Model name? Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000 Stoichiometric species (literal list of strings)? ['O', 'Si'] Prototype label? A2B_cF96_227_cf_e 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': 1.54842e-09, 'parameter-names.source-value': ['x2', 'x3'], 'parameter-values.source-value': [0.057687096, 0.24007909], 'meta.uuid': 'TE_981478359585_002-and-SM_714124634215_000-1711748695-tr'}] Runtime arguments (literal dictonary)? {} ==== Building ASE atoms object with: ==== representative atom symbols = ['O', 'O', 'Si'] representative atom coordinates = [[0.125 0.125 0.125 ] [0.88492091 0. 0. ] [0.1826871 0.1826871 0.1826871 ]] spacegroup = 227 cell = [[15.4842, 0, 0], [0, 15.4842, 0], [0, 0, 15.4842]] ========================================= 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)) The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 6.10026311e-02 7.34459035e-02 -1.32561770e-01] [ 9.30038507e-02 -1.30072707e-01 -3.21831403e-02] [-1.31112570e-01 -8.66409977e-02 4.68347075e-02] [-3.64263517e-02 9.38800291e-02 -1.29138100e-01] [-1.32150976e-01 8.88469047e-02 -3.90789188e-02] [ 1.21520359e-01 1.04541450e-02 -1.09492859e-01] [-3.89287554e-02 -1.27821580e-01 9.48234415e-02] [ 5.86741707e-02 7.65546962e-02 -1.32433903e-01] [ 1.31324833e-01 -7.25299561e-02 6.58944756e-02] [ 9.55579690e-02 -3.92136645e-02 -1.27180566e-01] [-7.80346222e-02 -5.62121111e-02 -1.32576776e-01] [ 6.88727675e-03 -1.11507184e-01 -1.19955354e-01] [-6.25483078e-02 -7.14270359e-02 1.33531950e-01] [ 1.13087677e-01 1.18023943e-01 -6.53283841e-03] [ 1.04879474e-01 1.25163935e-01 -1.51919150e-02] [-2.16846707e-02 -1.04491861e-01 1.24445189e-01] [-4.00732000e-03 1.90952113e-03 -1.87482428e-03] [ 4.15281350e-03 -8.30232454e-04 -6.44460868e-04] [ 5.88070090e-03 2.68673307e-03 2.30708979e-03] [-4.62141999e-03 1.73959643e-03 -1.59211105e-03] [-2.53534827e-03 -4.89412133e-03 2.15804387e-03] [-2.69285655e-03 4.83739414e-03 -2.55618986e-03] [-2.48704022e-04 5.97452926e-03 6.02352183e-05] [-6.44266912e-05 -5.70865431e-03 2.02094224e-04] [-2.53839654e-03 2.17575452e-03 -3.16910215e-03] [ 3.04966878e-03 3.00170215e-03 4.38013390e-03] [ 8.35658568e-04 5.93162158e-04 5.46100331e-03] [ 3.81163446e-05 -1.82831766e-04 -4.49005505e-03] [ 2.83288045e-03 -4.28170120e-03 2.92767201e-03] [-2.88589333e-03 3.63928963e-03 3.13014523e-03] [-2.54490572e-03 3.77040604e-03 2.54012682e-03] [-2.05484475e-03 -6.05738747e-03 -1.93321734e-03] [-6.77620524e-03 7.36486331e-04 4.29842405e-04] [ 5.12233611e-03 2.53340596e-03 -2.51673840e-03] [ 4.30979608e-03 -2.35307842e-03 2.73462577e-03] [-4.62010757e-03 -3.36206615e-04 5.32107556e-05] [ 1.36337175e-03 -1.37628064e-03 5.93478019e-03] [-1.54288373e-03 -1.79538399e-03 -4.79413508e-03] [ 5.63219539e-04 6.58522826e-04 -5.40044184e-03] [-1.41037541e-03 1.45139625e-03 3.97701821e-03] [-5.13298237e-03 2.35506740e-04 5.71581250e-04] [ 2.05384356e-03 3.15583488e-03 -2.51480789e-03] [-6.67655290e-05 -5.13492948e-03 -1.42512299e-04] [-4.25807391e-04 4.28644781e-03 