950529e-04 -4.45421760e-04] [ 7.47088645e-08 -9.80969922e-04 -4.14542467e-04] [ 4.14350196e-08 -9.81095674e-04 4.25323870e-04] [ 1.01402840e-07 9.81152639e-04 4.35589961e-04] [ 1.51276261e-07 -7.90362011e-06 -3.49885916e-06] [ 6.04560702e-06 3.65222693e-06 -3.03398220e-06] [-6.40452703e-06 4.03275599e-06 -3.31082046e-06] [ 1.18375857e-08 -8.48050750e-06 3.24158788e-06] [ 7.56277489e-06 4.29713831e-06 3.32214477e-06] [-7.61292328e-06 4.33977328e-06 3.37381330e-06] [-1.31132634e-08 -8.04446667e-04 -1.99280123e-06] [ 9.52393799e-05 5.90710610e-04 -2.00931463e-06] [-9.52417540e-05 5.90695869e-04 -1.98626284e-06] [-1.00219845e-07 7.78544175e-04 1.66056989e-06] [-7.23176893e-05 -5.77611945e-04 1.77362817e-06] [ 7.24673309e-05 -5.77811658e-04 1.67709955e-06] [ 1.61266051e-08 1.92621723e-03 9.07860928e-04] [-2.08500750e-09 -1.92620305e-03 9.07706253e-04] [ 2.19371547e-08 -1.92617116e-03 -9.07500348e-04] [ 1.86012430e-09 1.92617501e-03 -9.08132895e-04] [ 1.66225639e-09 5.61173595e-04 -2.57361258e-03] [-3.53076316e-09 -5.61204491e-04 -2.57339139e-03] [-7.46017953e-09 -5.61221427e-04 2.57351137e-03] [ 6.54662813e-09 5.61178574e-04 2.57339226e-03]] Final stress: [-9.48460408e-05 -1.83196758e-04 -6.65711213e-05 1.93745392e-10 -3.19107648e-10 3.70601815e-11] Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.36864958e-10 1.55913766e-05 5.59781346e-06] [-1.71994375e-09 -1.55905722e-05 6.13026620e-06] [ 9.01491013e-10 -1.55887665e-05 -5.60094087e-06] [-8.70390204e-10 1.55902496e-05 -5.97747690e-06] [-2.59570690e-09 -7.35303083e-08 -2.71121852e-08] [ 6.45072060e-08 3.96652030e-08 -2.87470410e-08] [-5.89582414e-08 3.34677206e-08 -2.47931225e-08] [-1.79322443e-09 -9.67596137e-09 -7.92114707e-10] [ 6.00510974e-09 5.56853685e-09 -2.89970692e-09] [-3.27680172e-09 1.92767341e-09 -3.98048883e-09] [ 1.20002391e-09 -2.69389780e-05 -9.00067167e-08] [ 2.87608874e-06 -1.20956817e-06 -9.23543224e-08] [-2.87802926e-06 -1.20707386e-06 -9.01628564e-08] [ 1.51017032e-10 2.68121382e-05 7.24453670e-08] [-2.76719894e-06 1.27147856e-06 7.21164172e-08] [ 2.76716497e-06 1.27170734e-06 7.16030710e-08] [-3.97408079e-10 -2.10000875e-05 1.24662390e-06] [-2.31706931e-10 2.10002732e-05 1.25473576e-06] [-2.77723622e-10 2.10002172e-05 -1.24573586e-06] [-1.32809569e-10 -2.09999486e-05 -1.25855490e-06] [ 1.24945665e-10 6.01633672e-06 -1.02157946e-05] [-6.91809947e-11 -6.01629096e-06 -1.02069848e-05] [ 5.28459144e-11 -6.01617886e-06 1.02136211e-05] [ 9.18596310e-11 6.01626445e-06 1.02071112e-05]] Final stress: [-2.79307918e-05 -5.59163914e-05 -2.65504915e-05 -2.44862127e-12 -7.13692446e-12 4.24062621e-13] Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 16 steps. Minimization converged after 168 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 35 steps. Final forces: [[-9.93710364e-05 3.90437051e-04 -2.92671660e-02] [-1.46317528e-04 -4.16466456e-04 4.17610484e-02] [ 8.86683383e-04 -5.76878162e-04 4.50792097e-02] [-5.82294259e-05 4.79891301e-04 -3.23414335e-02] [ 1.73393090e-04 1.14602059e-03 -1.04974432e-03] [-1.13880249e-03 -7.38422292e-04 -1.02852164e-03] [ 8.85542247e-04 -3.91854614e-04 -1.11005501e-03] [ 8.16036162e-04 3.47734108e-03 -2.64782480e-03] [-3.71035578e-03 -2.64123773e-03 -3.07241417e-03] [ 1.95835920e-03 -6.83960831e-04 -1.83802085e-03] [-1.41743547e-02 1.69498714e-03 -1.55540720e-02] [ 4.56629921e-03 -7.96311572e-03 -1.58659325e-02] [ 8.40532990e-03 1.10668907e-02 -1.51150328e-02] [ 1.35805430e-02 -7.84635795e-04 1.11461622e-02] [-5.24162410e-03 8.07875465e-03 1.13791889e-02] [-6.85695133e-03 -1.21447732e-02 1.10995310e-02] [ 8.53758479e-04 2.63950990e-03 3.18871476e-04] [-6.87566656e-04 -2.71189324e-03 2.07564270e-03] [-8.17748977e-04 -2.63690962e-03 -7.24091351e-04] [ 8.76906210e-04 2.71449403e-03 -2.44971795e-03] [-7.37357061e-05 2.07605580e-04 -3.75547560e-03] [ 1.05938217e-04 -2.43171943e-04 -2.61474928e-03] [ 3.76412878e-05 -1.95120566e-04 3.38354778e-03] [-1.41372689e-04 2.32508133e-04 2.19104965e-03]] Final stress: [-2.67369825e-04 -1.28644690e-04 -1.44515144e-04 -2.92846378e-06 8.32991896e-07 4.18508185e-06] Minimization converged after 7 steps. Minimization converged after 11 steps. Minimization converged after 7 steps. Minimization converged after 11 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.10233677e-05 -1.41787882e-04 -2.73726915e-06] [-1.10235621e-05 1.41787966e-04 -2.49457558e-06] [-1.10235209e-05 1.41788123e-04 2.17936453e-06] [ 1.10234498e-05 -1.41788184e-04 1.93162992e-06] [-2.65010998e-11 3.78728334e-07 1.18988915e-07] [-3.27973873e-07 -1.89275545e-07 1.18916187e-07] [ 3.28143317e-07 -1.89407214e-07 1.18913698e-07] [-4.87681161e-11 -6.38549938e-07 1.73952039e-07] [ 5.53194054e-07 3.19273220e-07 1.74015277e-07] [-5.53091092e-07 3.19199684e-07 1.73625905e-07] [-2.69166564e-05 -8.74880914e-05 -1.84930701e-09] [-4.66632088e-05 -3.21203753e-05 -2.02331007e-09] [ 7.58013843e-06 -4.07252788e-05 -1.96245460e-09] [ 2.69164686e-05 8.78183311e-05 8.60256161e-08] [ 4.63775203e-05 3.19554491e-05 8.58007004e-08] [-7.29416100e-06 4.05599960e-05 8.57054335e-08] [-3.57890050e-05 -6.45055634e-06 2.90070091e-05] [ 3.57889582e-05 6.45055476e-06 2.90177552e-05] [ 3.57890233e-05 6.45055022e-06 -2.90087644e-05] [-3.57890365e-05 -6.45056468e-06 -2.90092894e-05] [ 7.07491631e-06 2.69551912e-07 8.97081712e-05] [-7.07491362e-06 -2.69552099e-07 8.97172522e-05] [-7.07480318e-06 -2.69543234e-07 -8.97211008e-05] [ 7.07482777e-06 2.69538495e-07 -8.97202915e-05]] Final stress: [ 1.59664648e-05 1.65905231e-05 7.27381037e-06 3.77660234e-13 -8.86977950e-13 1.59372758e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 1.49391966e-05 -1.66517732e-05 -3.19265011e-06] [-9.25732258e-06 -1.97402881e-05 7.36793317e-06] [-1.08252518e-05 1.65158200e-05 -1.21246763e-06] [-1.09822247e-05 1.31225839e-05 1.75101802e-05] [ 9.78350569e-06 4.75899039e-06 1.56173883e-06] [ 1.40204404e-05 2.11471166e-06 1.40955771e-05] [-6.48355257e-06 -1.20698943e-05 -1.32496242e-05] [-9.11733557e-06 -1.16904987e-05 9.57331800e-06] [-2.38864784e-07 3.84604888e-07 -1.21379020e-05] [-5.46304734e-06 9.34359846e-06 1.22296506e-05] [ 1.02573677e-05 9.95468227e-06 6.13693929e-06] [ 3.02011618e-06 -5.46377343e-07 -9.93928728e-06] [ 3.07963330e-06 -4.84911537e-06 -8.00154294e-06] [ 1.90159075e-06 4.56631172e-06 2.06033858e-05] [-1.05253026e-05 -8.31917273e-06 -1.32923478e-05] [-2.44797894e-06 7.19487521e-06 1.24145902e-05] [-1.33895833e-06 -2.25733826e-06 -2.84607513e-06] [ 5.37705533e-06 2.00451288e-06 -9.73821525e-06] [-7.16813336e-06 -1.01157203e-05 -4.53469603e-06] [-2.21644031e-06 -8.27012762e-06 -8.39859881e-06] [ 4.48981767e-06 -1.56678169e-06 -2.00042178e-05] [ 1.49510843e-05 5.69936396e-06 7.72058138e-06] [-2.97002728e-06 8.66031434e-06 1.58931218e-06] [-2.78536768e-06 1.17567180e-05 -4.25558187e-06]] Final stress: [ 3.32810169e-02 3.23506888e-02 1.34819594e-01 2.27581309e-07 3.56691438e-07 -8.38551803e-04] Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 8 steps. Minimization converged after 10 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 6 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 8 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 7 steps. Minimization converged after 4 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 2 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 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 2 steps. Minimization converged after 3 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 0 steps. Minimization converged after 6 steps. Minimization converged after 0 steps. Minimization converged after 1 steps. Minimization converged after 4 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 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 1 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 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 3 steps. Minimization converged after 3 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]: [[ 1.1497 0.67108 0.59307 -0.00001 -0.00001 0.00004] [ 0.67108 1.16336 0.59256 -0. -0. 0.00004] [ 0.59307 0.59256 1.14696 0.00002 0. -0.00002] [-0.00001 -0. 0.00002 -0.20046 -0. -0. ] [-0.00001 -0. 0. -0. -0.21644 0. ] [ 0.00004 0.00004 -0.00002 -0. 0. 0.21329]] 95%% Error estimate [ASE units]: [[0.04438 0.03728 0.02794 0.00008 0.00001 0.00006] [0.03728 0.0516 0.02711 0.00001 0.00002 0.00006] [0.02794 0.02711 0.05297 0.00028 0.00007 0.00033] [0.00008 0.00001 0.00028 0.01512 0. 0. ] [0.00001 0.00002 0.00007 0. 0.00855 0. ] [0.00006 0.00006 0.00033 0. 0. 0.0191 ]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.026486 is too big compared to maximum elastic constant component 1.163359 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.026014 WARNING: Maximum deviation from material symmetry according to space group 194 is too big compared to maximum elastic constant component 1.163359 [ASE units] and requested fractional tolerance 0.010000. 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 3 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-2.30918618e-11 -9.19905706e-05 1.67951280e-04] [-6.97028998e-11 9.19906606e-05 1.67955209e-04] [-2.32396522e-11 9.19906432e-05 -1.67947184e-04] [-7.69184716e-12 -9.19906391e-05 -1.67951524e-04] [-1.63228920e-11 -1.65036718e-09 -7.41227579e-10] [ 1.66695999e-09 8.80709478e-10 -8.33926150e-10] [-1.60116742e-09 8.27178159e-10 -7.62602675e-10] [-8.96174660e-11 1.01407927e-09 -6.34116981e-10] [-1.05079379e-09 -4.57084703e-10 -6.95340341e-10] [ 1.20826454e-09 -6.50792087e-10 -7.79888733e-10] [-8.87750984e-11 6.39983617e-04 -1.30461005e-09] [-6.99313540e-05 -1.69010124e-04 -1.25730592e-09] [ 6.99315102e-05 -1.69010316e-04 -1.19559765e-09] [ 5.46144241e-11 -6.39982758e-04 2.45656712e-10] [ 6.99304054e-05 1.69009691e-04 2.41185160e-10] [-6.99304841e-05 1.69009806e-04 2.35834756e-10] [-3.61771724e-12 1.12379505e-04 -9.39114263e-05] [-1.12334586e-11 -1.12379499e-04 -9.39113144e-05] [-1.99840144e-12 -1.12379521e-04 9.39113295e-05] [-7.37537809e-12 1.12379517e-04 9.39112466e-05] [-1.05450648e-11 -1.67150630e-04 1.98253100e-04] [ 3.18779776e-12 1.67150644e-04 1.98253186e-04] [ 6.40911740e-12 1.67150645e-04 -1.98253184e-04] [-1.17754695e-11 -1.67150634e-04 -1.98253236e-04]] Final stress: [ 6.62994931e-04 1.16258475e-03 6.06056668e-04 2.65310537e-13 -1.74485023e-13 -8.91241011e-14] Minimization converged after 26 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 52 steps. Minimization converged after 50 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 167 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-2.02764776e-02 1.73044018e-02 7.15354870e-03] [ 2.02720001e-02 -1.73000523e-02 6.91650662e-03] [ 2.02626954e-02 -1.73072859e-02 -8.79096325e-03] [-2.02512513e-02 1.73083249e-02 -1.14885647e-02] [ 8.34246398e-06 3.67743265e-03 1.10424091e-03] [-3.20674040e-03 -1.85781950e-03 1.07498627e-03] [ 3.16533941e-03 -1.82429821e-03 1.09797410e-03] [-6.29222539e-06 -1.91996289e-03 5.12169942e-04] [ 1.67293300e-03 9.71399494e-04 4.96075587e-04] [-1.64879006e-03 9.49993880e-04 5.06152940e-04] [-1.69072551e-01 -2.38354547e-02 1.39475908e-05] [ 1.88913005e-02 -1.94355886e-02 1.28191659e-05] [ 7.57104036e-02 2.21068374e-02 1.39477592e-05] [ 1.69077310e-01 2.50016647e-02 4.61111315e-04] [-1.99012622e-02 1.88472968e-02 4.71151479e-04] [-7.47075447e-02 -2.26782816e-02 4.49555785e-04] [ 1.33676966e-02 2.42215396e-02 -2.09771599e-02] [-1.33670825e-02 -2.42275461e-02 -2.09331482e-02] [-1.33747144e-02 -2.42275147e-02 2.09993082e-02] [ 1.33716035e-02 2.42253666e-02 2.09812442e-02] [ 2.79679368e-03 -2.45911759e-03 4.62226876e-03] [-2.78818979e-03 2.45808807e-03 4.62331009e-03] [-2.80981358e-03 2.46165688e-03 -4.64546478e-03] [ 2.81429113e-03 -2.46108080e-03 -4.67501861e-03]] Final stress: [-1.17955594e-03 1.00965921e-03 1.92688112e-04 9.08729937e-09 4.66745816e-08 -1.07318366e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-8.88898538e-10 1.12623107e-03 -1.65383279e-03] [ 1.23737740e-09 -1.12623343e-03 -1.65378748e-03] [ 1.21985141e-09 -1.12623032e-03 1.65387115e-03] [ 5.78134152e-10 1.12623142e-03 1.65381700e-03] [ 1.02897091e-09 -9.75140796e-09 -5.36334771e-09] [ 1.32185656e-08 4.72598274e-09 -7.07028464e-09] [-1.59791274e-08 7.50902690e-09 -9.45230191e-09] [ 7.80321368e-10 -1.87784142e-08 -1.58749580e-09] [ 2.19457171e-08 9.08535247e-09 -9.53523926e-10] [-2.33132002e-08 1.07026085e-08 -1.91207192e-10] [ 1.96407662e-09 1.79759415e-03 -1.35821871e-08] [ 7.67824531e-04 -1.14545234e-03 -1.63494565e-08] [-7.67828249e-04 -1.14544790e-03 -1.59634017e-08] [-2.06594014e-09 -1.79754760e-03 2.26047185e-09] [-7.67869358e-04 1.14542831e-03 3.57336357e-09] [ 7.67872835e-04 1.14542392e-03 2.39623435e-09] [ 7.84881327e-11 -5.84943406e-04 -3.96314822e-04] [ 5.77178305e-11 5.84942519e-04 -3.96312886e-04] [ 1.80224280e-10 5.84942734e-04 3.96312851e-04] [ 8.44514458e-11 -5.84943254e-04 3.96312423e-04] [ 2.12025397e-10 2.50165360e-04 8.18729966e-04] [-1.92524196e-10 -2.50165096e-04 8.18731605e-04] [-2.04771830e-10 -2.50164832e-04 -8.18732389e-04] [ 2.99980374e-10 2.50165204e-04 -8.18732347e-04]] Final stress: [ 6.48314493e-04 4.42883288e-04 3.56743804e-04 -1.14370699e-11 -4.09261133e-12 1.92245268e-12] Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-3.54002078e-10 4.55187928e-05 8.63133404e-06] [ 1.04727772e-11 -4.55181426e-05 8.76798219e-06] [-1.68430046e-09 -4.55193771e-05 -8.63538957e-06] [ 1.42144360e-09 4.55203985e-05 -8.79714160e-06] [ 2.45553480e-09 6.43805813e-08 1.53886843e-08] [-6.13242578e-08 -3.56975822e-08 1.85260877e-08] [ 5.61743252e-08 -2.98986551e-08 1.49824100e-08] [ 1.41828727e-09 1.59393665e-08 -5.37807032e-09] [-1.33822765e-08 -8.58038984e-09 -3.73668763e-09] [ 1.23409588e-08 -6.36187830e-09 -4.48923199e-09] [-3.88332200e-09 3.41735712e-04 -2.71217779e-08] [-3.37959637e-05 -5.97681889e-05 -2.61868027e-08] [ 3.38028296e-05 -5.97766325e-05 -2.69024016e-08] [-1.52808877e-11 -3.41830908e-04 2.61918021e-08] [ 3.38741619e-05 5.98188308e-05 2.74256719e-08] [-3.38742468e-05 5.98188597e-05 2.66218670e-08] [ 3.39824141e-10 2.77659273e-04 -6.99899147e-05] [ 1.37253042e-10 -2.77659177e-04 -6.99880242e-05] [ 3.05241943e-10 -2.77659005e-04 6.99912611e-05] [ 1.79129461e-10 2.77659079e-04 6.99862400e-05] [-5.26748756e-10 -1.16896135e-04 2.54422351e-05] [ 6.54219349e-11 1.16896498e-04 2.54435476e-05] [-9.02831351e-11 1.16896399e-04 -2.54418692e-05] [-3.68456265e-10 -1.16896058e-04 -2.54455823e-05]] Final stress: [ 4.23232189e-04 7.23612757e-04 3.84669692e-04 5.97281289e-14 -2.35371306e-13 -1.70127728e-12] Minimization converged after 27 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 52 steps. Minimization converged after 54 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[ 1.35801860e-03 2.21205181e-03 2.23154004e-03] [-1.35810801e-03 -2.21214700e-03 2.30283630e-03] [-1.35835959e-03 -2.21251137e-03 -2.21945324e-03] [ 1.35831130e-03 2.21240039e-03 -2.29680998e-03] [-8.38984611e-08 8.70378722e-06 1.85152193e-07] [-7.17871430e-06 -4.28244012e-06 2.51258255e-07] [ 7.22914031e-06 -4.38458236e-06 6.92044737e-08] [-3.14405517e-07 -9.82386945e-06 -1.43340845e-07] [ 8.47824640e-06 5.30346305e-06 2.42333529e-07] [-7.91759600e-06 4.62378754e-06 -2.02640540e-07] [ 3.47174850e-02 8.08137648e-04 -1.62255009e-05] [-1.20670478e-02 1.10321647e-02 -1.58621241e-05] [-1.05229241e-02 -1.56313484e-02 -1.59867848e-05] [-3.47176283e-02 -7.99565353e-04 1.05090358e-05] [ 1.20598153e-02 -1.10362874e-02 1.10276449e-05] [ 1.05303178e-02 1.56269916e-02 1.07956522e-05] [-4.61350657e-03 4.65931229e-03 -4.12944840e-03] [ 4.61333015e-03 -4.65937258e-03 -4.12751456e-03] [ 4.61349787e-03 -4.65934161e-03 4.12874497e-03] [-4.61343029e-03 4.65939895e-03 4.12708795e-03] [-8.62953242e-04 -8.77592869e-04 -2.29664090e-03] [ 8.62837667e-04 8.77537532e-04 -2.29548437e-03] [ 8.63074780e-04 8.77575246e-04 2.29577051e-03] [-8.62943413e-04 -8.77543708e-04 2.29471179e-03]] Final stress: [-5.73861731e-04 -1.16672295e-04 -8.09762067e-05 -1.87401459e-10 -5.67015527e-09 3.14808144e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 78 steps. Final forces: [[-7.05283425e-04 -1.22116304e-04 -8.02459055e-04] [-7.95488794e-04 -7.59325369e-04 6.41624550e-05] [ 8.00976405e-04 8.07397528e-04 3.52917304e-04] [ 6.11907947e-04 1.29629753e-04 1.38435293e-04] [ 1.01901588e-04 6.19012303e-05 1.18676163e-04] [-1.66861485e-04 2.78052951e-05 1.88781772e-04] [-5.09585572e-05 2.75446491e-04 -5.65029536e-04] [ 1.57408357e-04 1.57081078e-04 2.06394538e-04] [-4.10046726e-04 -4.37003417e-04 2.16196399e-04] [ 3.52579164e-04 -2.27247068e-04 -5.37159758e-04] [-5.32165913e-04 1.81187371e-04 1.24753889e-03] [ 6.92927616e-05 3.20399976e-04 -1.03103801e-03] [ 4.65486695e-04 -5.42702922e-04 4.94247569e-04] [-8.45996820e-04 -5.66468426e-04 1.11300620e-04] [ 4.88088528e-04 1.18807248e-03 -9.04420226e-05] [ 5.24813411e-04 -5.65080845e-04 9.03259489e-05] [ 1.07837261e-03 -2.27200949e-04 4.62379074e-05] [-4.34641549e-04 8.28600984e-05 -9.64031669e-06] [ 5.93508874e-04 -2.53859823e-05 -5.32366980e-06] [-1.19723543e-03 1.52708673e-04 4.24129042e-05] [ 3.92715024e-04 3.69695490e-04 -5.33947265e-04] [-6.50238769e-04 -1.52595499e-04 2.47566695e-05] [ 2.59453384e-04 -8.77838608e-05 3.94431775e-04] [-1.07587289e-04 -4.12748243e-05 -1.61776579e-04]] Final stress: [ 3.61657014e-02 3.61626855e-02 1.44664742e-01 -3.59027739e-06 -4.64259105e-06 -4.82862394e-04] Minimization converged after 31 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 56 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-7.01958504e-06 3.88716621e-04 1.65342022e-04] [-6.62037000e-05 -1.02932386e-03 -1.15816873e-05] [-1.82761083e-05 -1.10207630e-04 -2.75431462e-05] [-2.11884618e-04 -1.01201252e-03 1.31814651e-04] [-2.56675604e-05 2.01321863e-04 -9.16541446e-04] [ 1.04216199e-04 6.05754914e-04 3.47898212e-04] [-2.77705007e-04 5.08190301e-04 9.63470863e-05] [ 1.34507790e-04 -4.39311236e-05 -4.14920255e-04] [ 2.15865040e-04 -5.59270238e-04 1.07124071e-03] [ 2.03645227e-05 -1.18152074e-04 4.31959481e-04] [ 2.63184968e-04 -8.57112981e-04 -8.86082964e-04] [-8.74442294e-04 9.58999869e-04 -2.66473197e-04] [ 6.09605132e-04 7.66154916e-04 1.94764000e-04] [-1.83247979e-04 -7.89884584e-04 -1.98894409e-04] [-4.52456341e-04 4.64158231e-04 -2.38801380e-04] [ 7.42543642e-04 6.90427681e-04 3.58755339e-04] [-4.52107369e-05 -2.03535761e-05 -7.44363929e-07] [ 6.85081506e-05 -1.28006250e-04 1.37751858e-04] [-3.65775446e-05 -9.88866083e-05 -8.48509997e-06] [ 5.67437787e-05 -4.85346810e-05 -1.78303161e-04] [-4.91864933e-05 1.93698653e-04 -2.28586204e-04] [ 3.88621550e-05 1.29096624e-04 1.98249383e-04] [-6.49495988e-05 3.13590429e-05 2.36639008e-04] [ 5.84261875e-05 -1.22202587e-04 6.19556870e-06]] Final stress: [-3.38980014e-04 -9.59842102e-05 -2.19256285e-04 2.55886952e-04 1.47146243e-07 1.32413349e-06] Minimization converged after 46 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 84 steps. Final forces: [[ 0.00193132 0.01730144 -0.01553258] [ 0.01167691 0.02664929 -0.01351816] [ 0.0029858 -0.03690455 -0.02284195] [-0.008191 -0.01231549 0.0440217 ] [-0.00219625 0.02429417 0.02607593] [ 0.01224022 -0.00739154 0.03131716] [-0.00676362 -0.01457865 0.01893867] [-0.01433562 -0.02553883 -0.01621485] [ 0.01891451 0.03027635 -0.01392104] [-0.00639961 0.00503676 -0.02338027] [ 0.0278865 -0.04205251 -0.02925402] [-0.038829 -0.01421674 0.01721307] [-0.01428141 0.05239523 0.00602812] [-0.04336039 0.01834555 0.00053065] [ 0.04863668 -0.01717275 -0.00960978] [ 0.00604594 -0.00613631 0.00775763] [ 0.02547241 -0.03032253 0.00194551] [-0.00191374 -0.00130327 0.00252007] [ 0.00327834 0.0098555 0.00219416] [-0.02023052 0.01701556 -0.00224726] [ 0.01876389 0.00100088 -0.01066803] [-0.010443 0.00614883 0.00124052] [-0.00803534 -0.01178556 0.00934709] [-0.00285302 0.01139917 -0.01194232]] Final stress: [3.61305082e-02 3.59804206e-02 1.44562091e-01 1.03412404e-04 4.69571275e-05 3.11182921e-04] Minimization converged after 199 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.33963299e-09 4.19777146e-04 2.54301683e-04] [-2.67005259e-09 -4.19788682e-04 2.54027404e-04] [ 1.29956414e-09 -4.19788471e-04 -2.51766363e-04] [ 1.25134203e-09 4.19771462e-04 -2.53271828e-04] [ 1.86460653e-09 -6.07351436e-07 -1.99791880e-07] [ 5.49503489e-07 3.07735892e-07 -2.14946887e-07] [-5.52117290e-07 3.11419228e-07 -2.15539218e-07] [-7.67493093e-09 1.41779693e-06 -5.19562959e-07] [-1.21934284e-06 -6.98348057e-07 -5.13945032e-07] [ 1.23324857e-06 -7.15364934e-07 -5.21684139e-07] [ 5.13274978e-10 6.54843384e-04 -2.87272636e-07] [ 2.73669598e-04 -2.36930691e-04 -2.88310112e-07] [-2.73670661e-04 -2.36929545e-04 -2.80520990e-07] [ 3.15198012e-09 -6.53821907e-04 -6.29270759e-08] [-2.74494025e-04 2.36426855e-04 -6.49503096e-08] [ 2.74489155e-04 2.36433351e-04 -6.53583400e-08] [-1.20309401e-10 -1.12626034e-04 8.13410625e-05] [-8.98302321e-10 1.12625415e-04 8.13699056e-05] [ 2.00285399e-10 1.12623854e-04 -8.13794396e-05] [-5.54508661e-10 -1.12624689e-04 -8.13790952e-05] [-1.31661848e-10 -3.30950795e-05 -3.09399139e-04] [ 2.81825053e-10 3.30913775e-05 -3.09392385e-04] [ 3.15384995e-10 3.30907948e-05 3.09398481e-04] [ 1.52309609e-10 -3.30944277e-05 3.09384522e-04]] Final stress: [ 2.66744465e-04 1.87474038e-04 1.54080862e-04 9.10924001e-12 -2.15935762e-11 -2.11749651e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 5.02050373e-10 -8.41232024e-06 1.08213709e-05] [ 7.30906089e-10 8.41147490e-06 1.09844129e-05] [ 4.27252053e-11 8.41090105e-06 -1.08925332e-05] [ 1.72882847e-10 -8.41195215e-06 -1.08545760e-05] [ 3.53957574e-10 -8.99507431e-08 -2.74074721e-08] [ 7.89367619e-08 4.47216073e-08 -2.74556525e-08] [-7.99755638e-08 4.57321184e-08 -2.84209161e-08] [ 6.97260574e-10 -2.96929081e-09 6.65680189e-09] [ 4.33662739e-09 1.22157562e-09 7.48007090e-09] [-5.87428423e-09 2.91130353e-09 8.58275214e-09] [ 1.21334109e-10 1.95166268e-05 -1.16995987e-08] [-1.25575876e-05 1.98653801e-05 -1.08950081e-08] [ 1.25572571e-05 1.98657113e-05 -1.17707737e-08] [-1.14487086e-10 -1.96268630e-05 1.08597411e-08] [ 1.26550726e-05 -1.98099406e-05 1.09010178e-08] [-1.26550214e-05 -1.98100948e-05 1.11321793e-08] [ 7.49445783e-11 3.52582344e-05 1.41201980e-05] [ 8.71452355e-11 -3.52583931e-05 1.41199147e-05] [ 3.19436144e-11 -3.52583474e-05 -1.41181435e-05] [ 4.06581990e-11 3.52581643e-05 -1.41213040e-05] [ 5.21612753e-11 -2.59043834e-05 -2.96107595e-05] [ 2.26387414e-11 2.59042645e-05 -2.96090945e-05] [ 8.99528732e-12 2.59042413e-05 2.96114969e-05] [ 3.06920045e-11 -2.59043706e-05 2.96110541e-05]] Final stress: [-2.66098484e-04 -1.45523023e-04 -1.35704601e-04 6.92869285e-13 2.92646779e-12 1.43600209e-13] Minimization converged after 26 steps. Minimization converged after 29 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 52 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-2.96259049e-04 -8.75365394e-04 4.36991381e-04] [-1.37421896e-03 3.38596698e-03 3.48332419e-04] [-2.41476982e-04 -1.67545776e-03 2.79348776e-04] [-1.49073849e-03 2.69985721e-03 3.54925159e-04] [ 4.04265825e-03 -3.15914084e-03 7.38108296e-04] [ 9.14707800e-05 6.52447498e-04 -2.08726727e-03] [-2.74601300e-03 -4.70098352e-03 -1.05495292e-03] [ 3.13922167e-03 2.05819854e-03 -1.14385859e-03] [ 9.36598691e-04 1.13575852e-03 -2.47667109e-04] [-3.09304010e-03 -1.26755734e-03 4.81725197e-05] [ 1.40812398e-03 -3.57115555e-03 6.50683464e-04] [-2.67871091e-03 4.55358676e-03 -3.61721093e-04] [ 1.99988619e-03 -8.30094022e-04 1.11425864e-03] [-2.28529209e-03 -3.25626451e-03 2.57598052e-03] [-9.01827412e-04 1.78129839e-03 -1.36572042e-03] [ 4.09120802e-03 1.80251880e-03 2.69719196e-04] [-1.48220224e-04 -1.85578173e-05 -7.31182489e-04] [ 2.48655429e-04 8.13602138e-05 7.34124860e-04] [-6.20569623e-06 -5.06046003e-04 8.20370270e-04] [ 1.73732753e-04 -3.34300606e-04 -6.95762410e-04] [-2.52998663e-04 3.53770089e-04 -2.41314562e-03] [-2.34846722e-04 7.09686200e-04 2.33700613e-03] [-3.12403432e-04 1.41983696e-04 2.02006722e-03] [-6.93040122e-05 8.38490445e-04 -2.62681091e-03]] Final stress: [-3.27521121e-04 -9.13824111e-05 -2.13181882e-04 2.12484823e-04 8.51620846e-07 1.26816057e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 1.02249201e-05 3.60486661e-05 2.21188737e-05] [ 1.03826495e-05 -3.64814573e-05 1.65193558e-05] [-1.06815742e-05 -3.64562968e-05 3.08328399e-05] [-1.03994530e-05 3.61153579e-05 1.21226743e-04] [ 1.74891847e-07 -2.03481339e-04 -4.78612722e-05] [ 1.76886732e-04 1.01822428e-04 -4.78734673e-05] [-1.77181719e-04 1.02194202e-04 -4.82637666e-05] [-3.45361058e-07 1.07392332e-04 -2.15669641e-05] [-9.20385563e-05 -5.31706976e-05 -2.08705666e-05] [ 9.28103310e-05 -5.40146730e-05 -2.13232560e-05] [-1.42642161e-07 3.34397205e-05 9.14718684e-06] [-8.62172255e-05 -9.09075997e-05 -1.02773763e-06] [ 8.65648905e-05 -9.12738830e-05 1.93683184e-05] [-1.02472029e-07 -1.19868842e-05 -8.10930748e-06] [ 6.84906646e-05 8.06275369e-05 2.23265719e-06] [-6.83081252e-05 8.04044028e-05 -1.82278769e-05] [ 2.57976638e-05 1.06594389e-04 6.25842526e-04] [ 2.57515390e-05 -1.06645017e-04 6.25039253e-04] [-2.57693780e-05 -1.06595079e-04 -6.24660880e-04] [-2.58326612e-05 1.06573635e-04 -6.23261874e-04] [-1.58383954e-05 -7.67735703e-05 7.87532621e-06] [-1.58242813e-05 7.66622245e-05 8.43040088e-06] [ 1.58011890e-05 7.68693076e-05 -3.87799591e-06] [ 1.57963725e-05 -7.69577051e-05 -1.70851530e-06]] Final stress: [ 3.94651982e-05 8.03711738e-06 -2.18115575e-05 -8.14197299e-10 -1.12641488e-04 -6.68333590e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[ 3.78065043e-06 7.95927523e-05 2.89656267e-04] [ 3.90270255e-06 -7.94273196e-05 -2.33800498e-04] [-3.28422977e-06 -7.97445117e-05 -1.73631367e-04] [-4.25080781e-06 7.93798937e-05 1.99295537e-04] [-1.04198908e-07 -1.21798670e-05 3.36777269e-06] [ 1.08753370e-05 6.28172399e-06 3.13902200e-06] [-1.05451413e-05 5.97288732e-06 3.47087715e-06] [ 1.89395007e-09 1.47957409e-04 -3.68841818e-05] [-1.28284225e-04 -7.41026330e-05 -3.67689041e-05] [ 1.28008763e-04 -7.39410489e-05 -3.65348199e-05] [ 1.65027820e-07 -3.21951284e-05 8.18160960e-05] [ 2.36376199e-06 -3.35750140e-05 8.38316490e-05] [-3.12684002e-06 -3.29479880e-05 8.04216556e-05] [-1.15900169e-07 3.68296071e-05 -7.84340512e-05] [-5.91562432e-06 3.12633996e-05 -8.06314049e-05] [ 6.52118896e-06 3.07828218e-05 -7.65547919e-05] [-3.34667315e-05 1.15502273e-04 6.81543770e-04] [-3.35088290e-05 -1.15603777e-04 6.71348026e-04] [ 3.34197385e-05 -1.15504932e-04 -6.80592095e-04] [ 3.35405256e-05 1.15565200e-04 -6.70234830e-04] [ 1.79403410e-05 -7.68795687e-05 3.51164476e-06] [ 1.78421861e-05 7.68444228e-05 -5.70580593e-06] [-1.79079275e-05 7.70355085e-05 1.25572953e-06] [-1.78516611e-05 -7.69061106e-05 7.11470228e-06]] Final stress: [ 4.08168958e-05 7.41085910e-06 -2.40173323e-05 -3.92600182e-09 1.12150377e-04 5.64355408e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.94297749e-05 5.47959444e-04 1.89431089e-04] [-2.94297960e-05 -5.47959439e-04 1.89412497e-04] [-2.94297991e-05 -5.47959445e-04 -1.89400050e-04] [ 2.94298011e-05 5.47959445e-04 -1.89409475e-04] [ 3.28566666e-12 -3.34662903e-09 -8.81563489e-10] [ 2.88486844e-09 1.66932638e-09 -8.78371070e-10] [-2.88950713e-09 1.67318159e-09 -8.77348194e-10] [-3.07179505e-11 2.60533144e-08 -7.80229792e-09] [-2.25419688e-08 -1.29912404e-08 -7.79986453e-09] [ 2.26003111e-08 -1.30619764e-08 -7.80982401e-09] [-1.38610385e-05 1.83332625e-04 -5.43670701e-10] [-1.14737815e-04 8.93078346e-05 -5.41791219e-10] [ 1.54726548e-05 1.25898745e-04 -5.37314192e-10] [ 1.38610391e-05 -1.83328777e-04 -2.17833519e-09] [ 1.14734471e-04 -8.93097560e-05 -2.16994182e-09] [-1.54693090e-05 -1.25900675e-04 -2.18811552e-09] [-7.08009339e-05 3.36320733e-05 3.99733534e-05] [ 7.08009340e-05 -3.36320720e-05 3.99733083e-05] [ 7.08009330e-05 -3.36320722e-05 -3.99735377e-05] [-7.08009320e-05 3.36320728e-05 -3.99733729e-05] [ 7.31701471e-05 -4.88141790e-06 1.44325659e-05] [-7.31701524e-05 4.88141826e-06 1.44322248e-05] [-7.31701589e-05 4.88141772e-06 -1.44321037e-05] [ 7.31701538e-05 -4.88141763e-06 -1.44322897e-05]] Final stress: [ 1.43770821e-05 1.52651690e-05 6.90319287e-06 1.73697615e-14 -4.43626709e-14 1.17380540e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.50401328e-05 5.21198127e-04 1.56294683e-04] [ 2.50401553e-05 -5.21198140e-04 1.56268922e-04] [ 2.50401804e-05 -5.21198165e-04 -1.56237000e-04] [-2.50401766e-05 5.21198162e-04 -1.56252474e-04] [-2.64111651e-11 -2.29471781e-08 -6.08194217e-09] [ 1.99170460e-08 1.15027098e-08 -6.08443609e-09] [-1.98674856e-08 1.14437677e-08 -6.07579465e-09] [ 4.70703700e-11 3.85701286e-08 -1.25038371e-08] [-3.34472238e-08 -1.93319234e-08 -1.24968329e-08] [ 3.33557202e-08 -1.92224457e-08 -1.24747442e-08] [ 2.13690233e-05 1.51161789e-04 -2.18076438e-09] [-2.15273751e-05 1.28808454e-04 -2.16105237e-09] [ 1.18630094e-04 1.01523988e-04 -2.15572036e-09] [-2.13689877e-05 -1.51134012e-04 -4.02927087e-09] [ 2.15033008e-05 -1.28822377e-04 -4.00733077e-09] [-1.18606070e-04 -1.01537838e-04 -3.98494593e-09] [ 7.19320086e-05 3.27502744e-05 3.32614155e-05] [-7.19320055e-05 -3.27502753e-05 3.32617261e-05] [-7.19320033e-05 -3.27502743e-05 -3.32621497e-05] [ 7.19320062e-05 3.27502742e-05 -3.32616028e-05] [-6.98622431e-05 -2.47952518e-06 1.68761708e-05] [ 6.98622448e-05 2.47952389e-06 1.68760351e-05] [ 6.98622576e-05 2.47952257e-06 -1.68757636e-05] [-6.98622558e-05 -2.47952354e-06 -1.68757255e-05]] Final stress: [ 1.45240755e-05 1.51659345e-05 7.43778823e-06 -3.17736531e-14 2.63701384e-14 -1.18058994e-04] Minimization converged after 31 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 4.90782667e-09 1.97948915e-04 -5.59975875e-05] [ 7.61013041e-10 -1.97944593e-04 -5.58209621e-05] [ 4.07318605e-09 -1.97943482e-04 5.59098149e-05] [-4.67938133e-09 1.97938496e-04 5.58215018e-05] [-6.93458613e-09 -1.66657244e-11 3.54107788e-09] [ 8.00692868e-09 9.08782286e-09 -4.00754330e-09] [ 4.68161254e-09 -6.23773438e-09 3.30938782e-09] [ 1.02136528e-08 6.52899597e-08 8.82629625e-09] [-7.12327476e-08 -4.56474327e-08 -9.04283537e-10] [ 5.08781566e-08 -2.20950818e-08 1.24269079e-08] [ 3.59010099e-09 5.52755862e-05 -1.52078987e-08] [-9.86006961e-06 1.58700235e-04 -1.42236951e-08] [ 9.85301373e-06 1.58708490e-04 -1.65336425e-08] [-2.18032226e-09 -5.53140690e-05 3.83938844e-08] [ 9.88985313e-06 -1.58682959e-04 2.72067792e-08] [-9.88623272e-06 -1.58687517e-04 3.17217346e-08] [-7.52589574e-10 4.29390303e-04 1.40500745e-04] [ 1.39718720e-09 -4.29389658e-04 1.40504474e-04] [-9.65247049e-10 -4.29390620e-04 -1.40499454e-04] [ 1.06345391e-09 4.29390384e-04 -1.40501892e-04] [ 5.97188243e-10 5.45963963e-05 -4.30100730e-04] [-2.10625907e-10 -5.45961120e-05 -4.30102156e-04] [-1.38368026e-10 -5.45961108e-05 4.30108769e-04] [ 3.59026975e-10 5.45959347e-05 4.30102927e-04]] Final stress: [-1.50350899e-04 -1.14427313e-04 -8.28270222e-05 2.83356094e-11 1.78642575e-11 2.14498016e-12] Minimization converged after 28 steps. Minimization converged after 31 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 13 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-7.32946346e-05 1.15947614e-03 5.94713076e-05] [ 7.32946234e-05 -1.15947614e-03 5.94665291e-05] [ 7.32946341e-05 -1.15947613e-03 -5.94682971e-05] [-7.32946132e-05 1.15947613e-03 -5.94677973e-05] [-4.45707794e-12 2.22592778e-10 2.02523831e-10] [-1.95327837e-10 -1.02999380e-10 1.99906119e-10] [ 1.90681970e-10 -1.06811782e-10 1.69587677e-10] [ 5.63882014e-12 2.80798673e-09 -7.73754172e-10] [-2.43040943e-09 -1.41666545e-09 -7.78261233e-10] [ 2.42904824e-09 -1.41672823e-09 -8.08984574e-10] [-5.83582002e-05 -3.16700792e-04 4.51045877e-10] [-4.98408292e-04 5.89980722e-04 4.54024426e-10] [ 3.69732915e-04 5.87157483e-04 4.63277509e-10] [ 5.83581964e-05 3.16701930e-04 -4.79061134e-10] [ 4.98407312e-04 -5.89981279e-04 -4.61070347e-10] [-3.69731934e-04 -5.87158056e-04 -4.84260950e-10] [-1.32204751e-04 -8.71803251e-06 1.54564486e-04] [ 1.32204751e-04 8.71803148e-06 1.54564446e-04] [ 1.32204750e-04 8.71803532e-06 -1.54564495e-04] [-1.32204748e-04 -8.71803633e-06 -1.54564417e-04] [ 5.82811093e-05 5.72068201e-05 7.22161198e-05] [-5.82811105e-05 -5.72068190e-05 7.22160449e-05] [-5.82811138e-05 -5.72068140e-05 -7.22160483e-05] [ 5.82811124e-05 5.72068158e-05 -7.22160326e-05]] Final stress: [ 1.85630163e-05 1.33035125e-05 -4.00570213e-07 -3.29883637e-15 -5.50381560e-14 6.41328123e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 6.11150170e-05 1.39032276e-03 -4.50666262e-05] [-6.11150165e-05 -1.39032273e-03 -4.50704797e-05] [-6.11149908e-05 -1.39032277e-03 4.50690198e-05] [ 6.11149885e-05 1.39032275e-03 4.50742260e-05] [ 1.09375766e-11 -2.48036958e-09 -7.94161681e-10] [ 2.16576826e-09 1.25788615e-09 -7.92842458e-10] [-2.14986817e-09 1.23078464e-09 -7.82691939e-10] [-9.30332200e-13 3.84602039e-09 -9.47919521e-10] [-3.34730432e-09 -1.92154648e-09 -9.39815670e-10] [ 3.32996719e-09 -1.90022381e-09 -9.42105227e-10] [ 8.06147390e-05 -5.04734421e-04 6.12006378e-10] [-4.64335634e-04 7.20917444e-04 6.36513003e-10] [ 6.39051815e-04 7.58122723e-04 6.51669703e-10] [-8.06147377e-05 5.04731246e-04 -9.80371444e-10] [ 4.64338377e-04 -7.20915867e-04 -9.94914573e-10] [-6.39054567e-04 -7.58121165e-04 -9.80738160e-10] [ 1.80006314e-04 -3.32295177e-04 6.67533596e-04] [-1.80006316e-04 3.32295181e-04 6.67533442e-04] [-1.80006315e-04 3.32295179e-04 -6.67533551e-04] [ 1.80006316e-04 -3.32295177e-04 -6.67533498e-04] [-1.35430476e-05 7.99663510e-05 -4.14872677e-04] [ 1.35430476e-05 -7.99663556e-05 -4.14872793e-04] [ 1.35430566e-05 -7.99663580e-05 4.14872779e-04] [-1.35430530e-05 7.99663517e-05 4.14872816e-04]] Final stress: [ 1.31149823e-05 -1.69855119e-07 -2.45940117e-05 8.32334440e-14 -1.12057669e-13 -4.29051815e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.85803622e-10 1.31970641e-05 -6.06568243e-06] [ 1.09233239e-09 -1.31990637e-05 -5.97897389e-06] [ 7.36954359e-10 -1.31991349e-05 6.08544341e-06] [-5.19317644e-11 1.31981555e-05 6.07849490e-06] [ 9.47909611e-10 -5.32610178e-08 -2.11137692e-08] [ 4.50203071e-08 2.55709667e-08 -2.06105520e-08] [-4.70391426e-08 2.78331820e-08 -2.20370895e-08] [ 1.46677575e-10 -5.84854742e-09 -2.07979922e-09] [ 5.56336477e-09 3.13063619e-09 -1.18750410e-09] [-6.02525346e-09 3.57608415e-09 -7.26045033e-10] [ 1.48459972e-09 -1.55164468e-05 -1.61307604e-08] [ 5.07239517e-06 -1.55470349e-05 -1.62089100e-08] [-5.07527429e-06 -1.55436779e-05 -1.62883598e-08] [-9.48457701e-10 1.55188868e-05 -6.06796742e-11] [-5.06692653e-06 1.55465497e-05 7.06614637e-10] [ 5.06861855e-06 1.55444964e-05 8.65438093e-10] [ 9.73318370e-11 -3.67951691e-06 3.16713732e-05] [ 3.56260021e-11 3.67950740e-06 3.16725258e-05] [ 1.14202814e-10 3.67959734e-06 -3.16727146e-05] [-5.68989300e-14 -3.67951449e-06 -3.16737033e-05] [ 1.83045024e-10 1.20927006e-05 -1.88567203e-06] [-8.00987193e-11 -1.20931534e-05 -1.88439511e-06] [-9.53193281e-11 -1.20931698e-05 1.88424343e-06] [ 1.90809368e-10 1.20927535e-05 1.88393199e-06]] Final stress: [ 1.23340853e-04 7.90529725e-05 6.63202927e-05 -2.96638627e-12 6.07565094e-13 8.61175431e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.26064014e-10 -5.77402748e-06 5.23624914e-06] [-1.15809385e-09 5.77089722e-06 5.56425368e-06] [-1.41591135e-09 5.77469864e-06 -5.43759532e-06] [-2.79426815e-10 -5.77587084e-06 -5.37611310e-06] [-1.03524236e-10 2.28307019e-07 3.55113535e-08] [-1.89768717e-07 -1.12069749e-07 3.06898406e-08] [ 1.90496618e-07 -1.12619935e-07 3.15970825e-08] [-2.07151469e-09 1.85204122e-07 -2.34237363e-08] [-1.62837213e-07 -9.10840423e-08 -2.40322394e-08] [ 1.66800645e-07 -9.57660587e-08 -2.65202401e-08] [-2.28167957e-09 -2.86984438e-05 -2.39069274e-08] [ 1.85021407e-05 3.59504056e-05 -2.59991156e-08] [-1.84978973e-05 