5.49970486e-04] [ 4.82369542e-03 5.68474043e-03 -5.66790804e-03] [-1.03547669e-03 8.73220068e-04 4.76974031e-03] [-3.33898464e-03 -3.50761104e-03 3.04844899e-03] [ 1.08206562e-03 5.48587733e-03 8.47076749e-04] [ 5.88167559e-03 -8.30861559e-04 -5.72426151e-04] [-5.10875530e-03 7.69121695e-04 -6.29144560e-04] [-1.68158648e-03 1.54746551e-03 -2.56898431e-03] [-1.76253803e-03 -9.14554007e-04 5.73728885e-03] [-6.14551636e-03 7.00972037e-04 -3.44022480e-05] [ 2.99254524e-03 2.54555470e-04 9.88545789e-04] [-3.90194795e-04 2.56399689e-03 8.29386994e-05] [ 8.33842581e-04 -6.34446658e-03 -3.80722710e-04] [ 6.02923046e-03 -5.51137365e-04 4.95016417e-04] [-3.24726772e-03 7.40862020e-04 1.12927621e-03] [-1.49312701e-03 1.25478547e-03 7.08081297e-03] [-2.79415305e-03 -2.87693528e-03 -2.44888299e-03] [ 3.37493464e-04 -3.32936179e-03 8.57525815e-04] [ 1.63119369e-03 6.25479596e-03 -2.04440272e-03] [-1.59121598e-03 1.84160967e-03 -5.61901529e-03] [-2.04567602e-03 -1.94914621e-03 4.58246477e-03] [-2.31920431e-02 -5.98749789e-02 2.35388632e-02] [ 3.50701195e-03 1.09331289e-01 2.33920519e-02] [ 4.60337746e-02 3.46489622e-02 -4.64071480e-02] [ 2.52778025e-03 -3.48287745e-02 3.63859371e-02] [-5.53564262e-02 5.66094418e-02 2.77392700e-02] [-6.93123862e-04 -4.02775275e-02 7.11203865e-02] [ 8.06477604e-02 1.33710147e-03 -6.75538057e-02] [ 4.13242077e-03 -1.48263073e-02 2.95348033e-02] [ 1.21004668e-01 1.03427759e-02 6.93955405e-02] [-3.96068691e-02 -1.14148510e-02 7.38093434e-02] [-3.16313421e-02 1.05315375e-01 -5.77047482e-02] [ 3.75131871e-02 -4.86047807e-02 4.03167272e-02] [-7.85382890e-02 3.41246689e-04 -1.94538501e-02] [-1.43060030e-02 2.48175566e-02 -1.36113625e-01] [ 1.00221968e-03 -6.46652424e-02 5.78852986e-02] [-2.25172513e-02 5.97212352e-02 5.29708422e-03] [-3.46946387e-02 9.14387486e-03 6.90521071e-02] [-6.16991319e-02 2.54991034e-02 -3.49169187e-02] [-4.31594029e-02 -4.11468900e-02 4.75398752e-02] [-5.91786968e-02 1.15828449e-02 -1.64331496e-02] [ 6.33324590e-02 4.70107818e-02 7.88242350e-02] [-3.57946357e-02 7.33481132e-02 3.28984940e-02] [ 1.38648919e-02 1.43935366e-02 7.64602403e-02] [ 2.67208195e-02 8.04980451e-03 4.00854734e-02] [ 3.80597261e-03 6.53386340e-02 3.65841230e-02] [-4.24184757e-02 -1.55817169e-02 1.63783081e-02] [-5.39440862e-03 -4.06158838e-02 -1.51977748e-02] [-4.97990916e-02 -5.41876079e-02 2.39068732e-02] [-3.83927477e-02 -6.27124317e-02 -3.34121030e-03] [-4.89434081e-02 -2.14106217e-02 3.19711555e-02] [ 7.58736376e-04 1.51210149e-02 -5.57027549e-03] [ 1.64018846e-02 3.36396524e-02 -1.40695302e-02]] Final stress: [-3.30551007e-05 -3.37220814e-05 -3.26496082e-05 1.81832237e-05 -1.00207468e-05 1.11236704e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-1.30389079e-01 9.02489413e-02 4.19583505e-02] [ 5.66560884e-02 -1.28959675e-01 -8.44551169e-02] [-1.24968123e-01 -1.31487898e-02 1.05117528e-01] [-1.33404122e-01 -7.77558923e-02 -5.51850833e-02] [-1.20461321e-01 1.07316752e-01 -2.99578021e-02] [-1.33767772e-01 -3.65979067e-02 8.77168026e-02] [ 1.35937217e-01 7.72188867e-02 4.95153707e-02] [ 5.04982030e-02 -1.31775624e-01 8.27153923e-02] [-1.29361427e-01 4.07821597e-02 -9.21453355e-02] [ 9.86146745e-02 1.28988304e-01 2.25482694e-02] [-5.77997666e-02 1.37040654e-01 6.92046939e-02] [ 5.45846868e-02 -7.81580202e-02 -1.33450658e-01] [-1.33830699e-01 6.61555215e-02 6.74654748e-02] [ 1.47211655e-02 -1.08819160e-01 1.21581229e-01] [ 1.35892228e-01 4.97935189e-02 7.74172183e-02] [-1.29557865e-01 9.64933448e-02 2.84282501e-02] [-3.48601216e-03 -1.37741947e-03 1.62913334e-03] [ 3.58653918e-03 1.80385041e-03 1.18031162e-03] [ 3.39998549e-03 1.47599790e-03 1.58427745e-03] [-4.41487767e-03 -4.52930970e-03 4.32275837e-03] [ 6.21405037e-04 -2.95953203e-03 -6.14237282e-04] [ 1.33908093e-03 4.92997305e-03 1.12485589e-03] [ 4.83016412e-04 4.97155909e-03 1.30867409e-04] [-9.37672686e-04 -4.71163619e-03 7.40044656e-04] [ 1.10433499e-04 7.90940046e-05 -3.71361671e-03] [ 1.33253524e-03 1.07239284e-03 2.60475229e-03] [-1.35335196e-03 -1.68377066e-03 3.10389854e-03] [ 4.54801025e-04 -3.02054005e-04 -5.64738099e-03] [ 5.22841903e-04 -4.37326060e-03 3.74449379e-04] [-4.02551783e-03 4.41336247e-03 3.89908887e-03] [-1.88676250e-03 4.76532575e-03 1.86758477e-03] [ 1.50308357e-03 -2.97047813e-03 1.49564953e-03] [-3.53308966e-03 2.48064083e-05 8.44545737e-05] [ 3.63153264e-03 -7.72185542e-04 9.46911882e-04] [ 4.83410359e-03 -4.97836951e-03 4.62312255e-03] [-3.25347065e-03 9.63585267e-04 1.12252541e-04] [-1.93126373e-03 1.73818838e-03 3.29411769e-03] [-1.96863163e-03 -1.82436226e-03 -5.12024284e-03] [ 7.00951371e-04 7.17370310e-04 -3.71775461e-03] [-2.06155557e-05 -4.40125118e-05 2.22345141e-03] [-4.48652303e-03 -1.51219273e-03 -1.54082636e-03] [ 4.11265980e-03 -1.15756420e-04 1.40701096e-04] [-1.37014202e-04 -1.38928182e-03 -6.03086395e-04] [ 2.24754685e-03 4.57125455e-03 -2.09903599e-03] [ 2.84980695e-04 3.65635018e-05 -4.16846129e-03] [ 7.36088992e-04 -3.43881058e-04 1.13406206e-03] [-3.92280229e-03 -2.12197122e-03 3.79333424e-03] [ 1.81052186e-03 2.46502686e-03 1.49326023e-03] [ 5.58291249e-03 -4.52886379e-04 -6.42854546e-04] [-3.16557546e-03 3.74473888e-04 -6.92901764e-04] [ 1.87478498e-03 -1.86713054e-03 -5.18242942e-03] [-1.90705577e-03 -1.53779138e-03 1.55920178e-03] [-2.61106129e-03 -3.73976794e-03 3.66156187e-03] [ 4.22663957e-03 -1.94966093e-03 -2.23455034e-03] [-4.04530563e-04 5.19718659e-03 -3.64138893e-04] [-9.10297632e-04 -3.90081042e-03 1.05950079e-03] [ 5.30400818e-03 -3.80429873e-03 3.61852685e-03] [-3.21147219e-03 1.32155679e-03 1.11109064e-03] [ 3.05662143e-03 -2.88480643e-03 4.46331067e-03] [-2.73083168e-03 -2.95094153e-03 -6.19221065e-03] [ 1.31666451e-03 -3.94923583e-03 1.06184659e-03] [-1.82872011e-03 3.18787495e-03 1.65747699e-03] [-6.81400898e-04 5.94463980e-04 -4.66124899e-03] [-1.33806214e-03 -1.43215319e-03 4.08755129e-03] [ 6.73249011e-02 -1.59984823e-02 -3.64289661e-02] [-8.43700658e-03 5.41450187e-02 3.08183329e-02] [ 8.31078937e-02 -2.69590280e-02 -1.84996750e-02] [ 7.91536984e-02 2.51928955e-02 -2.02868514e-02] [-1.16224729e-01 1.94469417e-02 