3.59453158e-05 -2.57931627e-08] [-1.89577076e-10 2.77576456e-05 2.24940298e-08] [-1.76742326e-05 -3.54754378e-05 2.23287126e-08] [ 1.76746656e-05 -3.54759144e-05 2.23311876e-08] [-3.26083605e-12 2.50738021e-05 5.07465159e-06] [-2.47693532e-10 -2.50739994e-05 5.06316800e-06] [-1.58538183e-11 -2.50745156e-05 -5.06052917e-06] [-2.19031765e-10 2.50744805e-05 -5.07811348e-06] [-2.73518486e-10 -7.40133217e-06 -1.52390337e-05] [-5.75821284e-11 7.40079665e-06 -1.52470269e-05] [-3.51611124e-11 7.40092607e-06 1.52486587e-05] [-2.89823887e-10 -7.40139790e-06 1.52361537e-05]] Final stress: [-9.38609228e-05 -4.92952932e-05 -4.61691594e-05 -5.39030900e-12 -5.21483734e-13 -8.63284506e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-5.53469964e-10 -1.64086437e-05 2.39563972e-06] [-4.13912043e-09 1.64060971e-05 2.54209039e-06] [-7.73290428e-11 1.64074668e-05 -2.13990485e-06] [-1.05795955e-09 -1.64076269e-05 -2.36412142e-06] [-2.52430890e-09 3.25211804e-08 -1.21947084e-08] [-2.33439059e-08 -1.25367857e-08 -1.59237644e-08] [ 3.01116385e-08 -1.93062806e-08 -1.00567666e-08] [ 4.42058561e-10 2.45913396e-07 -7.55170385e-08] [-2.13514915e-07 -1.23347129e-07 -7.53584432e-08] [ 2.13669166e-07 -1.22999310e-07 -7.62146943e-08] [-2.42483678e-09 3.93956870e-05 -5.86997368e-08] [-9.35398187e-06 3.63439560e-05 -6.11414243e-08] [ 9.35892357e-06 3.63382895e-05 -5.78845892e-08] [ 8.78688622e-10 -3.96234393e-05 6.20140429e-09] [ 9.56447561e-06 -3.62263562e-05 7.91314518e-09] [-9.56562911e-06 -3.62246665e-05 7.30251303e-09] [-3.92938238e-10 6.29716831e-05 2.18206393e-05] [ 2.55045984e-11 -6.29718275e-05 2.18214564e-05] [-2.70890921e-10 -6.29717558e-05 -2.18211092e-05] [ 2.16173940e-10 6.29717951e-05 -2.18288250e-05] [-3.96415956e-10 -5.59689550e-06 1.41070108e-05] [-7.81142739e-11 5.59640986e-06 1.41050718e-05] [ 3.62222652e-11 5.59652134e-06 -1.41040909e-05] [-3.93444832e-10 -5.59693946e-06 -1.41122829e-05]] Final stress: [ 8.23376233e-05 1.19348210e-04 6.61157044e-05 -6.16484873e-12 -1.01695911e-11 -1.29788301e-12] Minimization converged after 27 steps. Minimization converged after 9 steps. Minimization converged after 6 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.95737924e-05 6.78367536e-04 1.99460157e-05] [-1.95738064e-05 -6.78367558e-04 1.99200482e-05] [-1.95738136e-05 -6.78367530e-04 -1.99282391e-05] [ 1.95738240e-05 6.78367527e-04 -1.99339498e-05] [ 1.13646994e-11 7.66051705e-09 2.71931694e-09] [-6.63621998e-09 -3.82382653e-09 2.71764300e-09] [ 6.63628252e-09 -3.82906556e-09 2.70983094e-09] [-1.73794605e-11 1.25683031e-08 -3.94604338e-09] [-1.08239129e-08 -6.27826779e-09 -3.91768185e-09] [ 1.08579176e-08 -6.29353897e-09 -3.92762987e-09] [-3.64868066e-05 5.62806590e-04 1.76110800e-09] [ 1.94549388e-04 7.17262699e-05 1.75191544e-09] [-3.05188542e-04 8.96023790e-05 1.73348403e-09] [ 3.64867858e-05 -5.62795173e-04 -1.87520866e-09] [-1.94559249e-04 -7.17319688e-05 -1.85656881e-09] [ 3.05198413e-04 -8.96080721e-05 -1.89616239e-09] [-1.01845173e-04 -3.23564094e-05 1.91935341e-04] [ 1.01845175e-04 3.23564060e-05 1.91935287e-04] [ 1.01845178e-04 3.23564091e-05 -1.91935510e-04] [-1.01845178e-04 -3.23564113e-05 -1.91935099e-04] [ 4.63899921e-05 -2.36907462e-05 2.57967054e-04] [-4.63899987e-05 2.36907469e-05 2.57966687e-04] [-4.63900005e-05 2.36907491e-05 -2.57966792e-04] [ 4.63899909e-05 -2.36907481e-05 -2.57966817e-04]] Final stress: [ 2.06487549e-05 1.85565011e-05 -6.28717124e-06 -4.55753250e-14 4.49916057e-14 3.48514641e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-2.57084108e-05 1.16945898e-03 1.82447695e-04] [ 2.57084476e-05 -1.16945898e-03 1.82442947e-04] [ 2.57083683e-05 -1.16945900e-03 -1.82451586e-04] [-2.57084147e-05 1.16945899e-03 -1.82439317e-04] [-2.64195848e-11 -1.58594549e-09 -5.16547694e-10] [ 1.39957541e-09 8.24287374e-10 -5.30023803e-10] [-1.37317890e-09 7.49756812e-10 -4.99907005e-10] [-1.30814378e-11 6.15388851e-10 2.42285303e-10] [-5.20892329e-10 -3.50708240e-10 2.54972599e-10] [ 5.57588864e-10 -2.62658784e-10 2.52038501e-10] [ 1.55286412e-04 4.70982283e-04 1.60289669e-09] [ 8.96270786e-05 3.19394292e-04 1.65676180e-09] [ 1.18165047e-04 4.15332271e-04 1.58950986e-09] [-1.55286421e-04 -4.70989804e-04 -1.33206156e-09] [-8.96205619e-05 -3.19390492e-04 -1.34763298e-09] [-1.18171559e-04 -4.15328537e-04 -1.32617140e-09] [ 2.01768826e-04 -4.06722363e-04 7.95601480e-04] [-2.01768826e-04 4.06722364e-04 7.95601180e-04] [-2.01768831e-04 4.06722360e-04 -7.95601326e-04] [ 2.01768828e-04 -4.06722365e-04 -7.95601261e-04] [-1.17729996e-05 2.04734111e-05 1.06648009e-05] [ 1.17729963e-05 -2.04734076e-05 1.06646273e-05] [ 1.17729958e-05 -2.04734105e-05 -1.06647055e-05] [-1.17729987e-05 2.04734126e-05 -1.06645817e-05]] Final stress: [ 2.24798542e-05 6.65349536e-06 -4.16287525e-05 2.40021687e-13 9.57792976e-14 -1.22505272e-05] Minimization converged after 29 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 28 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 177 steps. Minimization converged after 173 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 9 steps. Minimization converged after 12 steps. Minimization converged after 7 steps. Minimization converged after 7 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 15 steps. Final forces: [[ 1.29687798e-05 -4.10091077e-04 5.09216791e-06] [-1.29658072e-05 4.10092097e-04 1.29269931e-05] [-1.29614873e-05 4.10087570e-04 -1.53458192e-05] [ 1.29643055e-05 -4.10090478e-04 -9.94456398e-06] [ 8.18552698e-10 -1.33181157e-06 -5.19595371e-07] [ 1.15032676e-06 6.64346098e-07 -5.18514458e-07] [-1.15177470e-06 6.66003894e-07 -5.17038785e-07] [ 2.14524890e-09 -7.63144908e-06 2.37465520e-06] [ 6.61142587e-06 3.81287034e-06 2.37747211e-06] [-6.62283391e-06 3.82184079e-06 2.37904606e-06] [-5.82068131e-05 -3.62724775e-04 6.84485961e-08] [-1.54092162e-04 -3.54559627e-05 6.99252263e-08] [ 7.47887400e-05 -5.77250406e-05 7.26723005e-08] [ 5.82078565e-05 3.58700905e-04 5.06666393e-07] [ 1.57577891e-04 3.74670297e-05 5.04512855e-07] [-7.82768067e-05 5.97386938e-05 5.07297378e-07] [-3.96846133e-05 -5.45279960e-05 1.13523629e-04] [ 3.96845632e-05 5.45278869e-05 1.13489231e-04] [ 3.96848536e-05 5.45282269e-05 -1.13435235e-04] [-3.96846212e-05 -5.45286866e-05 -1.13525585e-04] [ 1.36764352e-05 1.27196611e-05 7.17564343e-05] [-1.36739453e-05 -1.27196914e-05 7.18680338e-05] [-1.36718631e-05 -1.27198825e-05 -7.18907181e-05] [ 1.36745861e-05 1.27197177e-05 -7.18201155e-05]] Final stress: [ 1.64372441e-05 1.65025231e-05 2.78858621e-06 1.09126902e-11 -7.17870352e-12 7.47260831e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-8.52985943e-06 -1.03464112e-04 -9.02608868e-07] [ 8.52996877e-06 1.03464058e-04 7.64388531e-07] [ 8.52999589e-06 1.03464182e-04 -7.38890983e-07] [-8.52997241e-06 -1.03464490e-04 3.56497586e-07] [-1.08700675e-10 -5.17946679e-07 -1.96241419e-07] [ 4.50338854e-07 2.59388520e-07 -1.96848442e-07] [-4.50096888e-07 2.59147355e-07 -1.96914487e-07] [ 1.67868174e-10 -1.00886774e-06 3.34929493e-07] [ 8.72894763e-07 5.04164170e-07 3.34397070e-07] [-8.73128134e-07 5.04459245e-07 3.34882148e-07] [ 2.18403937e-05 -1.89114505e-05 -3.26128749e-08] [ 3.58812526e-05 -4.52448663e-05 -3.23967534e-08] [-3.98560546e-06 -3.84035418e-05 -3.24795923e-08] [-2.18405193e-05 1.76457285e-05 6.99404641e-08] [-3.47846484e-05 4.58778890e-05 6.98609597e-08] [ 2.88904338e-06 3.90363943e-05 6.98969239e-08] [ 2.76157654e-05 -3.96637935e-06 2.02539283e-05] [-2.76157301e-05 3.96634580e-06 2.02409318e-05] [-2.76157922e-05 3.96623140e-06 -2.02330169e-05] [ 2.76157983e-05 -3.96628819e-06 -2.02591692e-05] [-7.07833927e-06 -3.83524387e-06 6.63945840e-05] [ 7.07826956e-06 3.83522552e-06 6.64118637e-05] [ 7.07822425e-06 3.83523047e-06 -6.64112841e-05] [-7.07831302e-06 -3.83525793e-06 -6.64036375e-05]] Final stress: [ 1.55412579e-05 1.61376585e-05 8.25415281e-06 7.24046267e-13 7.39009213e-13 -1.59281793e-05] Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 8 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 9 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 5 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 6 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 2 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 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 5 steps. Minimization converged after 1 steps. Minimization converged after 3 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 0 steps. Minimization converged after 6 steps. Minimization converged after 0 steps. Minimization converged after 1 steps. Minimization converged after 4 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. 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]: [[ 1.10349 0.67203 0.60297 -0. 0. -0.00004] [ 0.67203 1.10082 0.60313 -0. 0. -0.00004] [ 0.60297 0.60313 1.11941 -0. -0. 0.00032] [-0. -0. -0. -0.21548 -0. 0. ] [ 0. 0. -0. -0. -0.21582 0. ] [-0.00004 -0.00004 0.00032 0. 0. 0.24919]] 95%% Error estimate [ASE units]: [[0.04616 0.02562 0.01666 0.00001 0.00001 0.00046] [0.02562 0.04869 0.01689 0.00001 0.00001 0.00046] [0.01666 0.01689 0.00203 0.00003 0.00002 0.00045] [0.00001 0.00001 0.00003 0.00178 0. 0. ] [0.00001 0.00001 0.00002 0. 0.00061 0. ] [0.00046 0.00046 0.00045 0. 0. 0.01916]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.024345 is too big compared to maximum elastic constant component 1.119412 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.033460 WARNING: Maximum deviation from material symmetry according to space group 194 is too big compared to maximum elastic constant component 1.119412 [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 3 steps. Minimization converged after 26 steps. Minimization converged after 19 steps. Minimization converged after 30 steps. Minimization converged after 20 steps. Minimization converged after 8 steps. Minimization converged after 11 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 28 steps. Minimization converged after 21 steps. Minimization converged after 31 steps. Minimization converged after 22 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 2.12298512e-11 3.88274381e-04 8.18782860e-07] [-1.12889399e-10 -3.88274505e-04 8.22189499e-07] [ 1.76252981e-12 -3.88274504e-04 -8.16356769e-07] [-4.56282234e-12 3.88274616e-04 -8.22352151e-07] [-5.02857706e-11 9.42473544e-10 1.81651916e-10] [-7.03645642e-10 -4.06893720e-10 1.46428480e-10] [ 8.41696768e-10 -5.47555223e-10 2.69958361e-10] [ 1.03694699e-11 1.21264954e-09 -5.69563618e-10] [-1.05626352e-09 -5.99416627e-10 -5.22235144e-10] [ 1.01672942e-09 -5.61992008e-10 -4.79749310e-10] [-1.24118937e-10 -5.72981714e-04 -1.03006435e-09] [ 1.07405481e-04 -6.43594164e-04 -1.08439524e-09] [-1.07405255e-04 -6.43594438e-04 -1.00022483e-09] [ 4.40529835e-11 5.72980886e-04 5.01385518e-10] [-1.07404864e-04 6.43594647e-04 7.38135533e-10] [ 1.07404783e-04 6.43594747e-04 7.25559949e-10] [-7.84947107e-12 -6.56245427e-04 -9.39022990e-04] [-1.20237154e-13 6.56245414e-04 -9.39022902e-04] [-5.74573722e-12 6.56245435e-04 9.39022978e-04] [ 5.94779781e-12 -6.56245418e-04 9.39022842e-04] [-1.39537271e-11 1.03264381e-03 1.68386805e-03] [ 1.40753013e-12 -1.03264382e-03 1.68386811e-03] [ 7.07361581e-12 -1.03264382e-03 -1.68386807e-03] [-1.57840407e-11 1.03264382e-03 -1.68386816e-03]] Final stress: [ 4.42056723e-03 2.51896212e-03 2.33131323e-03 -7.87270406e-13 -2.53282041e-13 -6.88575744e-14] Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 6.29291896e-11 -4.73047552e-04 7.02328286e-05] [-1.50434907e-10 4.73047386e-04 7.02378489e-05] [ 1.35870380e-10 4.73047505e-04 -7.02323968e-05] [-8.02481970e-11 -4.73047500e-04 -7.02325250e-05] [-1.38352906e-10 -4.50989396e-09 -1.37414291e-09] [ 4.28284924e-09 2.46412579e-09 -1.56903424e-09] [-3.94219390e-09 2.10827228e-09 -1.29132052e-09] [ 1.25544709e-10 -1.59141456e-09 1.82524773e-10] [ 1.32458222e-09 6.60319910e-10 1.09865117e-10] [-1.61756628e-09 9.71887903e-10 3.40221119e-10] [-1.39314671e-11 7.41130597e-04 -7.26292191e-10] [ 2.53372833e-04 4.86684887e-04 -9.25771176e-10] [-2.53372812e-04 4.86684859e-04 -7.36564541e-10] [ 2.27305952e-11 -7.41129082e-04 9.85585836e-11] [-2.53373851e-04 -4.86685596e-04 1.28228219e-10] [ 2.53373823e-04 -4.86685553e-04 1.60305611e-10] [-2.42763865e-11 1.35420973e-03 -1.10427246e-03] [ 1.57592828e-11 -1.35420974e-03 -1.10427238e-03] [-1.75057191e-11 -1.35420974e-03 1.10427239e-03] [ 2.29896380e-11 1.35420975e-03 1.10427235e-03] [ 1.66461289e-12 -1.09243052e-03 1.89655275e-03] [-4.45396915e-12 1.09243049e-03 1.89655290e-03] [ 7.28193108e-12 1.09243049e-03 -1.89655288e-03] [-6.51750875e-12 -1.09243052e-03 -1.89655281e-03]] Final stress: [ 2.50118511e-03 4.42703548e-03 2.33004102e-03 -4.25552401e-13 -4.18401000e-13 -3.41227080e-14] Minimization converged after 22 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 69 steps. Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.28634131e-10 1.55992558e-04 -2.42652239e-06] [-3.30766544e-11 -1.55992678e-04 -2.43159702e-06] [-7.98428232e-11 -1.55992589e-04 2.44041171e-06] [-2.88122026e-11 1.55992742e-04 2.43145595e-06] [-2.53635433e-11 3.65645580e-09 5.34507549e-10] [-3.26271576e-09 -1.83421312e-09 6.03788686e-10] [ 3.33949557e-09 -1.90830268e-09 6.77090162e-10] [-1.75042808e-10 9.71858349e-09 -3.29928107e-09] [-7.88087506e-09 -4.59982374e-09 -3.07565085e-09] [ 8.28165975e-09 -5.03534447e-09 -3.38164847e-09] [ 3.78947984e-11 -2.70803172e-04 -1.13719049e-09] [ 3.82868318e-05 -2.88334299e-04 -1.29890559e-09] [-3.82868697e-05 -2.88334232e-04 -1.28251880e-09] [-5.01609865e-11 2.70802848e-04 -6.09119834e-10] [-3.82865713e-05 2.88334475e-04 -4.79044891e-10] [ 3.82866807e-05 2.88334355e-04 -5.20151815e-10] [-3.86435328e-12 -3.09642346e-04 -3.90356979e-04] [-2.08620343e-11 3.09642329e-04 -3.90356941e-04] [-7.23032745e-13 3.09642357e-04 3.90356843e-04] [-1.93021987e-11 -3.09642346e-04 3.90356789e-04] [-2.91117130e-12 4.44858999e-04 7.18332189e-04] [-8.73004387e-12 -4.44859003e-04 7.18332045e-04] [-1.16842579e-11 -4.44859003e-04 -7.18332108e-04] [ 2.02388106e-12 4.44859008e-04 -7.18332317e-04]] Final stress: [ 2.79372823e-03 1.58887750e-03 1.46787156e-03 -8.11144788e-13 -1.49014901e-13 4.87182236e-14] Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 6.98435504e-10 1.82128759e-04 -3.29485020e-04] [-3.38400296e-10 -1.82129113e-04 -3.29435588e-04] [ 1.20873889e-10 -1.82129011e-04 3.29513576e-04] [ 2.93036873e-10 1.82129678e-04 3.29525014e-04] [ 2.13380349e-11 -6.40323293e-08 -2.12199647e-08] [ 5.45462251e-08 3.17091184e-08 -2.02281889e-08] [-5.45144827e-08 3.17140146e-08 -2.01491883e-08] [ 6.00002421e-10 2.36087863e-08 -7.75841691e-09] [-2.10029085e-08 -1.24778792e-08 -7.99979771e-09] [ 1.96098237e-08 -1.09829661e-08 -6.93104110e-09] [-6.91578017e-10 8.06361457e-04 -8.68743095e-09] [-1.49384531e-04 3.57938719e-04 -9.10174975e-09] [ 1.49385752e-04 3.57937220e-04 -8.90524544e-09] [ 9.12046161e-10 -8.06382251e-04 -2.46514769e-09] [ 1.49403163e-04 -3.57928512e-04 -1.93691915e-09] [-1.49404870e-04 -3.57926486e-04 -1.79984858e-09] [ 3.02138869e-12 1.21282045e-03 -1.44490333e-04] [ 6.51506071e-11 -1.21282043e-03 -1.44490223e-04] [-1.19073085e-11 -1.21282028e-03 1.44489991e-04] [ 8.52309057e-11 1.21282036e-03 1.44489200e-04] [-5.56128477e-11 -6.93275713e-04 8.42105481e-04] [ 1.00308058e-10 6.93275649e-04 8.42106219e-04] [ 1.28451000e-10 6.93275713e-04 -8.42105620e-04] [-8.24699198e-11 -6.93275746e-04 -8.42105513e-04]] Final stress: [ 1.59169765e-03 2.77251038e-03 1.43789803e-03 -2.46457089e-12 -1.60968406e-13 -6.68672535e-13] Minimization converged after 23 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 46 steps. Minimization converged after 47 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 77 steps. Minimization converged after 77 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 4.80700439e-05 1.44484523e-03 -3.03196375e-03] [ 7.81246749e-05 -1.44964487e-04 -3.45152026e-04] [-7.75736329e-06 2.10326938e-03 -3.24011813e-03] [ 2.57310040e-05 1.31670911e-04 -1.60779627e-04] [ 5.92823299e-05 1.49347712e-03 -2.63984381e-03] [ 3.25237463e-03 -8.44061653e-04 7.94268863e-04] [-3.39610506e-03 -6.87308369e-04 6.77920020e-04] [-4.71912336e-05 -2.33344574e-03 -8.92593219e-04] [ 2.58450314e-04 -1.29413523e-05 9.00132930e-04] [-2.26332308e-04 -7.25687281e-05 9.26702410e-04] [ 3.26640470e-05 -2.06919355e-03 1.51256856e-03] [ 2.12785335e-04 7.00618293e-04 1.02594038e-03] [-2.80209553e-04 7.71178723e-04 9.58415340e-04] [ 1.70787690e-05 -1.97618466e-03 2.62870558e-04] [ 1.28052154e-04 6.42902840e-04 1.42097401e-03] [-1.78907207e-04 7.09909227e-04 1.46823511e-03] [ 8.81915845e-06 -5.64727703e-04 1.79622445e-04] [-2.85696933e-06 -1.03126623e-05 2.20106448e-06] [ 4.43602737e-06 -3.74571819e-04 -4.87833279e-05] [-8.36070048e-06 7.91497158e-05 1.49689231e-04] [ 9.61966805e-06 2.40059307e-04 2.96632266e-04] [ 6.27153805e-06 3.98288975e-04 -2.73103613e-04] [ 3.20678538e-06 1.58987344e-04 -1.54935459e-04] [ 2.75392308e-06 2.15923656e-04 2.11099783e-04]] Final stress: [-3.83652753e-04 -8.46607139e-05 -1.85240693e-04 -9.94813226e-04 2.95293483e-07 3.80636357e-08] Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.13499118e-05 -2.96728268e-04 -4.05415721e-05] [-6.13399187e-05 2.96725534e-04 -3.87732186e-05] [ 6.13315964e-05 2.96717983e-04 3.44139236e-05] [ 6.13371824e-05 -2.96722183e-04 3.55741478e-05] [-4.42295399e-09 3.39989236e-06 9.11416921e-07] [-2.94613703e-06 -1.69998137e-06 8.90131084e-07] [ 2.95364345e-06 -1.70936188e-06 9.26144962e-07] [-8.11915058e-09 -5.69845372e-06 1.61848488e-06] [ 4.96287263e-06 2.86929425e-06 1.65241941e-06] [-4.94418697e-06 2.84921126e-06 1.58282202e-06] [ 1.76749515e-09 1.07950929e-03 2.56563810e-07] [-2.60121522e-04 1.38664918e-03 -2.82528887e-05] [ 2.60124281e-04 1.38664976e-03 2.87707206e-05] [ 1.38078277e-09 -1.07999790e-03 3.66724587e-07] [ 2.60553086e-04 -1.38640261e-03 2.88832984e-05] [-2.60545699e-04 -1.38640507e-03 -2.81483580e-05] [ 4.38797890e-04 -2.91632214e-04 1.21638794e-03] [ 4.38795984e-04 2.91632200e-04 1.21638758e-03] [-4.38798609e-04 2.91630530e-04 -1.21636130e-03] [-4.38799790e-04 -2.91630980e-04 -1.21637567e-03] [-9.01275364e-04 -6.41016395e-04 4.27431473e-04] [-9.01274540e-04 6.41013654e-04 4.27462747e-04] [ 9.01273617e-04 6.41002341e-04 -4.27542380e-04] [ 9.01274921e-04 -6.41005457e-04 -4.27521151e-04]] Final stress: [ 1.13646274e-04 -6.89814967e-05 5.77946648e-06 1.14473277e-11 -7.95594404e-04 1.95799159e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 6.12914972e-05 -2.96666488e-04 -3.95488496e-05] [ 6.12712652e-05 2.96660318e-04 -3.65800289e-05] [-6.12966377e-05 2.96665374e-04 3.84613125e-05] [-6.12688356e-05 -2.96662326e-04 3.57567503e-05] [ 1.15546958e-09 5.56135219e-07 1.63504899e-07] [-4.82219965e-07 -2.79480521e-07 1.64314215e-07] [ 4.80584697e-07 -2.77161134e-07 1.58499602e-07] [-1.14955493e-09 -1.49351076e-06 3.81352608e-07] [ 1.30292007e-06 7.51138608e-07 3.75836314e-07] [-1.29905686e-06 7.47566480e-07 3.86157795e-07] [-8.20032947e-09 1.08008669e-03 -4.51453645e-07] [-2.60514758e-04 1.38627831e-03 2.80158914e-05] [ 2.60547191e-04 1.38625042e-03 -2.89281518e-05] [ 4.95477637e-09 -1.07922945e-03 5.61491131e-07] [ 2.59769996e-04 -1.38670373e-03 -2.79070357e-05] [-2.59798121e-04 -1.38668206e-03 2.90335264e-05] [-4.38636687e-04 -2.91612332e-04 1.21618459e-03] [-4.38635530e-04 2.91613733e-04 1.21626317e-03] [ 4.38638971e-04 2.91612397e-04 -1.21619659e-03] [ 4.38633432e-04 -2.91613056e-04 -1.21624860e-03] [ 9.01451867e-04 -6.41028637e-04 4.27461356e-04] [ 9.01456944e-04 6.41028602e-04 4.27524607e-04] [-9.01454011e-04 6.41024853e-04 -4.27500518e-04] [-9.01455572e-04 -6.41027313e-04 -4.27531130e-04]] Final stress: [ 1.13641241e-04 -6.89755851e-05 5.78812241e-06 4.24980697e-11 7.95584884e-04 -2.18234671e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[ 1.02788028e-01 -1.49737307e-02 2.18891358e-01] [-1.02788023e-01 1.49741337e-02 2.19149679e-01] [-1.02788369e-01 1.49732032e-02 -2.18847742e-01] [ 1.02789461e-01 -1.49738114e-02 -2.19268179e-01] [ 7.70928715e-08 8.68918693e-05 2.58363855e-05] [-7.48876928e-05 -4.40802840e-05 2.43199696e-05] [ 7.29334093e-05 -4.27483930e-05 2.34895245e-05] [ 2.65048879e-07 -1.88781139e-05 -6.86830325e-07] [ 1.64668443e-05 9.32553652e-06 -1.06412658e-06] [-1.67589054e-05 9.88938255e-06 -5.54070785e-07] [ 3.28445852e-01 7.97780352e-02 -6.22574042e-05] [-2.50460251e-01 1.70884001e-01 -6.26665995e-05] [-8.53091756e-02 -3.70023761e-01 -6.51267411e-05] [-3.28447211e-01 -7.96776901e-02 6.30813516e-05] [ 2.50376226e-01 -1.70933342e-01 6.43542796e-05] [ 8.53948487e-02 3.69974393e-01 6.62574007e-05] [ 2.01479593e-02 9.36593021e-02 -1.74869517e-01] [-2.01481393e-02 -9.36610935e-02 -1.74859616e-01] [-2.01481088e-02 -9.36601236e-02 1.74869047e-01] [ 2.01480308e-02 9.36604537e-02 1.74860669e-01] [ 6.35765346e-02 -3.89104429e-02 3.13488153e-01] [-6.35757223e-02 3.89099680e-02 3.13484896e-01] [-6.35764203e-02 3.89103224e-02 -3.13488550e-01] [ 6.35763847e-02 -3.89102181e-02 -3.13485181e-01]] Final stress: [5.54128779e-03 8.68849622e-03 4.20104746e-05 3.32561535e-09 2.72845657e-08 2.75748951e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 78 steps. Final forces: [[ 2.78013928e-04 7.14869206e-04 -6.85248846e-04] [-2.40815837e-04 6.68685302e-04 1.19403247e-03] [-2.58623411e-04 -6.21630621e-04 -1.84039789e-03] [-1.90742100e-04 -1.34537684e-03 1.54600769e-03] [-1.02222885e-04 9.77171541e-05 -6.96147465e-04] [ 3.77873752e-04 3.25228559e-04 -4.11454413e-04] [-3.65182015e-05 -5.81260176e-05 -2.87638236e-04] [-3.56770048e-04 -3.89660461e-04 -2.81352673e-04] [ 7.96511397e-04 6.11380607e-04 6.85184771e-04] [-2.19955808e-04 -9.01749250e-05 1.19306056e-04] [ 1.63806990e-04 -1.16954089e-03 6.77257108e-04] [ 9.29289318e-04 -5.57505292e-04 3.70953913e-04] [-7.96751927e-04 1.43567171e-03 -3.54256352e-04] [-1.05110241e-03 -4.68839787e-04 7.78837278e-04] [ 1.04482272e-03 4.52937837e-04 4.57712054e-04] [-3.75590474e-04 3.41646110e-04 -6.28819424e-04] [ 1.25044415e-04 7.54545613e-04 2.18797527e-05] [-2.79234533e-04 -8.77669331e-04 6.18885748e-05] [ 2.53387822e-04 7.64691991e-04 5.52189433e-05] [-3.41765124e-04 -7.97724960e-04 -8.04302024e-06] [ 1.91739414e-04 4.70055277e-04 -1.93060094e-04] [-2.78020609e-06 -2.85293874e-04 -2.75190988e-04] [ 1.97809898e-04 4.54624265e-04 2.80275803e-04] [-1.05426687e-04 -4.30510629e-04 -5.86945020e-04]] Final stress: [ 3.61675004e-02 3.61576482e-02 1.44660762e-01 5.77192400e-06 6.82084379e-07 -1.18134069e-03] Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 29 steps. Minimization converged after 25 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[-4.62979326e-06 -8.56186311e-05 -1.00745787e-05] [-4.62957354e-06 8.56186740e-05 -9.97622927e-06] [ 4.63031508e-06 8.56188109e-05 1.00837894e-05] [ 4.62962759e-06 -8.56184291e-05 9.99212169e-06] [ 2.04819421e-10 9.15531534e-09 -6.76677603e-10] [-8.06128898e-09 -4.84393572e-09 -4.65806810e-10] [ 7.71393488e-09 -4.40459413e-09 -6.21064561e-10] [ 3.92417468e-11 -9.05865938e-09 1.08978382e-11] [ 7.06685654e-09 4.28464875e-09 -4.69186690e-10] [-7.38068751e-09 4.51160859e-09 -9.69457327e-11] [ 1.90585325e-10 8.36600428e-05 -2.02314780e-08] [-1.18094305e-04 3.33809061e-04 2.24487093e-06] [ 1.18093508e-04 3.33809730e-04 -2.28540609e-06] [-6.48573972e-11 -8.36684506e-05 1.35991789e-08] [ 1.18101075e-04 -3.33805134e-04 -2.25152992e-06] [-1.18100707e-04 -3.33805407e-04 2.27925656e-06] [ 2.24112176e-05 -1.45047444e-04 1.14006789e-04] [ 2.24111438e-05 1.45047453e-04 1.14008848e-04] [-2.24111694e-05 1.45047437e-04 -1.14007341e-04] [-2.24111100e-05 -1.45047413e-04 -1.14009656e-04] [-2.95544264e-05 -1.30704779e-04 1.93968999e-04] [-2.95544941e-05 1.30704809e-04 1.93970547e-04] [ 2.95544597e-05 1.30704802e-04 -1.93969940e-04] [ 2.95545230e-05 -1.30704776e-04 -1.93971589e-04]] Final stress: [ 4.23277896e-05 -1.25025719e-06 2.87918907e-05 -5.76538452e-13 -4.25403739e-04 4.55824570e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 4.62142383e-06 -8.52478448e-05 -9.66656025e-06] [ 4.62079482e-06 8.52476819e-05 -9.58208157e-06] [-4.62148974e-06 8.52474975e-05 9.67422732e-06] [-4.62134994e-06 -8.52476086e-05 9.59611465e-06] [ 3.82943216e-11 5.17925158e-09 -1.14334259e-09] [-4.16107791e-09 -2.55008394e-09 -1.32442046e-09] [ 4.38430908e-09 -2.63505295e-09 -9.19792548e-10] [-2.67261489e-10 -8.13489098e-09 -1.17904797e-10] [ 8.02656763e-09 4.51389326e-09 3.34977379e-10] [-7.54709201e-09 3.92396432e-09 1.13092868e-10] [-1.42780954e-10 8.24457779e-05 -1.72761905e-08] [-1.18977126e-04 3.34057264e-04 -2.29124092e-06] [ 1.18977795e-04 3.34056708e-04 2.25688336e-06] [ 5.63107894e-11 -8.24484363e-05 1.18258644e-08] [ 1.18979897e-04 -3.34055732e-04 2.28572066e-06] [-1.18980197e-04 -3.34055483e-04 -2.26180813e-06] [-2.22959815e-05 -1.44857812e-04 1.14543875e-04] [-2.22959329e-05 1.44857767e-04 1.14545705e-04] [ 2.22959535e-05 1.44857791e-04 -1.14544386e-04] [ 2.22958890e-05 -1.44857844e-04 -1.14546301e-04] [ 2.90969519e-05 -1.30810113e-04 1.94399345e-04] [ 2.90969909e-05 1.30810107e-04 1.94400742e-04] [-2.90969677e-05 1.30810087e-04 -1.94400195e-04] [-2.90970387e-05 -1.30810105e-04 -1.94401534e-04]] Final stress: [ 4.23527289e-05 -1.24355791e-06 2.87526210e-05 1.87123319e-13 4.25414762e-04 -3.92581916e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 5.76105990e-03 4.73132733e-03 5.00937120e-03] [-5.75855115e-03 -4.73131903e-03 5.29703317e-03] [-5.76089439e-03 -4.73164457e-03 -4.97852355e-03] [ 5.76111789e-03 4.73113639e-03 -5.45889045e-03] [ 1.49284941e-06 1.06426491e-04 3.17064217e-05] [-9.30131643e-05 -5.47634635e-05 3.26453469e-05] [ 9.01497187e-05 -5.13502732e-05 2.93363271e-05] [ 3.03132042e-07 -8.59681215e-05 1.30332064e-05] [ 7.49577472e-05 4.28366379e-05 1.33966404e-05] [-7.54128360e-05 4.34465474e-05 1.26360296e-05] [ 5.01660601e-02 -4.70956182e-03 -6.83056365e-05] [-2.08587121e-02 3.69310915e-02 -6.81245798e-05] [-2.46386008e-02 -4.83033284e-02 -6.93611816e-05] [-5.01656934e-02 4.90931803e-03 7.00336585e-05] [ 2.06844615e-02 -3.70315747e-02 7.03187802e-05] [ 2.48110242e-02 4.82046261e-02 7.02376715e-05] [ 2.64673588e-04 1.08687810e-02 -7.99434964e-03] [-2.65351309e-04 -1.08695482e-02 -7.98184817e-03] [-2.64440376e-04 -1.08692989e-02 7.99080129e-03] [ 2.64893273e-04 1.08692269e-02 7.98453972e-03] [ 5.68261992e-04 -1.34572380e-03 5.36885777e-03] [-5.68578746e-04 1.34560716e-03 5.37501667e-03] [-5.67456771e-04 1.34587903e-03 -5.37242654e-03] [ 5.68249176e-04 -1.34562179e-03 -5.37713415e-03]] Final stress: [-6.44470630e-04 4.35361284e-04 3.06278467e-05 4.70955238e-10 -1.68965391e-08 3.67203497e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-3.07037973e-02 -1.86069929e-02 3.95836172e-02] [ 3.06752324e-02 1.86187434e-02 4.15675273e-02] [ 3.06779013e-02 1.86142989e-02 -4.22053887e-02] [-3.06750414e-02 -1.86300131e-02 -4.46935310e-02] [-1.21563760e-06 1.64705567e-03 5.69678625e-04] [-1.41570546e-03 -8.21519541e-04 5.23084458e-04] [ 1.40177022e-03 -8.15615477e-04 5.39925595e-04] [-8.61720397e-06 -3.81511515e-03 1.00310889e-03] [ 3.30472184e-03 1.92220270e-03 9.18457764e-04] [-3.26032509e-03 1.88648679e-03 9.46885270e-04] [-1.73720294e-01 3.49462791e-02 -2.04688155e-04] [ 2.66396262e-02 -1.02021009e-01 -2.10609777e-04] [ 5.84261970e-02 6.31393003e-02 -1.98962704e-04] [ 1.73779982e-01 -3.16648711e-02 6.21781805e-04] [-2.95208224e-02 1.00362392e-01 6.28049588e-04] [-5.56060053e-02 -6.47417798e-02 6.00977332e-04] [-6.55234596e-03 2.37944355e-02 -4.85555052e-02] [ 6.56825352e-03 -2.38072680e-02 -4.84377391e-02] [ 6.55590733e-03 -2.38048532e-02 4.85347582e-02] [-6.55284109e-03 2.37993651e-02 4.85359128e-02] [ 2.99642913e-02 3.75515219e-04 4.44558986e-02] [-2.99630164e-02 -3.77386974e-04 4.45098742e-02] [-2.99960682e-02 -3.75468757e-04 -4.45261113e-02] [ 2.99822122e-02 3.75818107e-04 -4.45070017e-02]] Final stress: [-1.18318011e-03 1.18159467e-03 -3.20598352e-04 -5.90761569e-08 9.00104226e-08 -6.00045283e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-7.41794293e-10 7.44757377e-04 -3.42865152e-04] [ 4.31820830e-10 -7.44756833e-04 -3.42750721e-04] [ 6.71507376e-10 -7.44753447e-04 3.42963026e-04] [ 1.09783888e-09 7.44756265e-04 3.42843690e-04] [ 9.03732132e-10 -3.15931291e-08 -1.62081030e-08] [ 2.69678226e-08 1.47013110e-08 -1.57819252e-08] [-2.91725326e-08 1.69969272e-08 -1.75496679e-08] [ 3.09652867e-09 4.97154393e-08 -1.87236360e-08] [-4.95150894e-08 -2.84537656e-08 -2.11693031e-08] [ 4.58587489e-08 -2.27947871e-08 -2.06677937e-08] [ 5.10978482e-10 -6.90707068e-05 -3.12923743e-08] [ 7.23640703e-05 -2.02851052e-04 -3.47333370e-08] [-7.23651054e-05 -2.02849917e-04 -3.41560172e-08] [ 4.14570100e-10 6.90567343e-05 9.16522522e-09] [-7.23624569e-05 2.02855538e-04 9.05449554e-09] [ 7.23619931e-05 2.02856274e-04 7.38960180e-09] [ 7.35651817e-11 -5.19476313e-05 3.07427044e-04] [ 3.12982584e-10 5.19476574e-05 3.07429735e-04] [ 1.71179182e-10 5.19472692e-05 -3.07428989e-04] [ 3.97003014e-10 -5.19469339e-05 -3.07431718e-04] [-9.82549042e-11 4.82442416e-05 -4.74679195e-04] [ 5.71875734e-11 -4.82438913e-05 -4.74677715e-04] [-5.94547579e-11 -4.82439459e-05 4.74678546e-04] [ 1.20457699e-10 4.82444282e-05 4.74676122e-04]] Final stress: [ 6.28988035e-04 4.28124814e-04 3.45360989e-04 -9.25776224e-12 -5.85297961e-12 -3.43788434e-13] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-4.66063299e-12 -5.06037644e-05 9.30396129e-05] [-1.44869674e-10 5.06036883e-05 9.30582929e-05] [ 6.22449693e-11 5.06037334e-05 -9.30439788e-05] [ 7.09419745e-11 -5.06038279e-05 -9.30456939e-05] [ 4.21627598e-11 -6.14528506e-09 -2.30676023e-09] [ 5.30174481e-09 3.06031327e-09 -2.37990072e-09] [-5.37279504e-09 3.15118831e-09 -2.40631487e-09] [-9.34679217e-12 -1.88984273e-09 6.12427997e-10] [ 1.76662895e-09 9.70477587e-10 6.46606546e-10] [-1.77864129e-09 9.69093972e-10 6.85021106e-10] [-1.48464352e-10 3.49813834e-04 -2.28226373e-09] [-2.64720130e-05 -5.53547951e-05 -2.44836527e-09] [ 2.64722793e-05 -5.53551165e-05 -2.19929969e-09] [ 3.53156948e-11 -3.49822814e-04 1.39967529e-09] [ 2.64800948e-05 5.53594471e-05 1.36377694e-09] [-2.64801697e-05 5.53595317e-05 1.30482237e-09] [-4.74648099e-12 5.35684024e-05 -4.92619619e-05] [-3.85297350e-12 -5.35684023e-05 -4.92618639e-05] [ 5.98227023e-12 -5.35683992e-05 4.92620299e-05] [ 1.07156506e-11 5.35683955e-05 4.92616532e-05] [-1.83013604e-11 -8.73257318e-05 1.10422424e-04] [ 3.57436455e-12 8.73257180e-05 1.10422647e-04] [ 7.25786263e-12 8.73257214e-05 -1.10422516e-04] [-1.23648869e-11 -8.73257367e-05 -1.10422635e-04]] Final stress: [ 4.03107610e-04 6.98716926e-04 3.65929265e-04 8.30195306e-14 -8.15249490e-13 -6.94504920e-14] Minimization converged after 27 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 52 steps. Minimization converged after 55 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-6.18382239e-05 8.57740125e-04 4.22185635e-04] [ 6.18382156e-05 -8.57740130e-04 4.22184228e-04] [ 6.18382255e-05 -8.57740144e-04 -4.22185169e-04] [-6.18382165e-05 8.57740137e-04 -4.22184047e-04] [ 1.26763682e-12 -3.95516953e-12 -5.44325696e-12] [ 4.70309902e-12 1.81232807e-12 -5.40767431e-12] [-5.07643927e-12 1.96098693e-12 -6.80053236e-12] [-3.07302361e-12 7.56421370e-10 -1.94133154e-10] [-6.57265131e-10 -3.69116071e-10 -1.88325355e-10] [ 6.60715815e-10 -3.76198461e-10 -1.90457341e-10] [-9.58681612e-05 -2.01845793e-04 2.11158137e-10] [-5.90673401e-04 1.33401372e-04 2.15130612e-10] [ 3.74693760e-04 9.94869852e-05 2.22952172e-10] [ 9.58681628e-05 2.01845164e-04 -2.46952125e-10] [ 5.90673940e-04 -1.33401057e-04 -2.35584649e-10] [-3.74694303e-04 -9.94866695e-05 -2.43523648e-10] [-2.30878598e-04 1.33736627e-04 7.65262854e-05] [ 2.30878598e-04 -1.33736626e-04 7.65262462e-05] [ 2.30878599e-04 -1.33736626e-04 -7.65262750e-05] [-2.30878598e-04 1.33736627e-04 -7.65262547e-05] [ 1.51699296e-04 -2.23975313e-05 -2.20781377e-04] [-1.51699296e-04 2.23975302e-05 -2.20781410e-04] [-1.51699296e-04 2.23975294e-05 2.20781399e-04] [ 1.51699296e-04 -2.23975303e-05 2.20781408e-04]] Final stress: [ 3.98569052e-06 1.54826897e-05 6.67788479e-06 -9.51216186e-15 -2.24444269e-14 2.91032232e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 6.02961287e-05 8.50819762e-04 4.15674937e-04] [-6.02961253e-05 -8.50819762e-04 4.15673222e-04] [-6.02961410e-05 -8.50819765e-04 -4.15674054e-04] [ 6.02961309e-05 8.50819769e-04 -4.15673376e-04] [-6.29684000e-12 -1.84539828e-10 -1.65841230e-11] [ 1.65733025e-10 9.21646093e-11 -1.41037182e-11] [-1.58354274e-10 8.96256958e-11 -1.33345002e-11] [ 8.00031352e-12 7.40960182e-10 -2.14131046e-10] [-6.43545439e-10 -3.74212217e-10 -2.12332818e-10] [ 6.41034337e-10 -3.65928510e-10 -2.18435769e-10] [ 9.64270567e-05 -2.01036275e-04 2.02833090e-10] [-3.68765538e-04 9.63245380e-05 2.11917994e-10] [ 5.83989227e-04 1.31216901e-04 1.96699094e-10] [-9.64270559e-05 2.01036777e-04 -2.30207185e-10] [ 3.68765102e-04 -9.63247916e-05 -2.24004031e-10] [-5.83988792e-04 -1.31217152e-04 -2.26674499e-10] [ 2.30281709e-04 1.33531590e-04 7.64021954e-05] [-2.30281709e-04 -1.33531591e-04 7.64021759e-05] [-2.30281709e-04 -1.33531591e-04 -7.64022018e-05] [ 2.30281709e-04 1.33531590e-04 -7.64021657e-05] [-1.51507887e-04 -2.28499928e-05 -2.20226981e-04] [ 1.51507887e-04 2.28499930e-05 -2.20227005e-04] [ 1.51507886e-04 2.28499927e-05 2.20226997e-04] [-1.51507887e-04 -2.28499923e-05 2.20227014e-04]] Final stress: [ 3.98017780e-06 1.55043810e-05 6.70906825e-06 -1.33988296e-14 2.22841095e-14 -2.91035334e-04] Minimization converged after 29 steps. Minimization converged after 32 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 1.83114977e-03 6.08593835e-03 -4.57406821e-04] [ 8.90515026e-04 3.51953060e-04 -1.75984085e-03] [ 1.50157289e-03 1.83397895e-04 7.01804526e-05] [ 9.54458566e-04 -8.60703170e-03 5.23863505e-04] [-2.19795975e-03 3.08849563e-03 -6.02808272e-03] [-4.45902916e-04 2.48774990e-03 2.49345133e-03] [ 1.31310172e-03 1.52754038e-03 1.11118097e-03] [-2.22402819e-03 -8.66772564e-05 -2.82915209e-03] [-6.71308290e-04 5.06657492e-04 1.24749569e-03] [ 1.58124428e-03 -1.01328452e-03 3.72392212e-03] [ 1.00683105e-03 -2.61606608e-03 -5.35652394e-03] [-2.33397280e-03 -7.03116268e-04 3.29566387e-04] [ 1.53566632e-04 6.44667700e-04 1.34224899e-03] [ 6.51766203e-04 -2.66554123e-03 7.11307322e-03] [-3.98269598e-03 -1.30820238e-03 -1.57883312e-03] [ 1.73512956e-03 2.58093645e-03 -2.85045724e-04] [-2.64942505e-04 2.53913030e-04 3.28315018e-04] [-1.41429669e-04 6.30317848e-04 -1.82782577e-04] [-2.51733945e-04 -8.41525919e-04 -2.15087509e-04] [-1.73030778e-04 -1.52376754e-04 6.28009405e-06] [ 2.22174721e-04 -1.03621748e-04 1.85947164e-03] [ 3.31705546e-04 -3.79055495e-04 -1.57078911e-03] [ 2.34287745e-04 2.50677902e-04 -1.61080843e-03] [ 2.79501108e-04 -1.15746292e-04 1.72530347e-03]] Final stress: [-3.36090093e-04 -8.76247154e-05 -2.12173216e-04 -2.31272380e-04 7.36716229e-07 2.81168915e-06] Minimization converged after 56 steps. Minimization converged after 45 steps. Minimization converged after 48 steps. Minimization converged after 184 steps. Minimization converged after 188 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-4.95318453e-10 1.35932220e-05 -2.22086804e-05] [ 1.13734084e-10 -1.35937144e-05 -2.21886443e-05] [ 1.24744031e-10 -1.35939996e-05 2.22583015e-05] [ 7.26570193e-11 1.35937754e-05 2.22292144e-05] [ 6.23743890e-10 -2.67720552e-08 -9.91811266e-09] [ 2.19667925e-08 1.25781620e-08 -9.32912786e-09] [-2.30644034e-08 1.39272662e-08 -9.91732493e-09] [-5.94839159e-10 3.15418989e-08 -1.10458612e-08] [-2.62878803e-08 -1.48563684e-08 -1.00737461e-08] [ 2.74956831e-08 -1.62234864e-08 -1.08655355e-08] [ 5.12915377e-10 -8.20739279e-05 -9.04637987e-09] [-4.75031564e-05 6.71167022e-07 -9.24738986e-09] [ 4.75022838e-05 6.72261810e-07 -8.77683647e-09] [-5.22975885e-10 8.20884522e-05 -3.84171062e-10] [ 4.74925039e-05 -6.78067719e-07 -1.20554513e-11] [-4.74915596e-05 -6.79215920e-07 -1.71128869e-10] [ 4.75443018e-11 -3.63022085e-05 -2.90339493e-05] [-6.77397027e-11 3.63022299e-05 -2.90330926e-05] [ 8.25151059e-11 3.63022803e-05 2.90330528e-05] [-5.16704179e-11 -3.63022329e-05 2.90327683e-05] [ 3.73462927e-11 3.50562172e-05 -5.15880072e-06] [-6.12791751e-11 -3.50563309e-05 -5.15853113e-06] [-6.77901406e-11 -3.50563639e-05 5.15885167e-06] [ 6.45387077e-11 3.50562605e-05 5.15829744e-06]] Final stress: [ 2.80738789e-04 1.66117627e-04 1.51535999e-04 -8.04506764e-13 -1.66071409e-12 4.98003705e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-8.19946833e-10 -1.14345144e-05 3.82994682e-06] [-3.22152833e-10 1.14343014e-05 3.81261141e-06] [-1.29974651e-09 1.14340203e-05 -3.77259380e-06] [ 8.92750318e-11 -1.14345042e-05 -3.82742598e-06] [-1.34037955e-10 2.13875750e-08 4.03034706e-09] [-1.72290628e-08 -1.02992814e-08 3.40991110e-09] [ 1.75472679e-08 -1.06492032e-08 3.65430519e-09] [-1.51289721e-09 8.52135917e-09 -8.16944545e-09] [-4.45604076e-09 -2.06025730e-09 -6.07472661e-09] [ 7.97162070e-09 -5.84160043e-09 -8.78547917e-09] [-9.59973434e-10 1.51320408e-05 -7.91313684e-09] [-1.52802611e-05 2.94203127e-05 -7.48904826e-09] [ 1.52821344e-05 2.94181133e-05 -7.90277564e-09] [ 3.25012572e-10 -1.50843480e-05 -1.01485670e-09] [ 1.52385189e-05 -2.94434819e-05 -8.87103339e-10] [-1.52389437e-05 -2.94428591e-05 -1.22667018e-09] [ 8.94209706e-12 2.83166707e-05 1.00067549e-05] [-1.90417349e-10 -2.83167498e-05 1.00079440e-05] [-6.20126173e-12 -2.83167662e-05 -1.00083894e-05] [-1.81210408e-10 2.83166616e-05 -1.00080639e-05] [-1.63369096e-10 -2.23135119e-05 -3.45202667e-05] [ 2.50647033e-11 2.23135394e-05 -3.45200658e-05] [-2.02292362e-11 2.23135158e-05 3.45191738e-05] [-1.20364552e-10 -2.23134989e-05 3.45187434e-05]] Final stress: [-2.52885546e-04 -1.38643368e-04 -1.28591308e-04 8.02067050e-13 1.94279893e-13 -5.80564648e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 2.97377678e-10 -2.09730800e-05 1.06689009e-05] [-4.30953810e-10 2.09727060e-05 1.06835669e-05] [ 3.88724039e-10 2.09728791e-05 -1.06607540e-05] [-7.78666576e-11 -2.09728425e-05 -1.06760058e-05] [-1.74639597e-10 -1.21980548e-08 -3.25280936e-09] [ 1.05798846e-08 6.33403507e-09 -3.48371262e-09] [-1.02117643e-08 5.91607668e-09 -3.19706669e-09] [ 4.46591694e-10 3.95192479e-09 -1.51135882e-09] [-2.50050836e-09 -2.24297925e-09 -1.27586208e-09] [ 1.40485423e-09 -1.09329645e-09 -3.75549682e-10] [-4.24814517e-10 2.99434618e-05 -2.88056005e-09] [-2.76100860e-06 1.92895926e-05 -3.60026367e-09] [ 2.76171859e-06 1.92886859e-05 -2.95575569e-09] [-7.52934382e-11 -2.99281927e-05 2.21963539e-09] [ 2.74691839e-06 -1.92968556e-05 2.12472068e-09] [-2.74684473e-06 -1.92969933e-05 2.28524313e-09] [-4.58571237e-11 3.90843749e-05 -3.22930997e-05] [ 5.76231840e-11 -3.90844385e-05 -3.22924720e-05] [-2.96030978e-11 -3.90843659e-05 3.22927940e-05] [ 8.08031975e-11 3.90843370e-05 3.22927326e-05] [-3.44467233e-11 -2.81543257e-05 1.57605241e-05] [-7.31999387e-12 2.81543504e-05 1.57609036e-05] [ 1.25213035e-11 2.81543454e-05 -1.57605308e-05] [-3.89602239e-11 -2.81543067e-05 -1.57606563e-05]] Final stress: [ 1.66526307e-04 2.80771606e-04 1.51147103e-04 -1.15028406e-12 -1.28083415e-12 -1.44506768e-13] Minimization converged after 30 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 49 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 1.65639106e-04 -6.88315590e-04 -3.45869862e-04] [ 1.30306105e-04 3.36834520e-04 6.69429424e-04] [-1.07507700e-04 -3.10647521e-04 -3.79569352e-04] [ 1.61784927e-04 6.50820129e-04 5.42069875e-04] [-7.45585211e-05 -5.98377657e-04 2.70185468e-04] [ 5.16975869e-04 -1.64277414e-04 -1.41220076e-03] [-4.23705967e-04 -3.39050077e-04 -1.41578529e-03] [-3.04315574e-04 1.30495578e-04 8.67607893e-04] [ 1.69368113e-03 6.87609852e-04 -1.00223524e-03] [-1.18418683e-03 -8.25038025e-05 -1.25178014e-03] [ 3.16996287e-04 -6.18737091e-04 1.37464949e-03] [ 1.69782621e-05 3.33742542e-04 4.33937337e-04] [-5.06131896e-04 7.47042888e-04 2.40439432e-04] [ 5.59946178e-04 -6.48352412e-04 1.00100508e-03] [-1.67368949e-04 -4.63363980e-04 3.09557295e-04] [-9.01045192e-04 1.14016275e-03 3.56411366e-04] [-3.42907567e-06 -1.69322128e-04 1.60665923e-06] [-3.97259118e-05 -7.87503092e-05 5.62493439e-05] [-1.18616323e-05 7.88705150e-05 1.17676954e-04] [-4.76759521e-05 -2.12576829e-04 5.16449582e-05] [ 3.95071499e-05 2.02479341e-04 -3.10427690e-04] [ 7.58178683e-05 1.01754385e-04 3.54992217e-05] [ 7.14873222e-05 -4.31296890e-05 4.37337712e-05] [ 2.23929942e-05 7.59200104e-06 -2.53835245e-04]] Final stress: [-3.35372787e-04 -1.00162784e-04 -2.17983618e-04 1.55237292e-04 5.18124314e-07 3.81593571e-07] Minimization converged after 49 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.55893942e-05 4.05791048e-04 -3.21252988e-04] [-1.55894515e-05 -4.05791079e-04 -3.21338162e-04] [-1.55894638e-05 -4.05791069e-04 3.21375468e-04] [ 1.55894573e-05 4.05791081e-04 3.21322954e-04] [ 2.18395543e-11 -9.94992777e-09 -8.75378936e-10] [ 8.58797300e-09 4.95141134e-09 -8.70108596e-10] [-8.62552041e-09 4.99392327e-09 -8.76993617e-10] [-9.71902305e-11 8.07566622e-08 -2.62438326e-08] [-6.98105167e-08 -4.02551819e-08 -2.62255185e-08] [ 7.00130653e-08 -4.04895339e-08 -2.62302499e-08] [-1.15031642e-04 -4.81206648e-04 -1.44148318e-09] [-2.69552619e-04 3.22575935e-04 -1.46597534e-09] [ 2.09816962e-04 2.16865180e-04 -1.44244734e-09] [ 1.15031549e-04 4.81276281e-04 -7.31775013e-09] [ 2.69492394e-04 -3.22610652e-04 -7.27890414e-09] [-2.09756622e-04 -2.16900078e-04 -7.30125767e-09] [-9.73564503e-05 2.37686562e-05 8.71065692e-05] [ 9.73564451e-05 -2.37686593e-05 8.71072685e-05] [ 9.73564391e-05 -2.37686552e-05 -8.71080615e-05] [-9.73564453e-05 2.37686556e-05 -8.71066111e-05] [ 5.66641599e-05 2.14391252e-05 -8.58066181e-06] [-5.66641773e-05 -2.14391270e-05 -8.58145656e-06] [-5.66642067e-05 -2.14391270e-05 8.58174778e-06] [ 5.66641876e-05 2.14391268e-05 8.58150372e-06]] Final stress: [ 1.33165647e-05 1.51110233e-05 6.53858147e-06 -1.23353875e-13 -2.83884918e-14 1.07281190e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.55416075e-05 4.38517529e-04 -2.29391235e-05] [ 1.55416219e-05 -4.38517532e-04 -2.29907308e-05] [ 1.55416321e-05 -4.38517533e-04 2.29996795e-05] [-1.55416143e-05 4.38517538e-04 2.29583179e-05] [ 1.56166549e-11 1.62013076e-08 5.89262661e-09] [-1.40379848e-08 -8.11711168e-09 5.89490998e-09] [ 1.40137738e-08 -8.08414169e-09 5.89633253e-09] [ 4.03822292e-11 3.99804521e-08 -1.30026498e-08] [-3.46692203e-08 -2.00342268e-08 -1.30079474e-08] [ 3.46046767e-08 -1.99510705e-08 -1.30033471e-08] [ 5.17192449e-05 -3.86762314e-05 -2.33537197e-10] [-7.95801111e-05 1.71719914e-04 -2.32609275e-10] [ 1.51214258e-04 1.92395441e-04 -2.26153545e-10] [-5.17192115e-05 3.87129038e-05 -2.07423247e-09] [ 7.95483298e-05 -1.71738283e-04 -2.06244601e-09] [-1.51182522e-04 -1.92413742e-04 -2.06227468e-09] [ 7.24087671e-05 2.35123380e-05 1.58462194e-05] [-7.24087671e-05 -2.35123383e-05 1.58466686e-05] [-7.24087654e-05 -2.35123381e-05 -1.58468963e-05] [ 7.24087667e-05 2.35123385e-05 -1.58462112e-05] [-5.52405605e-05 1.26466079e-05 1.90961872e-05] [ 5.52405656e-05 -1.26466078e-05 1.90955906e-05] [ 5.52405691e-05 -1.26466076e-05 -1.90955280e-05] [-5.52405635e-05 1.26466079e-05 -1.90959520e-05]] Final stress: [ 1.51904469e-05 1.43943374e-05 9.32728503e-06 -2.35974714e-14 -2.38379473e-14 -1.14542113e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 3.45712625e-11 1.76756017e-05 -3.37218999e-06] [-1.00557796e-10 -1.76758525e-05 -3.37013818e-06] [ 3.98378070e-11 -1.76757788e-05 3.37289808e-06] [-6.76433909e-11 1.76754392e-05 3.37190961e-06] [-1.42097008e-10 1.43871942e-09 1.96264949e-10] [-2.37412548e-10 -3.45666100e-10 -4.12831602e-10] [ 6.51536602e-10 -7.36820160e-10 -3.81009668e-11] [-1.52290055e-10 4.60969041e-11 -6.36658504e-11] [-4.70261496e-10 1.38079770e-10 5.68031178e-11] [ 7.62384988e-10 -1.82894255e-10 -1.18951595e-10] [ 3.16123072e-10 -1.15078918e-05 -6.18486558e-10] [ 3.44470822e-06 -1.89898665e-05 -6.38605124e-10] [-3.44519987e-06 -1.89892089e-05 -5.22551064e-10] [ 2.43525977e-10 1.15082608e-05 -4.47581504e-12] [-3.44465680e-06 1.89892637e-05 -8.66457191e-11] [ 3.44424936e-06 1.89897792e-05 -1.22989175e-11] [-2.08963125e-11 -2.42163636e-05 -8.06412438e-06] [-1.43402512e-11 2.42163786e-05 -8.06406740e-06] [-1.91108240e-11 2.42163003e-05 8.06404406e-06] [-1.27184374e-11 -2.42162929e-05 8.06402752e-06] [ 2.92543767e-11 1.69065721e-05 2.00118186e-05] [ 1.42738883e-11 -1.69066337e-05 2.00117800e-05] [ 2.21866634e-11 -1.69066462e-05 -2.00118033e-05] [ 2.27241004e-11 1.69065818e-05 -2.00118911e-05]] Final stress: [ 1.80673785e-04 1.10739401e-04 9.77263576e-05 2.45416206e-13 -1.11523490e-13 8.10840791e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-4.38164413e-09 1.73053539e-04 1.82784983e-04] [-3.72753580e-10 -1.73059517e-04 1.82913277e-04] [-1.92839174e-09 -1.73060547e-04 -1.82655754e-04] [ 6.25450108e-10 1.73068242e-04 -1.82785767e-04] [ 3.30600031e-11 -3.44937276e-08 -2.23037051e-08] [ 8.64968679e-09 1.23176387e-08 -1.03942142e-08] [-1.06652164e-08 1.32773835e-08 -1.30817885e-08] [-3.71387168e-09 8.71108459e-08 -3.83415952e-08] [-5.66087037e-08 -3.55927741e-08 -2.72251661e-08] [ 6.57150081e-08 -4.54626239e-08 -3.44321684e-08] [-1.07966280e-09 -1.44849950e-04 -3.78572578e-08] [ 6.47715007e-05 2.36382991e-04 -4.20788570e-08] [-6.47692197e-05 2.36380332e-04 -4.08511247e-08] [-5.77999643e-09 1.44714945e-04 3.44676073e-10] [-6.46448664e-05 -2.36307632e-04 1.08119595e-08] [ 6.46544583e-05 -2.36319869e-04 8.30393599e-09] [-7.69515562e-11 5.43501214e-04 2.28686338e-04] [-4.86749030e-10 -5.43501582e-04 2.28686643e-04] [ 1.01985642e-10 -5.43499317e-04 -2.28686339e-04] [-3.71272235e-10 5.43500071e-04 -2.28692086e-04] [-3.24150040e-10 8.36523110e-05 -5.31303752e-04] [-4.83677676e-10 -8.36526196e-05 -5.31301854e-04] [-7.85821760e-10 -8.36525880e-05 5.31301912e-04] [ 6.06857342e-11 8.36528196e-05 5.31299504e-04]] Final stress: [-1.41000515e-04 -1.14985107e-04 -8.20255988e-05 -3.72065905e-11 -9.60902366e-12 3.09443374e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 20 steps. Final forces: [[-1.09507731e-09 -2.70327891e-04 -1.04775701e-04] [-9.16780514e-10 2.70327060e-04 -1.04764587e-04] [ 7.65856184e-10 2.70328242e-04 1.04781946e-04] [ 7.78280912e-10 -2.70326816e-04 1.04761796e-04] [-8.55943808e-10 -1.02499537e-09 5.03105335e-10] [ 1.14858008e-09 1.32277529e-09 3.37059325e-10] [ 2.56420662e-10 -4.63510508e-10 1.02743361e-09] [-4.11719439e-10 -2.78000645e-09 -2.99818392e-10] [ 1.74768977e-09 1.67261183e-09 -4.20092072e-10] [-8.88644547e-10 7.33452410e-10 -1.01418454e-09] [ 5.76245218e-10 -2.78122480e-05 -2.58889909e-09] [-9.43145879e-05 4.22291553e-05 -4.50997790e-09] [ 9.43136831e-05 4.22303285e-05 -2.73777589e-09] [-3.71389031e-11 2.78125064e-05 1.47707503e-09] [ 9.43130463e-05 -4.22300254e-05 3.60532246e-09] [-9.43130194e-05 -4.22299997e-05 1.50987868e-09] [-1.75373549e-10 6.75539630e-05 -4.20274660e-05] [-1.31530897e-10 -6.75539884e-05 -4.20272227e-05] [-1.52564072e-11 -6.75539197e-05 4.20274638e-05] [ 2.15614193e-11 6.75540887e-05 4.20270162e-05] [ 2.32862063e-11 1.05482031e-05 6.58928592e-05] [-2.57231471e-11 -1.05482018e-05 6.58933895e-05] [ 1.78042828e-11 -1.05481603e-05 -6.58931845e-05] [ 9.52524726e-11 1.05482424e-05 -6.58931987e-05]] Final stress: [ 1.16742409e-04 1.73150033e-04 9.79571953e-05 -6.33290167e-12 -1.01770795e-11 3.93985066e-13] Minimization converged after 28 steps. Minimization converged after 9 steps. Minimization converged after 8 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 12 steps. Minimization converged after 12 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.15302719e-05 1.24111826e-03 -6.85042353e-05] [-1.15303299e-05 -1.24111827e-03 -6.85588166e-05] [-1.15304636e-05 -1.24111827e-03 6.85903752e-05] [ 1.15303915e-05 1.24111823e-03 6.85869219e-05] [ 1.02356994e-11 -1.88460040e-08 -5.93310012e-09] [ 1.63099394e-08 9.41320730e-09 -5.96927296e-09] [-1.64023266e-08 9.46607359e-09 -5.99166280e-09] [-8.74730930e-11 7.97077822e-08 -2.32418822e-08] [-6.89000339e-08 -3.96993610e-08 -2.32717944e-08] [ 6.92886917e-08 -4.00240322e-08 -2.32449161e-08] [-1.03004358e-04 -2.26287697e-04 6.50313478e-11] [-4.44937318e-04 6.08260695e-04 1.04364533e-10] [ 2.88838918e-04 5.35395951e-04 6.53552446e-11] [ 1.03004390e-04 2.26278546e-04 -9.10406901e-09] [ 4.44945274e-04 -6.08256106e-04 -9.09800866e-09] [-2.88846879e-04 -5.35391354e-04 -9.11625740e-09] [-1.55535883e-04 -3.71726977e-04 7.25035353e-04] [ 1.55535902e-04 3.71726982e-04 7.25034624e-04] [ 1.55535875e-04 3.71726977e-04 -7.25035621e-04] [-1.55535879e-04 -3.71726977e-04 -7.25035170e-04] [-2.03641342e-06 5.72573030e-05 -4.16803975e-04] [ 2.03635732e-06 -5.72573053e-05 -4.16805207e-04] [ 2.03624917e-06 -5.72573062e-05 4.16805432e-04] [-2.03632495e-06 5.72573010e-05 4.16805054e-04]] Final stress: [ 1.29015467e-05 2.15456379e-08 -2.83978691e-05 5.60534986e-14 5.37478073e-13 3.70632508e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.78842780e-05 1.07055338e-03 -9.08372525e-05] [ 2.78843546e-05 -1.07055350e-03 -9.08293480e-05] [ 2.78843091e-05 -1.07055347e-03 9.09256674e-05] [-2.78844662e-05 1.07055360e-03 9.09928331e-05] [-1.01899716e-10 -1.31663688e-07 -3.98960104e-08] [ 1.14184063e-07 6.59906012e-08 -3.97940457e-08] [-1.13762903e-07 6.56183022e-08 -3.98751754e-08] [ 1.23784142e-10 8.48997177e-08 -2.43125002e-08] [-7.36683492e-08 -4.25959920e-08 -2.42087169e-08] [ 7.33467407e-08 -4.22765474e-08 -2.42947575e-08] [ 1.55604479e-04 -2.13767137e-04 -4.77635377e-09] [-2.52653604e-04 4.20406495e-04 -4.71001223e-09] [ 4.03193816e-04 5.39729638e-04 -4.89486838e-09] [-1.55604482e-04 2.13739288e-04 -1.55233953e-08] [ 2.52677736e-04 -4.20392557e-04 -1.53441081e-08] [-4.03217929e-04 -5.39715713e-04 -1.52860756e-08] [ 1.01085765e-04 -2.08397143e-04 4.93332765e-04] [-1.01085760e-04 2.08397134e-04 4.93331654e-04] [-1.01085726e-04 2.08397154e-04 -4.93333258e-04] [ 1.01085731e-04 -2.08397142e-04 -4.93333014e-04] [-3.13626086e-05 4.61021416e-05 -1.48823587e-04] [ 3.13625722e-05 -4.61021444e-05 -1.48823654e-04] [ 3.13627384e-05 -4.61021464e-05 1.48824590e-04] [-3.13627696e-05 4.61021536e-05 1.48825521e-04]] Final stress: [ 1.55693938e-05 7.92126744e-06 -1.79716412e-05 -7.39763541e-13 1.86798408e-13 -4.39649128e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 2.53100607e-09 1.88833896e-05 -1.73785496e-05] [ 4.59934646e-10 -1.88826468e-05 -1.72771074e-05] [ 1.58610591e-09 -1.88797435e-05 1.73608152e-05] [ 2.99355152e-10 1.88826682e-05 1.73039381e-05] [-9.87924647e-10 -5.97855826e-09 -3.88565558e-09] [ 4.86121031e-09 3.71481114e-09 -3.55347660e-09] [-3.88458538e-09 1.98270045e-09 -3.70587200e-09] [ 2.04485858e-09 -7.77011522e-09 3.62762453e-09] [ 3.39221984e-10 -1.54199653e-10 -1.97428285e-09] [-6.27570584e-09 5.57510405e-09 3.40438963e-09] [-2.19496865e-10 1.68154050e-05 -1.31580191e-08] [-1.91326520e-05 -3.37529645e-05 -1.52794131e-08] [ 1.91324810e-05 -3.37531973e-05 -1.55441313e-08] [ 1.42229678e-09 -1.68591644e-05 1.40177712e-08] [ 1.91641855e-05 3.37723193e-05 1.33559305e-08] [-1.91670933e-05 3.37756838e-05 1.42937007e-08] [-1.08127118e-10 -4.33794756e-05 2.15630441e-05] [ 2.43300102e-10 4.33794864e-05 2.15642318e-05] [-1.69606273e-10 4.33794186e-05 -2.15624629e-05] [ 2.07241002e-10 -4.33792074e-05 -2.15649671e-05] [ 1.53899282e-10 1.04214777e-05 1.18218894e-05] [ 2.31301125e-10 -1.04211880e-05 1.18231833e-05] [ 3.18249747e-10 -1.04210647e-05 -1.18221321e-05] [ 2.63760680e-11 1.04214338e-05 -1.18234815e-05]] Final stress: [ 1.15748858e-04 7.82139662e-05 6.35182249e-05 -6.44106929e-12 3.17902858e-12 -9.71965869e-13] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.42739418e-09 1.89026947e-06 1.70319712e-05] [-3.20268264e-09 -1.89395392e-06 1.70738844e-05] [ 4.22238626e-10 -1.89129200e-06 -1.65617142e-05] [-2.14733883e-09 1.88743582e-06 -1.69634906e-05] [-3.35542856e-09 -3.18011037e-07 -7.45127006e-08] [ 2.96898378e-07 1.66939851e-07 -8.61301094e-08] [-2.88584749e-07 1.58267034e-07 -7.93551419e-08] [ 1.38140319e-09 9.91861919e-08 -5.84610731e-08] [-8.82166497e-08 -5.11950693e-08 -5.92773488e-08] [ 8.48991948e-08 -4.76815468e-08 -5.66323192e-08] [-1.97386679e-09 2.46370308e-05 -6.66424253e-08] [-1.03302546e-05 1.44224908e-05 -6.75998614e-08] [ 1.03340650e-05 1.44180002e-05 -6.61392790e-08] [ 8.73345840e-10 -2.39365034e-05 1.29210278e-08] [ 9.72835178e-06 -1.47703562e-05 1.18071791e-08] [-9.72968270e-06 -1.47685874e-05 1.32117502e-08] [-4.19091067e-10 2.60718121e-05 -7.21637923e-06] [ 2.01159200e-10 -2.60724325e-05 -7.20046908e-06] [-4.44566550e-10 -2.60732577e-05 7.20240100e-06] [ 2.31403896e-10 2.60726087e-05 7.20809997e-06] [-1.78389969e-10 -9.14854238e-06 8.77107374e-06] [-5.74398380e-11 9.14816472e-06 8.78133220e-06] [ 1.42578598e-10 9.14827418e-06 -8.77633520e-06] [-3.76426113e-10 -9.14866677e-06 -8.77356390e-06]] Final stress: [ 7.52784425e-05 1.17642766e-04 6.51736349e-05 7.77774306e-13 -1.59768356e-13 -1.22713437e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.29954719e-09 9.01805011e-06 1.57300235e-06] [-1.22328140e-09 -9.01933134e-06 1.45362877e-06] [ 1.05382294e-11 -9.02037432e-06 -1.28764196e-06] [ 3.94545702e-10 9.01879933e-06 -1.56187506e-06] [-8.27298399e-10 7.92930788e-08 2.41421316e-08] [-6.55722243e-08 -3.82201419e-08 2.25263268e-08] [ 6.75229081e-08 -4.03023666e-08 2.40601463e-08] [ 4.28605237e-10 2.04980910e-07 -6.58818577e-08] [-1.73323423e-07 -1.01960208e-07 -6.38119615e-08] [ 1.72141446e-07 -1.00765182e-07 -6.27361671e-08] [-1.38043665e-09 -1.79616300e-05 -2.31682853e-08] [ 4.46022822e-06 -1.16041553e-05 -2.29785669e-08] [-4.45771536e-06 -1.16071948e-05 -2.22826081e-08] [ 2.85260571e-09 1.80794085e-05 4.73907063e-09] [-4.56253295e-06 1.15440002e-05 4.83854527e-09] [ 4.55749766e-06 1.15501995e-05 5.17665852e-09] [-1.04915437e-10 -2.19691712e-05 2.18181797e-06] [ 3.97251676e-11 2.19689078e-05 2.18553317e-06] [-1.30211397e-10 2.19690181e-05 -2.18487220e-06] [ 9.40576783e-11 -2.19693027e-05 -2.18471659e-06] [-1.39503353e-10 8.41260728e-06 -1.62777993e-05] [ 2.83640245e-10 -8.41272876e-06 -1.62796023e-05] [ 3.39926710e-10 -8.41278905e-06 1.62811589e-05] [-1.83826343e-10 8.41266053e-06 1.62767428e-05]] Final stress: [-4.64666612e-05 -8.88147291e-05 -4.35352248e-05 7.45987145e-13 -9.46817188e-13 -1.91375448e-12] Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 6.04052711e-06 6.32309736e-04 -4.63096083e-04] [-6.04052167e-06 -6.32309747e-04 -4.63100007e-04] [-6.04053259e-06 -6.32309726e-04 4.63130425e-04] [ 6.04056375e-06 6.32309743e-04 4.63157378e-04] [ 3.39112385e-11 -4.08506839e-08 -1.29376952e-08] [ 3.53216710e-08 2.03735188e-08 -1.29365067e-08] [-3.54182985e-08 2.04720242e-08 -1.29511039e-08] [-5.98498031e-12 3.54177814e-08 -1.00442734e-08] [-3.06672100e-08 -1.77005902e-08 -1.00698131e-08] [ 3.06979183e-08 -1.77272169e-08 -1.00397851e-08] [-1.38581237e-05 7.37402780e-05 -1.03792595e-09] [ 1.08361647e-04 2.35235247e-04 -1.06180553e-09] [-2.28016573e-04 2.84585562e-04 -1.05407512e-09] [ 1.38581520e-05 -7.37596535e-05 -6.58030522e-09] [-1.08344894e-04 -2.35225581e-04 -6.56514442e-09] [ 2.27999777e-04 -2.84575847e-04 -6.58029212e-09] [-6.46424767e-05 -2.43413799e-05 1.87957993e-04] [ 6.46424830e-05 2.43413794e-05 1.87957342e-04] [ 6.46424768e-05 2.43413801e-05 -1.87958071e-04] [-6.46424736e-05 -2.43413788e-05 -1.87958013e-04] [ 5.29944660e-05 2.52169032e-06 2.75271605e-04] [-5.29944613e-05 -2.52168908e-06 2.75271309e-04] [-5.29944887e-05 -2.52168911e-06 -2.75271121e-04] [ 5.29944899e-05 2.52169070e-06 -2.75270897e-04]] Final stress: [ 2.11713466e-05 1.85708614e-05 -3.97858778e-06 -8.49106082e-14 5.87048991e-14 3.40693643e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-4.81989463e-04 -3.78867450e-03 7.09106586e-03] [ 6.37651050e-04 3.76969034e-03 -1.37616488e-02] [ 5.10795604e-04 3.74025916e-03 -9.17541399e-03] [-5.92494511e-04 -3.74838064e-03 1.14612420e-02] [ 1.68476989e-05 -1.76558544e-03 6.01375440e-05] [ 1.51360617e-03 8.55908224e-04 1.02532233e-04] [-1.54978242e-03 8.97445203e-04 5.49749988e-05] [ 2.30245350e-05 1.87434004e-03 -2.63744404e-05] [-1.58620263e-03 -9.48336360e-04 9.78538692e-06] [ 1.52430728e-03 -8.85759442e-04 4.22761638e-05] [ 2.00432447e-02 -3.80142009e-03 4.27707799e-03] [-1.35795584e-02 1.25765767e-02 4.44415421e-03] [-1.17163275e-02 -3.58785593e-02 4.29820520e-03] [-2.00185393e-02 3.58415739e-03 -3.13709729e-03] [ 1.37444108e-02 -1.24951858e-02 -3.22203425e-03] [ 1.14950834e-02 3.60192693e-02 -3.10518089e-03] [ 2.29957145e-03 9.36618446e-03 8.00999831e-03] [-2.31975753e-03 -9.34853158e-03 7.53371596e-03] [-2.29700581e-03 -9.36044580e-03 -7.88244257e-03] [ 2.32477107e-03 9.33739277e-03 -7.41823550e-03] [ 1.68825341e-04 -4.47710552e-03 2.69638434e-03] [-1.89852009e-04 4.49138690e-03 2.40163063e-03] [-1.44804910e-04 4.47036016e-03 -2.52902956e-03] [ 1.74175490e-04 -4.48498618e-03 -2.22572351e-03]] Final stress: [-2.98044312e-04 1.71632315e-04 -6.45442710e-04 3.68006325e-07 -8.37418903e-07 -6.36078380e-06] Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.41127043e-09 -5.02014969e-06 1.92996845e-06] [ 1.32536795e-09 5.02618111e-06 2.23552078e-06] [-1.77318911e-09 5.02820643e-06 -1.05780852e-06] [-7.93715427e-10 -5.01880226e-06 -1.27595791e-06] [ 4.54815144e-09 -4.70793501e-07 -1.79328091e-07] [ 3.95475104e-07 2.27915966e-07 -1.70760503e-07] [-4.04144661e-07 2.38136187e-07 -1.75994751e-07] [-1.79175827e-09 8.71476207e-07 -2.53029080e-07] [-7.72410506e-07 -4.37667077e-07 -2.60854241e-07] [ 7.76835546e-07 -4.42328973e-07 -2.64427868e-07] [-2.44011078e-09 8.64574408e-06 -1.32610771e-07] [ 1.46039558e-06 1.35601369e-05 -1.32691340e-07] [-1.45629738e-06 1.35549289e-05 -1.33347951e-07] [-6.05516254e-09 -9.29511898e-06 -4.06161650e-08] [-9.05617571e-07 -1.32294604e-05 -3.83417318e-08] [ 9.16322311e-07 -1.32426093e-05 -3.73849619e-08] [ 5.45184675e-10 2.19748797e-05 -1.66182452e-06] [-1.21045007e-10 -2.19740095e-05 -1.66579569e-06] [ 5.15945564e-10 -2.19742909e-05 1.66178515e-06] [-2.22775465e-10 2.19754445e-05 1.64569315e-06] [-3.29389072e-10 -4.55756490e-06 -1.26589610e-05] [-5.86833277e-10 4.55859974e-06 -1.26628119e-05] [-7.60915315e-10 4.55875005e-06 1.26711114e-05] [-2.06905659e-10 -4.55760434e-06 1.26584680e-05]] Final stress: [-4.94637317e-05 -2.43649522e-05 -2.30163796e-05 -9.39461061e-12 4.27788633e-12 1.45693987e-12] Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 7.07136599e-10 1.50956544e-05 -1.04066402e-05] [-1.76828547e-09 -1.50974663e-05 -1.00451875e-05] [ 1.58707739e-09 -1.50953329e-05 1.00218817e-05] [-2.17640433e-09 1.50944808e-05 1.01073998e-05] [-5.77702799e-10 2.42183976e-07 4.04496328e-08] [-2.01577855e-07 -1.18520743e-07 3.55300351e-08] [ 2.03696043e-07 -1.20398292e-07 3.78313483e-08] [ 2.40384346e-09 -2.43851304e-07 7.03641638e-08] [ 2.09024817e-07 1.18951528e-07 6.82833764e-08] [-2.14663492e-07 1.24999060e-07 7.27158617e-08] [-2.41293896e-09 -3.17848490e-05 -2.10751004e-08] [-5.01861949e-06 -6.37683240e-06 -2.31787774e-08] [ 5.02249483e-06 -6.38183634e-06 -2.10572502e-08] [-3.37633116e-09 3.12567417e-05 2.74468782e-08] [ 5.47912614e-06 6.64701266e-06 2.65112202e-08] [-5.47316159e-06 6.63970666e-06 2.81202455e-08] [-1.47713730e-10 -1.91839042e-05 -7.85512036e-06] [ 3.60556029e-10 1.91835451e-05 -7.86028767e-06] [-1.12644116e-10 1.91833120e-05 7.86181770e-06] [ 3.66820158e-10 -1.91835791e-05 7.85037281e-06] [-1.81674342e-10 4.90353705e-06 -2.63758985e-05] [-4.13178843e-10 -4.90356496e-06 -2.63757590e-05] [-2.85933353e-10 -4.90341801e-06 2.63700174e-05] [-2.92039393e-10 4.90342862e-06 2.63654622e-05]] Final stress: [-2.52494808e-05 -4.93025364e-05 -2.24031290e-05 -2.93067188e-12 -1.34895337e-12 6.89136272e-14] Minimization converged after 6 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. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 6.62681214e-05 -9.25483458e-05 -1.72650909e-05] [-6.62675865e-05 9.25483227e-05 -1.68136363e-05] [-6.62676273e-05 9.25481810e-05 1.67347649e-05] [ 6.62677902e-05 -9.25482348e-05 1.68246281e-05] [ 2.37758840e-10 -1.44785461e-09 -1.78536008e-09] [ 6.48778559e-10 3.92617668e-10 -1.42152032e-09] [-1.15826521e-09 9.20449272e-10 -1.78795537e-09] [ 9.45194240e-11 -4.44544620e-07 1.33270342e-07] [ 3.85186883e-07 2.22049947e-07 1.33708446e-07] [-3.86103679e-07 2.22709011e-07 1.33463312e-07] [-1.23599722e-04 1.18444802e-03 -1.14630815e-08] [ 7.12103088e-04 -4.48262499e-04 -1.13694199e-08] [-8.74632635e-04 -4.98114079e-04 -1.15020675e-08] [ 1.23599653e-04 -1.18451527e-03 5.33571886e-08] [-7.12044849e-04 4.48296189e-04 5.32382718e-08] [ 8.74574353e-04 4.98147661e-04 5.34898322e-08] [-2.11421203e-04 -1.32516780e-04 3.63217523e-04] [ 2.11421171e-04 1.32516766e-04 3.63220613e-04] [ 2.11421270e-04 1.32516813e-04 -3.63214508e-04] [-2.11421255e-04 -1.32516827e-04 -3.63219731e-04] [ 2.34730280e-05 -1.00762591e-04 5.22493340e-04] [-2.34727950e-05 1.00762591e-04 5.22501604e-04] [-2.34725266e-05 1.00762587e-04 -5.22501462e-04] [ 2.34728184e-05 -1.00762587e-04 -5.22499243e-04]] Final stress: [ 2.39704525e-05 2.45206852e-05 -2.27341500e-05 3.73457045e-14 -1.07985608e-12 8.39230080e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.50499669e-03 -1.40929188e-03 -1.92921796e-02] [-1.28667685e-03 1.61226505e-03 3.70401732e-02] [-5.88811954e-04 1.45299912e-03 5.20483469e-02] [ 1.30984255e-03 -1.49678828e-03 -3.15494567e-02] [ 7.21130213e-05 5.13183383e-03 -3.18493402e-04] [-4.78876749e-03 -2.70798008e-03 -1.85703593e-04] [ 4.62259362e-03 -2.52816651e-03 -2.40045012e-04] [ 6.24420115e-04 1.12621058e-02 -5.66305926e-03] [-1.07064196e-02 -6.47341143e-03 -6.21299918e-03] [ 9.17546220e-03 -4.86227710e-03 -5.16106773e-03] [ 1.71797529e-02 6.04632504e-03 -1.57027586e-02] [-9.43370088e-03 5.09959094e-03 -1.58637590e-02] [-1.40622715e-03 -7.55950902e-03 -1.54682531e-02] [-1.69201010e-02 5.66426613e-03 9.59163861e-03] [-1.06058646e-03 -1.12728165e-02 9.55431313e-03] [ 1.13347576e-02 2.00023402e-03 9.55796600e-03] [-2.67605812e-03 -2.11154324e-04 -3.50769050e-06] [ 2.85767568e-03 1.83687229e-04 1.83284959e-03] [ 2.70484491e-03 2.09144731e-04 -7.28006962e-04] [-2.71533627e-03 -1.63707650e-04 -2.19325845e-03] [ 1.11100477e-03 1.49145659e-03 1.46357362e-04] [-9.12472022e-04 -1.50154943e-03 1.01574884e-03] [-1.01229575e-03 -1.47402103e-03 -5.00674736e-04] [ 1.00998952e-03 1.50676484e-03 -1.70417042e-03]] Final stress: [-1.00991209e-04 -3.80995373e-04 -2.79776184e-04 -2.73431031e-07 3.72827664e-06 1.71035507e-04] Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 10 steps. Minimization converged after 7 steps. Minimization converged after 3 steps. Minimization converged after 6 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 9 steps. Minimization converged after 9 steps. 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]: [[ 0.98206 0.69716 0.54782 -0. 0. -0.09434] [ 0.69716 1.24422 0.58263 0. -0. 0.05276] [ 0.54782 0.58263 1.11943 0. -0. -0.00097] [-0. 0. 0. -0.21585 0. 0. ] [ 0. -0. -0. 0. -0.21587 0.00001] [-0.09434 0.05276 -0.00097 0. 0.00001 0.24462]] 95%% Error estimate [ASE units]: [[0.34286 0.14616 0.15852 0. 0. 0.70498] [0.14616 0.10838 0.05352 0.00002 0. 1.305 ] [0.15852 0.05352 0.00002 0. 0. 0.03368] [0. 0.00002 0. 0.00293 0. 0.00188] [0. 0. 0. 0. 0.00285 0.00016] [0.70498 1.305 0.03368 0.00188 0.00016 0.24696]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.652502 is too big compared to maximum elastic constant component 1.244219 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.262163 WARNING: Maximum deviation from material symmetry according to space group 194 is too big compared to maximum elastic constant component 1.244219 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.1,_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 3 steps. Minimization converged after 27 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 19 steps. Minimization converged after 11 steps. Minimization converged after 11 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 27 steps. Minimization converged after 19 steps. Minimization converged after 28 steps. Minimization converged after 18 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 68 steps. Final forces: [[-2.60624918e-06 -3.83511171e-03 5.56180006e-03] [ 7.92657976e-08 3.73014193e-02 8.17520268e-02] [-2.64170879e-06 -9.74587163e-03 5.00868272e-02] [ 7.66126007e-08 -3.67861398e-02 -7.68930180e-02] [ 2.01830186e-08 -1.30200126e-04 1.21135147e-03] [ 1.20808494e-04 -8.27308806e-05 1.03907100e-03] [-1.20812273e-04 -8.27116126e-05 1.03909612e-03] [ 1.61778576e-06 1.16277194e-02 -2.09696688e-01] [-7.91331529e-04 -1.41759139e-02 6.46251152e-02] [ 7.92518592e-04 -1.41775000e-02 6.46338911e-02] [-8.75626088e-08 -1.78526821e-02 2.95394969e-02] [-2.96866099e-02 -7.83450865e-03 -4.73735148e-03] [ 2.96857824e-02 -7.83345652e-03 -4.73528258e-03] [-8.15170631e-08 1.66499666e-02 -1.42750056e-02] [ 3.74805737e-02 -1.40013394e-02 2.43525439e-02] [-3.74814812e-02 -1.40002006e-02 2.43547686e-02] [-4.84499531e-08 5.58554334e-03 -1.35277616e-02] [ 2.09365825e-06 6.36667522e-02 -4.64797597e-04] [-4.87529572e-08 -5.79807609e-03 1.84908406e-02] [ 2.20822904e-06 4.83797327e-03 -2.34758010e-02] [-7.36298185e-08 6.42389084e-03 1.75328887e-02] [ 4.19197854e-08 3.90590725e-03 -2.47604756e-02] [-4.11719461e-08 7.45853210e-04 -3.22519655e-02] [ 4.31981698e-08 -4.40858241e-03 2.05984296e-02]] Final stress: [ 4.23456270e-02 5.97137851e-02 1.00589749e-01 -1.06860470e-02 5.59551830e-10 -5.74783105e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 68 steps. Final forces: [[ 3.21085298e-08 -5.98069591e-02 1.30539827e-01] [-9.64918098e-07 4.76709057e-03 1.52237978e-02] [ 3.05233790e-08 5.88746564e-02 -1.23200571e-01] [-9.81633360e-07 1.61078740e-02 6.90523815e-02] [ 6.00209640e-07 -1.72414330e-02 -3.16513000e-01] [ 4.27003457e-05 2.13450585e-02 9.88384785e-02] [-4.23091855e-05 2.13444880e-02 9.88351496e-02] [ 4.48037055e-08 1.71648323e-04 1.85998977e-03] [-1.69083838e-04 1.23500237e-04 1.55355429e-03] [ 1.69035777e-04 1.23579676e-04 1.55354699e-03] [-3.23190802e-08 -2.81658026e-02 -2.49931682e-02] [-5.80565809e-02 2.24515835e-02 3.70535759e-02] [ 5.80562523e-02 2.24520103e-02 3.70527479e-02] [-3.47754855e-08 2.99639565e-02 4.79180158e-02] [ 4.76613920e-02 1.04996636e-02 -9.18327623e-03] [-4.76616513e-02 1.05000368e-02 -9.18397729e-03] [ 7.70165323e-07 -9.71007356e-02 -2.10090236e-03] [-1.16202382e-08 -9.25683537e-03 -2.22854321e-02] [ 8.34221431e-07 -6.82151016e-03 -3.42442075e-02] [-1.14265267e-08 9.57562276e-03 2.99614967e-02] [ 1.10596911e-08 -7.69879630e-03 -4.34167923e-02] [-3.53292436e-08 -1.01299541e-02 2.91243829e-02] [ 1.20179551e-08 8.40216753e-03 3.71373842e-02] [-1.83716242e-08 -4.80910531e-04 -5.05830009e-02]] Final stress: [4.22671334e-02 5.97814427e-02 1.00208961e-01 1.04586318e-02 5.57128913e-10 2.66874021e-10] Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 29 steps. Minimization converged after 19 steps. Minimization converged after 27 steps. Minimization converged after 18 steps. Minimization converged after 11 steps. Minimization converged after 10 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 66 steps. Final forces: [[ 3.82337552e-06 -4.81466316e-04 1.67490385e-03] [-4.66378496e-08 1.26401933e-03 5.17759447e-04] [ 3.81971526e-06 -4.40917420e-04 2.20656819e-03] [-4.62365339e-08 -1.27092010e-03 -3.69170995e-04] [ 1.78568954e-10 -8.43190165e-06 4.49874182e-05] [ 7.88072288e-06 -7.30467103e-07 3.45492428e-05] [-7.88256121e-06 -7.28587550e-07 3.45255678e-05] [-2.20835468e-06 6.13056175e-04 -1.43193765e-02] [-9.55470349e-06 -7.28956697e-04 5.49975362e-03] [ 8.80235476e-06 -7.26666360e-04 5.48340881e-03] [ 7.59860799e-08 -1.44644360e-03 -1.85426717e-03] [ 3.95525487e-04 -6.38509761e-04 1.14023622e-04] [-3.94744902e-04 -6.40199918e-04 1.11304713e-04] [ 7.54141447e-08 1.33565534e-03 2.68791637e-03] [ 7.10627174e-05 -1.11861870e-03 6.37375581e-04] [-7.02882380e-05 -1.12031383e-03 6.34662107e-04] [ 6.21377225e-08 -4.55300731e-04 -9.53672587e-04] [-3.22867206e-06 3.55056179e-03 -9.22476852e-04] [ 6.21503341e-08 4.62985308e-04 1.18947205e-03] [-3.24316187e-06 1.53348373e-03 -1.05562717e-03] [ 5.11741368e-08 6.57868518e-05 -5.79490243e-06] [-2.34843891e-08 -7.02346749e-04 -4.36139859e-04] [ 4.91076800e-08 2.76601146e-04 -1.13463455e-03] [-2.35702169e-08 6.78401472e-04 1.79950017e-04]] Final stress: [ 4.09043352e-02 5.03355215e-02 1.04479239e-01 -1.89906619e-02 3.72679273e-12 5.26129038e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 65 steps. Final forces: [[ 6.40853191e-08 -4.30736006e-03 -5.64075754e-03] [-6.28561492e-06 -7.92190190e-03 -1.98811925e-02] [ 7.04299419e-08 4.23710149e-03 4.19421763e-03] [-6.34574237e-06 -7.47918919e-04 -1.70599024e-02] [ 3.65908943e-06 5.91732249e-03 1.36254837e-01] [-1.79300206e-04 -6.89943714e-03 -5.21509549e-02] [ 1.80521332e-04 -6.90317101e-03 -5.21778475e-02] [ 1.54422853e-09 -7.85813313e-05 -4.26832862e-04] [ 7.42952411e-05 -6.58875014e-06 -3.25508636e-04] [-7.42934459e-05 -6.58991736e-06 -3.25547760e-04] [-1.28630661e-07 2.59967367e-04 8.89231196e-03] [-3.55592712e-04 -1.26893297e-02 4.05359190e-03] [ 3.54265160e-04 -1.26865379e-02 4.04910249e-03] [-1.19594393e-07 -1.29276015e-03 -1.69295037e-02] [ 4.73295133e-03 -4.15797390e-03 -1.13280757e-02] [-4.73418263e-03 -4.15510503e-03 -1.13324738e-02] [ 5.46304272e-06 1.66037399e-02 2.63815371e-03] [-1.02458087e-07 1.49472809e-02 -1.31071675e-02] [ 5.23301924e-06 3.17491753e-02 1.63116234e-02] [-1.02180635e-07 -1.48892412e-02 1.08974288e-02] [ 3.88740967e-08 1.32894971e-03 -2.39479056e-03] [-5.73289623e-08 1.56273965e-03 -4.50349125e-04] [ 3.75483371e-08 -1.57832320e-03 4.83152259e-03] [-9.01509495e-08 1.71454324e-03 1.14081147e-02]] Final stress: [ 4.08308344e-02 4.98948924e-02 1.05182096e-01 1.89346213e-02 4.28620153e-11 -7.94417152e-10] Minimization converged after 51 steps. Minimization converged after 51 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 28 steps. Minimization converged after 18 steps. Minimization converged after 26 steps. Minimization converged after 21 steps. Minimization converged after 12 steps. Minimization converged after 10 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 6.69742040e-13 1.57616083e-03 -5.64932701e-03] [-2.30053064e-14 -1.57616083e-03 -5.64932707e-03] [ 4.42823709e-14 -1.57616084e-03 5.64932700e-03] [ 3.28542749e-13 1.57616084e-03 5.64932706e-03] [-1.38525920e-12 2.93987057e-13 -2.66159317e-12] [-6.90039692e-12 -7.54417362e-13 1.88862814e-12] [ 8.84170515e-12 -3.54311025e-12 2.63146449e-12] [-7.62392265e-14 3.46634943e-11 -4.62674343e-12] [-1.80957471e-11 -1.46023749e-11 1.46593848e-12] [ 1.80461202e-11 -1.47604706e-11 1.68387526e-12] [-2.34257058e-14 3.62807433e-03 1.28680923e-11] [-4.17029159e-03 -5.13557511e-03 1.49055391e-11] [ 4.17029159e-03 -5.13557511e-03 1.47294953e-11] [ 2.38298270e-12 -3.62807433e-03 -8.60980742e-12] [ 4.17029158e-03 5.13557511e-03 -7.26359671e-12] [-4.17029159e-03 5.13557511e-03 -7.14251372e-12] [-1.46938017e-13 -5.45433237e-04 -2.35575476e-03] [-4.31876757e-14 5.45433238e-04 -2.35575476e-03] [-2.02171613e-13 5.45433238e-04 2.35575476e-03] [-1.61537450e-14 -5.45433238e-04 2.35575476e-03] [ 8.82627305e-15 5.30314333e-03 1.15481306e-03] [ 3.08679352e-13 -5.30314332e-03 1.15481306e-03] [ 2.72340540e-13 -5.30314333e-03 -1.15481305e-03] [ 3.51940699e-14 5.30314333e-03 -1.15481306e-03]] Final stress: [ 1.64810086e-02 9.32284306e-03 8.86322495e-03 2.42732625e-15 7.61196555e-16 -1.44394533e-15] Minimization converged after 21 steps. Minimization converged after 26 steps. Minimization converged after 22 steps. Minimization converged after 10 steps. Minimization converged after 11 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 57 steps. Minimization converged after 55 steps. Minimization converged after 27 steps. Minimization converged after 19 steps. Minimization converged after 27 steps. Minimization converged after 21 steps. Minimization converged after 8 steps. Minimization converged after 10 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 65 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.05102593e-11 5.53326929e-03 1.13752188e-03] [-1.93202872e-11 -5.53326929e-03 1.13752285e-03] [ 1.76635999e-11 -5.53326927e-03 -1.13752177e-03] [-3.63179209e-11 5.53326932e-03 -1.13752231e-03] [ 2.80784354e-12 1.76012926e-10 -4.76398365e-11] [-6.79377388e-12 -6.71573561e-11 -9.37830091e-11] [ 2.04963824e-11 -7.20641324e-11 -6.77400358e-11] [ 2.30559048e-11 -4.29327685e-11 8.87556695e-12] [-3.20214966e-11 -1.24822930e-11 -2.07616146e-11] [-2.33383868e-11 4.48324156e-11 2.58476227e-11] [-2.12750928e-11 -3.66161853e-03 -2.01747423e-10] [ 4.92141342e-03 -5.37298520e-03 -2.14920436e-10] [-4.92141338e-03 -5.37298524e-03 -1.88303609e-10] [-5.25037791e-11 3.66161842e-03 3.24239691e-11] [-4.92141354e-03 5.37298529e-03 7.16805160e-11] [ 4.92141363e-03 5.37298517e-03 1.08709631e-10] [-8.19455614e-13 1.95943522e-03 -5.73966221e-04] [ 4.61042315e-12 -1.95943523e-03 -5.73966195e-04] [-8.37108161e-13 -1.95943523e-03 5.73966200e-04] [ 3.76998432e-12 1.95943523e-03 5.73966189e-04] [-2.15927276e-12 4.15174737e-03 1.02542784e-02] [-6.02910239e-12 -4.15174736e-03 1.02542784e-02] [-6.17652519e-12 -4.15174736e-03 -1.02542784e-02] [-2.65909517e-12 4.15174737e-03 -1.02542784e-02]] Final stress: [ 6.52401662e-03 3.95501437e-03 3.19244514e-03 -2.05714676e-13 2.54293120e-14 1.32139561e-14] Minimization converged after 21 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[-6.45561382e-12 -3.59791500e-03 8.43484098e-04] [ 3.45713647e-11 3.59791499e-03 8.43484083e-04] [ 3.27597676e-11 3.59791502e-03 -8.43482836e-04] [-2.66849043e-11 -3.59791498e-03 -8.43483650e-04] [-2.20239202e-11 6.05340778e-11 -5.51030332e-11] [-9.16191290e-11 -1.89384342e-11 -3.83001686e-11] [ 1.34075362e-10 -6.77183309e-11 -1.32027445e-11] [ 2.53668164e-11 1.30257582e-10 -1.93544514e-10] [-2.24549934e-10 -1.11808396e-10 -2.44603449e-10] [ 1.79471160e-10 -5.56207302e-11 -2.19486793e-10] [ 1.00280118e-10 -5.88361704e-04 -1.90982844e-10] [-1.58872079e-05 5.54701569e-03 -2.06747773e-10] [ 1.58870273e-05 5.54701591e-03 -2.26055474e-10] [-3.33679195e-11 5.88361682e-04 -8.21305512e-11] [ 1.58872994e-05 -5.54701573e-03 -5.77575536e-11] [-1.58872350e-05 -5.54701581e-03 -5.23204155e-11] [-2.62859179e-12 2.91278197e-03 -1.02073329e-03] [ 3.84342558e-12 -2.91278197e-03 -1.02073328e-03] [-2.04125605e-12 -2.91278197e-03 1.02073327e-03] [ 9.01140274e-13 2.91278198e-03 1.02073325e-03] [ 1.18486887e-11 -2.86703069e-03 8.09538827e-03] [-4.62863732e-12 2.86703069e-03 8.09538829e-03] [-4.28002566e-12 2.86703069e-03 -8.09538831e-03] [ 1.13570819e-11 -2.86703069e-03 -8.09538831e-03]] Final stress: [ 3.86145135e-03 6.62452508e-03 3.32198531e-03 -1.47880664e-13 6.92716853e-14 5.88995254e-14] Minimization converged after 21 steps. Minimization converged after 10 steps. Minimization converged after 9 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 63 steps. Minimization converged after 64 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 3.17326720e-12 3.38293016e-04 7.88679470e-05] [-2.10217228e-11 -3.38293033e-04 7.88698534e-05] [-1.22493159e-11 -3.38293081e-04 -7.88677374e-05] [-5.52646817e-12 3.38293102e-04 -7.88699747e-05] [ 1.18496008e-11 -2.83266743e-11 -2.77147749e-11] [-4.15774776e-11 -1.35342640e-11 1.81426818e-11] [ 3.50585116e-11 2.50494070e-12 2.82776857e-11] [ 5.54510078e-12 -1.27322597e-11 -5.47784040e-13] [ 4.13123979e-11 2.22584173e-11 5.52867752e-11] [-5.13962206e-11 3.47104567e-11 6.10013151e-11] [-4.48149851e-11 -5.23339095e-04 -4.15504689e-10] [ 8.61233865e-05 -3.89551856e-04 -3.98881718e-10] [-8.61233042e-05 -3.89551956e-04 -3.92479201e-10] [-1.10147447e-11 5.23340038e-04 2.87899367e-10] [-8.61242103e-05 3.89551438e-04 3.49064612e-10] [ 8.61242278e-05 3.89551415e-04 3.55353920e-10] [ 1.56419322e-12 -5.37191211e-04 -8.20906870e-04] [ 8.69748717e-13 5.37191209e-04 -8.20906801e-04] [ 1.13203891e-12 5.37191218e-04 8.20906842e-04] [ 1.31272770e-12 -5.37191213e-04 8.20906815e-04] [-4.97940578e-12 8.44853609e-04 8.72118344e-04] [-2.01738596e-12 -8.44853608e-04 8.72118375e-04] [-1.11537689e-12 -8.44853611e-04 -8.72118338e-04] [-5.86997118e-12 8.44853615e-04 -8.72118377e-04]] Final stress: [ 4.22187506e-03 2.39302433e-03 2.24179282e-03 -1.47521942e-13 -5.81552866e-16 -1.06878257e-14] Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 1.58025731e-10 -7.80853077e-04 7.71713516e-04] [-1.39799895e-10 7.80852847e-04 7.71722267e-04] [-2.73873417e-11 7.80852954e-04 -7.71710068e-04] [ 5.88508964e-11 -7.80853109e-04 -7.71721753e-04] [-6.22711497e-11 1.23044547e-09 2.93038427e-10] [-5.89921459e-10 -4.28310790e-10 -3.05915848e-11] [ 7.52952978e-10 -5.98660788e-10 1.07399228e-10] [ 1.35238681e-10 -4.36162217e-11 -3.98405642e-10] [ 2.47239340e-10 -6.30374641e-11 -3.19802185e-10] [-5.29099736e-10 2.53365440e-10 -1.27323683e-10] [-2.08680073e-10 1.65380201e-06 -2.29553570e-09] [ 1.40312127e-04 2.06306238e-03 -2.38020438e-09] [-1.40311729e-04 2.06306190e-03 -2.35118682e-09] [ 2.66200395e-10 -1.65166092e-06 1.33344693e-09] [-1.40313777e-04 -2.06306343e-03 1.28740152e-09] [ 1.40313292e-04 -2.06306285e-03 1.30219647e-09] [-5.55097635e-12 2.26234957e-03 -1.14722594e-03] [ 1.29147248e-11 -2.26234959e-03 -1.14722567e-03] [-1.06877840e-11 -2.26234960e-03 1.14722581e-03] [ 1.92181826e-11 2.26234957e-03 1.14722560e-03] [-2.15498175e-11 -1.11959594e-03 6.99473552e-04] [ 2.65669683e-11 1.11959592e-03 6.99473730e-04] [ 3.39234201e-11 1.11959592e-03 -6.99473650e-04] [-2.87929680e-11 -1.11959594e-03 -6.99473811e-04]] Final stress: [ 2.38127521e-03 4.12135166e-03 2.22415966e-03 1.41460687e-13 -3.50283216e-14 -1.88975757e-13] Minimization converged after 20 steps. Minimization converged after 9 steps. Minimization converged after 11 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-2.24231467e-11 -3.53966237e-04 1.65917826e-04] [-7.31922450e-11 3.53966295e-04 1.65930576e-04] [-1.18055257e-10 3.53966199e-04 -1.65917190e-04] [-1.17011900e-10 -3.53966035e-04 -1.65920931e-04] [-6.65829286e-11 -7.33976607e-09 -2.43186260e-09] [ 6.14721739e-09 3.65960837e-09 -2.25444086e-09] [-5.96830624e-09 3.47988954e-09 -2.09488746e-09] [-5.15949204e-11 1.79040582e-09 -3.73305942e-10] [-1.30525646e-09 -7.88298760e-10 -2.28954189e-10] [ 1.46063484e-09 -9.39739397e-10 -3.69842507e-10] [-1.57169611e-10 7.84868640e-05 -1.92194270e-09] [ 1.41805236e-04 3.63164115e-04 -1.87678460e-09] [-1.41804943e-04 3.63163767e-04 -1.92094809e-09] [-6.27905505e-11 -7.84895512e-05 9.80331268e-10] [-1.41803004e-04 -3.63162589e-04 1.02934785e-09] [ 1.41803137e-04 -3.63162736e-04 1.13727924e-09] [-4.90055219e-12 2.61119190e-04 -3.63537912e-04] [-8.54816218e-13 -2.61119189e-04 -3.63537748e-04] [-1.22189481e-11 -2.61119159e-04 3.63537898e-04] [-6.49499898e-12 2.61119163e-04 3.63537674e-04] [-2.15353291e-11 -3.78641687e-04 3.66647922e-04] [-9.58496845e-12 3.78641707e-04 3.66648098e-04] [-1.31661741e-11 3.78641704e-04 -3.66647892e-04] [-2.22761254e-11 -3.78641682e-04 -3.66647994e-04]] Final stress: [ 1.51154041e-03 2.66285973e-03 1.40821776e-03 -2.18427286e-13 4.01535462e-13 -5.18687908e-14] Minimization converged after 24 steps. Minimization converged after 7 steps. Minimization converged after 8 steps. Minimization converged after 47 steps. Minimization converged after 48 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 78 steps. Final forces: [[-1.48063192e-03 1.51031875e-03 2.06362813e-02] [ 3.04729215e-05 -3.18787376e-03 -1.88866450e-02] [-2.43767783e-03 -8.59565995e-04 1.58944236e-02] [ 1.08673158e-03 2.24852372e-03 -1.80146963e-02] [ 1.92191474e-03 -3.46999157e-03 -2.10021004e-02] [-2.39656307e-03 -1.32664103e-03 -1.88591803e-02] [ 1.79254910e-03 1.79562752e-03 -9.08284159e-03] [ 3.23721049e-03 2.44319832e-04 1.28051173e-02] [ 1.60936487e-03 -3.88898636e-03 9.80489921e-03] [-4.63963452e-03 3.16757733e-04 2.16484142e-02] [ 1.53937942e-03 1.88925487e-02 1.68967647e-02] [-3.87331617e-03 -1.04240437e-03 -4.35449398e-03] [ 3.64358453e-03 -9.59121009e-03 -5.90185124e-04] [ 4.15784030e-05 7.86830599e-03 1.00420444e-02] [-1.45059391e-02 -7.58800331e-03 -8.84212069e-03] [ 1.37940987e-02 -7.80951388e-03 -1.07128288e-02] [-1.31028944e-02 9.66465995e-03 1.84775052e-03] [ 1.05657468e-02 -5.59033183e-03 -6.81455985e-04] [-1.11168640e-02 4.99429555e-03 -1.04163647e-03] [ 1.59162186e-02 -1.05966819e-02 4.06977214e-04] [-9.23845544e-03 3.59582812e-03 1.07836914e-02] [ 3.17350818e-03 2.23548833e-03 -5.38489081e-03] [-2.62613137e-03 6.68955235e-03 -6.25201412e-03] [ 7.06574960e-03 -5.10502239e-03 2.93872563e-03]] Final stress: [ 3.61581146e-02 3.61399201e-02 1.44592039e-01 -7.59134475e-06 1.26702450e-05 1.79848315e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 78 steps. Final forces: [[-1.09721625e-03 5.95922009e-04 2.98451068e-03] [-1.24301346e-03 1.25988973e-03 -2.73508736e-03] [ 1.29210594e-03 -1.47538851e-03 5.73079981e-03] [ 1.31141669e-03 -7.61125310e-04 -5.87720129e-03] [-1.95770271e-04 -3.75619413e-03 2.46380784e-03] [ 3.52058090e-03 2.22098253e-03 4.03258324e-03] [-3.64340822e-03 1.92556752e-03 1.92656550e-03] [ 1.37730235e-05 9.83819855e-04 -4.69273154e-03] [-7.14379510e-04 -4.46175086e-04 -2.60452815e-03] [ 4.39484088e-04 -1.01616281e-04 -4.31414497e-03] [-3.10686254e-03 4.18708971e-03 2.22901078e-03] [ 2.22484352e-03 -2.27617766e-04 -6.50171233e-04] [ 7.83828849e-04 -3.41648257e-03 -1.16146690e-03] [-3.01425012e-03 4.28275471e-03 4.14313434e-03] [ 2.14003871e-03 -3.33676193e-04 -3.97724985e-04] [ 8.22790382e-04 -3.42625863e-03 -1.86384048e-04] [ 2.59660694e-03 1.74854986e-03 1.65680283e-04] [-2.06100565e-03 -8.92183146e-04 6.42320084e-05] [ 2.00074507e-03 9.63180296e-04 2.82804745e-05] [-2.57579594e-03 -1.77601340e-03 4.35501402e-05] [ 1.94743240e-03 7.02947165e-04 -7.27952431e-06] [-1.29572551e-04 -4.17368807e-04 -5.65516324e-04] [ 3.32579698e-04 -3.68644971e-04 -2.63934700e-03] [-1.64495170e-03 -1.47195860e-03 2.01942822e-03]] Final stress: [ 3.61671330e-02 3.61434854e-02 1.44654437e-01 6.97828612e-06 -8.47730493e-06 -1.80401121e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 3.00764968e-11 9.89485206e-05 3.07749740e-06] [ 5.42111218e-11 -9.89485963e-05 3.07430831e-06] [ 4.51565039e-12 -9.89485474e-05 -3.06967555e-06] [ 2.91802971e-11 9.89485333e-05 -3.07427627e-06] [ 6.29594880e-11 -7.59550423e-10 -1.83778437e-10] [ 5.77242143e-10 3.10199894e-10 -1.52413915e-10] [-7.21600169e-10 4.65819716e-10 -2.64213068e-10] [ 4.27698457e-11 2.89359470e-09 -1.31321032e-09] [-2.54815313e-09 -1.49280888e-09 -1.33708000e-09] [ 2.45412352e-09 -1.39069101e-09 -1.26886705e-09] [-1.16771037e-11 -1.12223529e-04 -6.05917797e-10] [ 1.02610772e-04 -1.06024363e-04 -6.33440067e-10] [-1.02610765e-04 -1.06024380e-04 -6.79631455e-10] [ 1.17378329e-12 1.12229152e-04 -3.98199251e-10] [-1.02615389e-04 1.06021597e-04 -3.94099901e-10] [ 1.02615378e-04 1.06021605e-04 -3.85177676e-10] [ 9.14254783e-12 -1.29662105e-04 -1.96113073e-04] [ 5.07838216e-12 1.29662104e-04 -1.96112978e-04] [ 6.82043311e-12 1.29662104e-04 1.96112913e-04] [ 2.88041813e-12 -1.29662099e-04 1.96112976e-04] [ 1.07575060e-12 2.02704215e-04 2.25781860e-04] [ 2.77517899e-12 -2.02704228e-04 2.25781888e-04] [ 1.51768512e-12 -2.02704228e-04 -2.25781913e-04] [ 5.13256104e-13 2.02704217e-04 -2.25781910e-04]] Final stress: [ 1.68068725e-03 9.52302045e-04 8.84815568e-04 -1.81100523e-13 1.45282682e-13 -1.04601253e-14] Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 27 steps. Minimization converged after 7 steps. Minimization converged after 6 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 6.11658850e-05 -3.84138946e-04 -3.07655518e-04] [ 6.11548107e-05 3.84138346e-04 -3.09332030e-04] [-6.11550145e-05 3.84139321e-04 3.08604719e-04] [-6.11678179e-05 -3.84138875e-04 3.06705859e-04] [-3.52802192e-09 1.68274583e-06 5.40804270e-07] [-1.45460166e-06 -8.37657224e-07 5.28896869e-07] [ 1.46359781e-06 -8.46909042e-07 5.50706986e-07] [ 1.29180102e-09 -9.82959896e-08 -6.55692950e-08] [ 8.44859366e-08 4.71834783e-08 -6.77482294e-08] [-8.90988597e-08 5.13414954e-08 -6.30160662e-08] [ 8.53594084e-10 9.66899371e-04 2.91565922e-08] [-4.84308994e-04 5.58568677e-04 -1.49367686e-04] [ 4.84307760e-04 5.58570362e-04 1.49423350e-04] [ 3.74848708e-10 -9.64790171e-04 6.83850450e-08] [ 4.82480765e-04 -5.59624208e-04 1.49457424e-04] [-4.82479803e-04 -5.59624318e-04 -1.49321449e-04] [ 2.28828603e-04 -3.60340830e-04 2.73465100e-04] [ 2.28833271e-04 3.60341235e-04 2.73499929e-04] [-2.28833703e-04 3.60341192e-04 -2.73496001e-04] [-2.28828788e-04 -3.60340741e-04 -2.73466303e-04] [-3.02289503e-04 -4.01491150e-04 4.32982383e-04] [-3.02293647e-04 4.01491742e-04 4.32975751e-04] [ 3.02293350e-04 4.01490845e-04 -4.32993396e-04] [ 3.02289450e-04 -4.01490260e-04 -4.33003751e-04]] Final stress: [ 8.07405638e-05 -2.98900704e-05 5.22127108e-05 -1.83763863e-12 -7.02128086e-04 8.03819687e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-5.09728263e-05 -3.89927477e-04 -2.84193124e-04] [-5.09822493e-05 3.89926559e-04 -2.82801566e-04] [ 5.09783075e-05 3.89926781e-04 2.82582395e-04] [ 5.09830544e-05 -3.89926219e-04 2.82125202e-04] [ 4.98666798e-10 8.50874076e-07 2.24191937e-07] [-7.37903242e-07 -4.26618934e-07 2.28061974e-07] [ 7.36251667e-07 -4.25089740e-07 2.19552693e-07] [ 2.78938292e-09 -1.22823841e-06 3.74531501e-07] [ 1.06169174e-06 6.11574867e-07 3.67038925e-07] [-1.06765723e-06 6.18239125e-07 3.81538879e-07] [-2.06410783e-09 9.54980871e-04 -8.02783587e-08] [-4.82731642e-04 5.61037088e-04 1.54401200e-04] [ 4.82738686e-04 5.61030654e-04 -1.54562448e-04] [ 1.67748532e-09 -9.55578428e-04 2.50398476e-07] [ 4.83248131e-04 -5.60739025e-04 -1.54231435e-04] [-4.83258852e-04 -5.60730933e-04 1.54733418e-04] [-2.27183372e-04 -3.62258875e-04 2.66934340e-04] [-2.27180989e-04 3.62258849e-04 2.66946489e-04] [ 2.27182606e-04 3.62258557e-04 -2.66918160e-04] [ 2.27182981e-04 -3.62258829e-04 -2.66948667e-04] [ 3.02355831e-04 -3.98397399e-04 4.30651733e-04] [ 3.02355741e-04 3.98397422e-04 4.30668757e-04] [-3.02354309e-04 3.98396224e-04 -4.30669622e-04] [-3.02356381e-04 -3.98396562e-04 -4.30683548e-04]] Final stress: [ 8.05130499e-05 -2.98306598e-05 5.25846252e-05 5.15453614e-12 7.01528309e-04 -6.81714416e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 75 steps. Final forces: [[ 4.95615498e-04 2.05400705e-03 -8.95154402e-03] [-5.78265600e-04 3.81735676e-03 9.07234392e-03] [ 1.34173621e-03 -5.14642743e-03 -5.92868184e-03] [ 1.14782459e-05 -3.83313701e-03 6.61204441e-03] [ 6.54017100e-04 2.04841554e-03 -3.65714534e-03] [-4.25551759e-03 -1.11115651e-03 -5.61058649e-03] [ 3.71434343e-03 -7.64841264e-05 -2.74316721e-03] [-6.56632327e-04 1.92735275e-03 2.20098535e-03] [-1.49143965e-03 -2.96979235e-04 5.05642656e-04] [ 4.83719052e-04 -4.64776780e-04 4.10583678e-03] [-6.13604486e-06 -6.81772088e-05 4.79030385e-03] [-4.57960701e-04 -5.60155704e-04 8.14490128e-04] [-1.26898276e-04 1.67003382e-03 -2.05961247e-03] [ 1.61795351e-04 -2.94064463e-04 2.39370603e-03] [ 5.70321935e-04 1.95169009e-03 1.77283742e-03] [-2.46006544e-04 -5.55397920e-04 -6.71180674e-04] [-3.80511726e-03 8.07800866e-04 1.42762234e-04] [ 2.15932174e-03 2.01522151e-03 4.42893768e-05] [-2.20080666e-03 -2.02948422e-03 1.20941351e-04] [ 4.11757558e-03 -9.62908570e-04 2.90288541e-04] [-1.19167631e-03 7.27772128e-04 4.35652418e-04] [ 5.92975062e-04 1.84063760e-03 -2.18047591e-03] [-8.84849123e-04 -2.19408583e-03 7.92389653e-05] [ 1.59840687e-03 -1.26705311e-03 -1.57896950e-03]] Final stress: [ 3.61647198e-02 3.61535420e-02 1.44660405e-01 2.47032153e-05 -2.31254890e-06 1.12510692e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 76 steps. Final forces: [[ 2.38432718e-03 2.53168374e-03 1.06744605e-03] [ 2.85656485e-03 -1.85552498e-04 1.10585111e-03] [-2.60872248e-04 1.57938748e-03 -9.33618484e-03] [ 4.40964169e-04 2.61760267e-04 1.11724605e-02] [ 9.15209572e-04 -3.06782820e-02 -1.60599987e-04] [ 2.88266018e-02 1.48224091e-02 5.70896202e-03] [-3.19535807e-02 1.73476157e-02 9.88232630e-04] [-9.17293643e-03 2.83940861e-03 -6.60890139e-03] [-1.35246458e-02 6.23568779e-03 1.62333572e-03] [ 2.39844121e-02 -9.79766365e-03 -4.81367949e-03] [-6.83363324e-03 -1.57689793e-02 4.75882639e-03] [ 1.34968136e-02 -1.66890539e-02 1.01483459e-03] [-9.65224567e-03 2.87116315e-02 -7.64226801e-03] [-4.76310259e-03 -1.57587679e-02 5.89094619e-03] [ 1.13546733e-02 -1.78244148e-02 -6.60901144e-03] [-1.01286499e-02 2.92467054e-02 -7.46738685e-03] [ 3.44207603e-03 7.01834618e-03 -7.73812111e-05] [-7.85754745e-03 -4.70147882e-03 -4.64752293e-04] [ 7.52323679e-03 6.59355033e-03 -1.16950023e-04] [-4.07485887e-03 -6.17095857e-03 -9.10242557e-04] [ 2.32587557e-03 3.34320525e-03 3.66165655e-03] [-1.78311349e-03 -2.82499822e-03 1.63514665e-03] [ 3.54323660e-03 2.69325970e-03 5.17360944e-03] [-1.08880523e-03 -2.82450159e-03 4.06050227e-04]] Final stress: [ 3.61675815e-02 3.61501104e-02 1.44653206e-01 2.12150246e-06 9.10023936e-06 -1.12810479e-03] Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 8 steps. Minimization converged after 9 steps. Minimization converged after 51 steps. Minimization converged after 51 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-4.03273501e-05 -1.20296893e-04 -7.63149586e-05] [-4.03264785e-05 1.20296705e-04 -7.60856000e-05] [ 4.03275665e-05 1.20296860e-04 7.62220818e-05] [ 4.03265514e-05 -1.20296890e-04 7.60429869e-05] [ 1.65851287e-10 1.10524607e-07 2.32263037e-08] [-9.52896426e-08 -5.53328474e-08 2.27606433e-08] [ 9.50170098e-08 -5.49860280e-08 2.31062324e-08] [-3.85324775e-10 -1.00938157e-07 2.49393702e-08] [ 8.76496334e-08 5.08432612e-08 2.51717021e-08] [-8.72068278e-08 5.01452729e-08 2.47158404e-08] [ 3.34789474e-10 1.45332443e-04 -3.64838752e-08] [-2.09627471e-04 2.03603746e-04 -7.35513508e-05] [ 2.09626071e-04 2.03604933e-04 7.34782591e-05] [-2.16686669e-10 -1.45400386e-04 3.66185178e-08] [ 2.09686128e-04 -2.03569935e-04 7.35512209e-05] [-2.09685082e-04 -2.03570780e-04 -7.34778756e-05] [ 1.51697767e-05 -1.13143412e-04 7.28612675e-05] [ 1.51695232e-05 1.13143390e-04 7.28649302e-05] [-1.51696680e-05 1.13143353e-04 -7.28611289e-05] [-1.51696514e-05 -1.13143387e-04 -7.28668777e-05] [-6.42952987e-05 -1.19276556e-04 1.46895098e-04] [-6.42953743e-05 1.19276566e-04 1.46898045e-04] [ 6.42952439e-05 1.19276521e-04 -1.46898112e-04] [ 6.42954450e-05 -1.19276535e-04 -1.46902039e-04]] Final stress: [ 3.70766053e-05 1.26437791e-06 2.88298331e-05 2.11236686e-13 -4.06133907e-04 9.45838808e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 4.83163716e-05 -1.17310726e-04 -9.10261638e-05] [ 4.83139179e-05 1.17311043e-04 -9.04808843e-05] [-4.83164773e-05 1.17310716e-04 9.08822779e-05] [-4.83151890e-05 -1.17311108e-04 9.06075894e-05] [-4.05975808e-10 1.62252579e-08 -9.59790286e-09] [-1.28789938e-08 -7.44607721e-09 -1.03351669e-08] [ 1.39598213e-08 -8.53479137e-09 -9.40023687e-09] [-2.67871079e-10 -9.05804223e-08 2.68743352e-08] [ 7.81597572e-08 4.55805316e-08 2.67841781e-08] [-7.75583326e-08 4.49194098e-08 2.67263260e-08] [-7.45056128e-10 1.32501855e-04 -7.80586952e-08] [-2.45073346e-04 1.91173775e-04 8.88990997e-05] [ 2.45076325e-04 1.91171186e-04 -8.90542545e-05] [ 2.80043544e-10 -1.32713788e-04 6.93059945e-08] [ 2.45257163e-04 -1.91067233e-04 -8.89079283e-05] [-2.45258955e-04 -1.91065864e-04 8.90460392e-05] [-1.49840825e-05 -1.05127360e-04 8.89553779e-05] [-1.49835401e-05 1.05127410e-04 8.89616019e-05] [ 1.49837115e-05 1.05127297e-04 -8.89534222e-05] [ 1.49837135e-05 -1.05127367e-04 -8.89660820e-05] [ 6.70954715e-05 -1.25640504e-04 1.63377926e-04] [ 6.70954987e-05 1.25640551e-04 1.63384552e-04] [-6.70953069e-05 1.25640482e-04 -1.63380426e-04] [-6.70958191e-05 -1.25640527e-04 -1.63387601e-04]] Final stress: [ 3.78341436e-05 1.53694123e-06 2.75436915e-05 3.54132938e-12 4.07336252e-04 -1.89266290e-12] Minimization converged after 176 steps. Minimization converged after 166 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.21612026e-10 -4.35304993e-05 3.74311201e-05] [ 6.76589047e-13 4.35306715e-05 3.74397085e-05] [ 3.76870309e-10 4.35306057e-05 -3.73458512e-05] [-1.18767524e-10 -4.35300098e-05 -3.74234931e-05] [ 5.30535263e-11 -3.29575506e-08 -9.67235808e-09] [ 2.71478287e-08 1.61421463e-08 -8.96849292e-09] [-2.71791433e-08 1.62211554e-08 -8.92730131e-09] [ 3.01173851e-10 2.11951217e-08 -1.20700882e-08] [-1.86406729e-08 -1.10203694e-08 -1.24357812e-08] [ 1.78818204e-08 -1.02393778e-08 -1.18085208e-08] [ 2.51138832e-10 2.04204596e-04 -1.34999141e-08] [ 9.13515345e-07 4.86410078e-05 -1.36961494e-08] [-9.14000070e-07 4.86415744e-05 -1.34463907e-08] [-2.80753698e-10 -2.04112983e-04 1.67757251e-09] [-9.93811194e-07 -4.86869577e-05 1.92777826e-09] [ 9.94280270e-07 -4.86875482e-05 2.03093951e-09] [-6.45966614e-12 1.29052701e-04 -5.41468242e-05] [ 4.09398626e-11 -1.29052653e-04 -5.41443936e-05] [ 4.58155736e-12 -1.29052549e-04 5.41445250e-05] [ 4.16349177e-11 1.29052622e-04 5.41449666e-05] [ 4.19737578e-11 -7.89400009e-05 1.42676109e-04] [-3.39851037e-11 7.89400378e-05 1.42677471e-04] [-1.55557309e-11 7.89400501e-05 -1.42677178e-04] [ 2.76810241e-11 -7.89400043e-05 -1.42677272e-04]] Final stress: [ 3.89102893e-04 6.62195442e-04 3.49196373e-04 -9.94228220e-13 -3.76272743e-13 2.33974160e-13] Minimization converged after 27 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 53 steps. Minimization converged after 55 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.97863798e-05 4.58045550e-06 -1.45010874e-04] [ 1.97933246e-05 -4.58078547e-06 -1.43015010e-04] [-1.97896296e-05 -4.58063691e-06 1.44191369e-04] [-1.97907371e-05 4.58040890e-06 1.43355677e-04] [-1.09055325e-10 4.23132449e-08 -2.40709038e-08] [-3.59499204e-08 -2.09976689e-08 -2.41190616e-08] [ 3.53696013e-08 -2.07953590e-08 -2.52554513e-08] [ 3.01867309e-10 -5.55212935e-07 1.72710517e-07] [ 4.81316129e-07 2.77842364e-07 1.74621533e-07] [-4.80398752e-07 2.77668162e-07 1.71078645e-07] [ 1.16997945e-09 2.72341921e-05 -2.44939217e-07] [ 3.43234289e-05 1.02827879e-04 3.34073837e-05] [-3.43285254e-05 1.02832147e-04 -3.38972107e-05] [-1.14824378e-09 -2.79103732e-05 2.62247676e-07] [-3.37383361e-05 -1.02489769e-04 -3.33876964e-05] [ 3.37436466e-05 -1.02494147e-04 3.39122310e-05] [ 3.66558247e-05 -3.94827512e-05 8.50057728e-05] [ 3.66546488e-05 3.94827677e-05 8.50280476e-05] [-3.66551872e-05 3.94826455e-05 -8.49964607e-05] [-3.66552028e-05 -3.94827567e-05 -8.50393439e-05] [ 9.78634949e-06 -6.09338907e-05 1.17228586e-04] [ 9.78632452e-06 6.09339118e-05 1.17255074e-04] [-9.78701025e-06 6.09337700e-05 -1.17239303e-04] [-9.78585041e-06 -6.09338856e-05 -1.17260516e-04]] Final stress: [ 2.67264959e-05 9.72419428e-06 1.45147827e-05 3.39592800e-12 -2.49400777e-04 4.12445671e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[-1.49486955e-05 -5.36686051e-05 -1.19892914e-04] [-1.49471741e-05 5.36687881e-05 -1.20551600e-04] [ 1.49458102e-05 5.36699558e-05 1.20199372e-04] [ 1.49466631e-05 -5.36695317e-05 1.19783862e-04] [-1.15489797e-09 6.74860928e-07 1.87217706e-07] [-5.82498671e-07 -3.36019504e-07 1.86875771e-07] [ 5.84718996e-07 -3.38636827e-07 1.86354360e-07] [-8.61650789e-10 -1.18830866e-07 -1.25765480e-08] [ 1.04424860e-07 6.02913185e-08 -1.25010634e-08] [-1.02087118e-07 5.79538076e-08 -1.44308040e-08] [-6.28742058e-10 2.47577403e-05 1.85240577e-08] [ 3.71253621e-05 7.08213300e-05 -2.53478656e-05] [-3.71241806e-05 7.08199068e-05 2.53830498e-05] [-8.04848244e-10 -2.42355126e-05 -2.51248726e-08] [-3.75764254e-05 -7.10808510e-05 2.53405083e-05] [ 3.75784480e-05 -7.10829084e-05 -2.53921533e-05] [-3.08810842e-05 -3.83290063e-05 8.93694934e-05] [-3.08815170e-05 3.83288969e-05 8.93746179e-05] [ 3.08811870e-05 3.83288388e-05 -8.93815867e-05] [ 3.08808539e-05 -3.83289149e-05 -8.93708822e-05] [-5.96298582e-06 -6.51466291e-05 1.21891267e-04] [-5.96264087e-06 6.51467460e-05 1.21885307e-04] [ 5.96241680e-06 6.51466930e-05 -1.21901480e-04] [ 5.96285451e-06 -6.51465555e-05 -1.21903334e-04]] Final stress: [ 2.67660781e-05 1.00245197e-05 1.40791340e-05 -1.01470387e-12 2.49548746e-04 3.38364882e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 75 steps. Final forces: [[ 0.00191407 -0.00253082 0.02689074] [-0.01809356 0.00415746 -0.01139875] [ 0.04297408 -0.0882358 0.05403402] [ 0.10042738 -0.09922687 -0.05416044] [-0.01001033 -0.10786289 0.00145927] [-0.01175202 0.06842609 -0.04872776] [ 0.00750435 0.05628003 0.00513274] [-0.02479813 0.14935703 -0.01041141] [-0.01868204 -0.04832047 -0.04216709] [ 0.01041337 -0.06629418 0.03362838] [ 0.12579304 -0.05723081 0.05612683] [-0.03979115 -0.10513916 0.02448614] [-0.13282615 0.27723707 -0.02301066] [ 0.11521887 -0.07817715 0.03903316] [-0.07559326 -0.12510539 0.01530278] [-0.13051238 0.28393804 -0.04162615] [-0.0661301 -0.03364423 0.01524011] [ 0.0628793 -0.00558184 0.00368917] [-0.06579202 0.00791701 -0.00354354] [ 0.06582603 -0.00904156 -0.00939871] [ 0.0182145 -0.00137103 0.01125755] [ 0.03715097 0.00854632 0.01222501] [-0.03408163 -0.0109968 0.00078922] [ 0.03974682 -0.01710004 -0.05485062]] Final stress: [ 0.036003 0.03596745 0.14369715 0.00024402 -0.00016711 0.00032275] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 3.33361564e-04 2.43031341e-04 -1.61187873e-04] [-3.36052602e-04 -2.41960788e-04 3.22447571e-04] [-3.33076515e-04 -2.42750442e-04 3.43745217e-05] [ 3.34314108e-04 2.41978911e-04 -4.76993649e-04] [-1.63123085e-06 1.61049963e-04 4.03481724e-05] [-1.38303328e-04 -7.88877231e-05 3.81817663e-05] [ 1.40565892e-04 -8.21007549e-05 4.14274739e-05] [ 1.09722650e-06 -2.27820608e-04 5.24413868e-05] [ 1.96435978e-04 1.12876114e-04 4.99426637e-05] [-1.97333917e-04 1.14689221e-04 5.28930637e-05] [-1.43398841e-02 -7.75476564e-04 -8.68399440e-05] [ 6.79374936e-03 -1.17484380e-02 -8.75208504e-05] [ 6.09349389e-03 1.05280650e-02 -8.56911743e-05] [ 1.43397291e-02 8.87669631e-04 9.32997619e-05] [-6.89094078e-03 1.16928475e-02 9.31907092e-05] [-5.99503997e-03 -1.05847806e-02 9.20446019e-05] [-8.35244628e-05 1.46903913e-03 -1.96236673e-03] [ 8.44067503e-05 -1.46935541e-03 -1.94861046e-03] [ 8.30453732e-05 -1.46928686e-03 1.95985818e-03] [-8.35824870e-05 1.46943835e-03 1.94975107e-03] [ 1.03680674e-03 4.24779952e-04 1.19861427e-04] [-1.03647880e-03 -4.24809195e-04 1.28653921e-04] [-1.03864505e-03 -4.24608239e-04 -1.26782976e-04] [ 1.03748727e-03 4.24810064e-04 -1.32722641e-04]] Final stress: [-4.13132150e-04 -2.35281168e-04 -1.87277524e-04 3.22052441e-09 2.77539816e-08 -1.64212376e-04] Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 26 steps. Minimization converged after 8 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[ 0.03286557 0.00896822 0.27716523] [ 0.01099014 -0.04383345 -0.11821232] [ 0.02834784 -0.05302661 0.2823588 ] [ 0.01241015 -0.09859611 -0.10316681] [-0.0647379 0.32006228 -0.01035612] [-0.1971124 -0.06745712 0.11709551] [ 0.20026897 -0.07451537 0.03009122] [-0.0194761 0.30415967 -0.05979717] [-0.20683573 -0.12349133 -0.08883209] [ 0.21680817 -0.13533678 -0.08034561] [-0.00184367 0.05366907 -0.13571134] [-0.16822268 -0.01432586 -0.03098825] [ 0.16381883 -0.0276649 0.02337576] [-0.05900087 0.03866375 0.00531615] [-0.12647633 -0.07757679 -0.07176245] [ 0.17959639 0.00752145 -0.01800035] [-0.01264028 -0.00634127 -0.00041497] [ 0.0022328 -0.00952504 -0.01902169] [-0.00466571 -0.0031103 -0.00697953] [ 0.00149549 -0.00525486 0.01656094] [-0.00237392 0.00676253 0.02457713] [ 0.00500526 -0.01518647 -0.01390604] [-0.00111101 0.00928074 -0.0209764 ] [ 0.010657 0.00615456 0.00193039]] Final stress: [ 1.14200884e-04 -1.43577588e-04 1.73046523e-04 1.02564351e-03 3.00974278e-05 1.67822518e-04] Minimization converged after 56 steps. Minimization converged after 48 steps. Minimization converged after 47 steps. Minimization converged after 170 steps. Minimization converged after 183 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 4.55273708e-10 -4.23524122e-05 -1.66310752e-04] [ 1.32027233e-10 4.23520251e-05 -1.66297462e-04] [-3.19696891e-10 4.23520844e-05 1.66332539e-04] [-3.62823910e-10 -4.23519066e-05 1.66302156e-04] [ 5.11114920e-11 -6.70391315e-09 -1.73307618e-09] [ 5.81413188e-09 3.38774037e-09 -1.87629362e-09] [-5.81718429e-09 3.41772799e-09 -1.79906118e-09] [ 2.57436213e-10 9.32783562e-09 -4.24220981e-09] [-7.89518373e-09 -4.82415186e-09 -4.09501633e-09] [ 7.41486866e-09 -4.26868979e-09 -3.80330984e-09] [-3.92152311e-10 -2.57331781e-04 -5.29721741e-09] [-9.09941294e-05 3.86782598e-05 -5.05900393e-09] [ 9.09948278e-05 3.86773714e-05 -5.63437731e-09] [ 3.14284154e-11 2.57343552e-04 2.19791334e-09] [ 9.09836351e-05 -3.86838068e-05 2.28311169e-09] [-9.09836902e-05 -3.86837278e-05 3.08953570e-09] [ 3.09852421e-11 -4.41594681e-05 1.20000589e-05] [ 6.13150086e-11 4.41594326e-05 1.20007217e-05] [-2.90997226e-11 4.41595022e-05 -1.20004084e-05] [ 9.15742482e-12 -4.41594848e-05 -1.20007595e-05] [-3.22125104e-11 4.48329196e-05 2.46223807e-06] [ 1.29635929e-11 -4.48329187e-05 2.46272966e-06] [-6.78376740e-12 -4.48328991e-05 -2.46242602e-06] [-5.88969429e-11 4.48329209e-05 -2.46266693e-06]] Final stress: [ 2.67411019e-04 1.61669203e-04 1.43428417e-04 -1.68143505e-12 3.65420056e-12 -2.08190758e-13] Minimization converged after 27 steps. Minimization converged after 29 steps. Minimization converged after 27 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 14 steps. Minimization converged after 14 steps. Minimization converged after 13 steps. Minimization converged after 13 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.89223108e-05 5.61160144e-04 -2.12672928e-04] [-1.89223224e-05 -5.61160163e-04 -2.12683154e-04] [-1.89223025e-05 -5.61160150e-04 2.12682363e-04] [ 1.89223153e-05 5.61160181e-04 2.12684110e-04] [ 6.96966942e-12 -1.58258406e-11 -6.36337094e-11] [ 5.98938954e-12 -4.36541775e-12 -4.89843444e-11] [-1.33846823e-11 1.10538245e-11 -5.36928280e-11] [-1.35555171e-11 9.01493102e-09 -2.60509259e-09] [-7.80378828e-09 -4.49224291e-09 -2.60402400e-09] [ 7.82181075e-09 -4.52337678e-09 -2.59748718e-09] [-1.42023527e-04 -1.10647060e-05 6.68619263e-10] [-1.82159247e-06 2.47251492e-04 6.45392458e-10] [-5.51125513e-05 1.09059695e-04 6.67270620e-10] [ 1.42023531e-04 1.10631761e-05 -1.50644445e-09] [ 1.82291185e-06 -2.47250733e-04 -1.47033937e-09] [ 5.51112266e-05 -1.09058928e-04 -1.47331167e-09] [-1.29369912e-04 2.03077770e-05 9.22350760e-05] [ 1.29369912e-04 -2.03077789e-05 9.22349140e-05] [ 1.29369913e-04 -2.03077763e-05 -9.22350887e-05] [-1.29369911e-04 2.03077786e-05 -9.22349755e-05] [ 4.39350584e-05 -7.79848348e-06 -8.76984590e-06] [-4.39350613e-05 7.79848315e-06 -8.77006741e-06] [-4.39350635e-05 7.79848341e-06 8.77002889e-06] [ 4.39350605e-05 -7.79848188e-06 8.77000929e-06]] Final stress: [ 1.34024004e-05 1.50069756e-05 5.70168358e-06 -1.35353007e-13 -4.16496087e-14 1.00789808e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.76226304e-05 5.60083579e-04 -2.10060004e-04] [ 1.76226319e-05 -5.60083606e-04 -2.10070850e-04] [ 1.76226637e-05 -5.60083592e-04 2.10076889e-04] [-1.76226517e-05 5.60083620e-04 2.10074264e-04] [-9.26920541e-12 -5.01193992e-09 -1.26776634e-09] [ 4.35601970e-09 2.51428712e-09 -1.26937719e-09] [-4.33536268e-09 2.49333382e-09 -1.26296243e-09] [ 8.29206305e-12 1.32510671e-08 -4.02916811e-09] [-1.15194099e-08 -6.64809252e-09 -4.04272427e-09] [ 1.14788721e-08 -6.60362681e-09 -4.02383916e-09] [ 1.39785892e-04 -1.02840824e-05 -1.20332675e-11] [ 5.41096947e-05 1.11706445e-04 -3.54028153e-11] [ 7.03838797e-06 2.44774575e-04 -1.47505765e-11] [-1.39785888e-04 1.02892654e-05 -1.52325693e-09] [-5.41141868e-05 -1.11709040e-04 -1.48989193e-09] [-7.03389776e-06 -2.44777162e-04 -1.48057304e-09] [ 1.28116578e-04 2.08071074e-05 9.02781833e-05] [-1.28116580e-04 -2.08071088e-05 9.02781686e-05] [-1.28116579e-04 -2.08071074e-05 -9.02783254e-05] [ 1.28116579e-04 2.08071105e-05 -9.02781496e-05] [-4.41138711e-05 -7.41276544e-06 -7.23819082e-06] [ 4.41138740e-05 7.41276467e-06 -7.23833495e-06] [ 4.41138815e-05 7.41276469e-06 7.23840444e-06] [-4.41138778e-05 -7.41276389e-06 7.23839797e-06]] Final stress: [ 1.34535906e-05 1.50169183e-05 5.78326922e-06 -1.50811293e-13 -3.46079802e-14 -1.00931200e-04] Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.1,_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]: [[ 1.13811 0.64259 0.62804 -0. -0. 0. ] [ 0.64259 1.13107 0.57727 0. -0. 0. ] [ 0.62804 0.57727 1.11945 -0. -0. -0. ] [-0. 0. -0. -0.31731 0. -0. ] [-0. -0. -0. 0. -0.38408 0. ] [ 0. 0. -0. -0. 0. 0.38733]] 95%% Error estimate [ASE units]: [[0.06983 0.0453 0.07806 0. 0. 0. ] [0.0453 0.02639 0.00095 0. 0. 0. ] [0.07806 0.00095 0.00013 0. 0. 0. ] [0. 0. 0. 0.00233 0. 0.00015] [0. 0. 0. 0. 0.04707 0. ] [0. 0. 0. 0.00015 0. 0.00101]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.039028 is too big compared to maximum elastic constant component 1.138110 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.139575 WARNING: Maximum deviation from material symmetry according to space group 194 is too big compared to maximum elastic constant component 1.138110 [ASE units] and requested fractional tolerance 0.010000. WARNING: None of the calculations successfully completed with errors within tolerance. Using the following run with the lowest errors: 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]: [[ 1.16991 0.6426 0.59804 0.00045 0. 0.0001 ] [ 0.6426 1.16991 0.59708 0.00001 0.00005 0.00003] [ 0.59804 0.59708 1.11954 -0.00001 0. -0. ] [ 0.00045 0.00001 -0.00001 -0.21588 0. 0.00009] [ 0. 0.00005 0. 0. -0.21595 0.00005] [ 0.0001 0.00003 -0. 0.00009 0.00005 0.26894]] 95%% Error estimate [ASE units]: [[0.01362 0.02507 0.02095 0.00046 0.00004 0.00017] [0.02507 0.01365 0.00917 0.00023 0.00017 0.00004] [0.02095 0.00917 0.00294 0.00003 0. 0.00004] [0.00046 0.00023 0.00003 0.00019 0.00001 0.00014] [0.00004 0.00017 0. 0.00001 0.00026 0.00035] [0.00017 0.00004 0.00004 0.00014 0.00035 0.00696]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.012536 is too big compared to maximum elastic constant component 1.169908 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.005281 R E S U L T S Elastic constants [GPa]: [[187.43948 102.95524 95.81704 0.07247 0.00037 0.01523] [102.95524 187.43998 95.66249 0.00179 0.00866 0.0041 ] [ 95.81704 95.66249 179.37038 -0.00117 0.00015 -0.00017] [ 0.07247 0.00179 -0.00117 -34.58766 0. 0.01445] [ 0.00037 0.00866 0.00015 0. -34.59884 0.00746] [ 0.01523 0.0041 -0.00017 0.01445 0.00746 43.08827]] 95 %% Error estimate [GPa]: [[2.1824 4.01683 3.35587 0.07329 0.00654 0.02674] [4.01683 2.18739 1.46885 0.0372 0.02681 0.00598] [3.35587 1.46885 0.47132 0.00447 0.00063 0.00569] [0.07329 0.0372 0.00447 0.03015 0.00109 0.0228 ] [0.00654 0.02681 0.00063 0.00109 0.04102 0.0563 ] [0.02674 0.00598 0.00569 0.0228 0.0563 1.11467]] Maximum deviation from material symmetry [GPa] = 0.84615 Bulk modulus [GPa] = 126.81821 Unique elastic constants for space group 194 [GPa] ['c11', 'c12', 'c13', 'c33', 'c44'] [187.43948092272936, 102.95524154241022, 95.81703567660065, 179.3703838570249, -34.5876646278951] WARNING: Nearest isotropic state not computed.