5.59935872e-02] [ 6.29273152e-02 -7.36776681e-02 -4.14072682e-02] [ 2.73371150e-02 -6.85126222e-03 -6.16327473e-02] [ 4.44426153e-02 6.64938303e-02 -2.88438581e-03] [ 4.50098688e-02 -6.47926175e-02 5.00936776e-02] [ 7.73171959e-02 -4.50577616e-04 -2.01756829e-02] [-6.71737002e-02 -2.58303592e-02 -4.73826748e-03] [-1.28607439e-02 -6.93543808e-02 2.73425468e-02] [ 8.19886941e-02 -2.34716753e-03 -2.96663040e-02] [-9.14383885e-02 -2.95135220e-02 -7.33024484e-03] [ 2.59837501e-03 5.15115496e-02 -9.84957727e-02] [ 6.76061919e-02 1.59416034e-02 5.56387169e-02] [ 1.71655404e-02 -7.16148339e-02 -2.67779289e-02] [ 2.77188376e-02 -3.79909937e-03 7.16269963e-02] [ 2.80410493e-02 8.36205053e-02 -8.55841156e-02] [ 4.39890025e-03 -8.08328441e-02 -1.50416432e-02] [ 1.13771402e-02 -6.89355568e-02 -6.58002609e-02] [-3.56907913e-02 2.91106040e-02 7.64745142e-02] [-1.26413235e-05 -1.26580514e-01 7.44974782e-03] [-1.80142934e-02 4.39132968e-02 5.36446065e-02] [ 7.02859218e-02 -2.69179986e-02 -3.36290786e-02] [ 1.39659645e-02 1.13525556e-01 -4.27480583e-02] [ 4.57921730e-02 -2.17858814e-02 -3.62109065e-02] [ 4.00006357e-02 6.75782328e-02 -7.83000763e-02] [-4.13666118e-02 1.62266986e-02 -2.83268788e-02] [-1.09628261e-01 1.80218634e-02 -4.67673419e-02] [ 3.03083490e-02 -5.35357510e-02 -1.36188433e-03] [ 1.20687575e-01 -3.39990174e-02 -2.45140193e-03]] Final stress: [-1.84271307e-05 6.90664981e-05 6.93455289e-05 -2.43931637e-06 -3.23059216e-06 1.96402158e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 63 steps. Final forces: [[-6.24057171e-02 -7.71211074e-02 1.30385603e-01] [-5.54095053e-02 -2.76267090e-02 -1.57414857e-01] [ 7.45113824e-02 1.40556901e-01 4.02523475e-02] [ 5.28697501e-02 -7.19837512e-02 1.37189265e-01] [-9.60686359e-02 -6.10205156e-02 -1.18520951e-01] [-4.42318624e-02 5.20786384e-02 1.51249867e-01] [ 1.07975364e-01 1.22083676e-01 -1.69345897e-02] [ 1.21681025e-01 -1.15653355e-02 -1.08098124e-01] [ 1.24152348e-01 -9.65132445e-02 4.64260468e-02] [ 5.51719402e-02 -6.10315251e-02 -1.41850719e-01] [-8.19558609e-02 -5.43023846e-02 -1.31145838e-01] [-4.90017887e-02 -1.38701844e-01 -7.15464184e-02] [-1.35362577e-01 1.74190928e-02 9.21499829e-02] [ 1.15667856e-01 -4.15705078e-02 1.10077311e-01] [-7.20803394e-02 9.59935072e-02 -1.15132719e-01] [ 1.10938313e-01 -1.17930038e-01 2.34907121e-02] [-2.01630046e-03 1.25543539e-02 -1.48079548e-02] [-4.81239073e-03 -6.05570017e-03 -5.64812750e-03] [ 3.87495521e-03 -5.56649886e-03 -4.87988746e-03] [-1.89144845e-03 6.93462169e-03 -5.58675692e-03] [-1.21269232e-03 1.74198779e-02 5.08512636e-04] [-3.69951575e-03 8.06082973e-04 -3.22538241e-03] [-6.31798838e-03 -2.49973770e-03 -6.61862227e-03] [ 1.05513355e-03 1.22639409e-02 1.24600862e-02] [-1.68232857e-02 4.10428836e-03 4.01152635e-03] [-5.27450187e-03 -2.54365870e-03 -2.03476968e-02] [ 7.10624223e-03 -5.63541325e-03 -1.05206560e-02] [ 7.21114029e-03 -6.96469917e-03 5.50879739e-03] [ 8.76338613e-03 1.70112560e-03 -4.60087253e-03] [ 4.30095691e-03 -5.22916548e-03 7.72587392e-03] [ 6.10819107e-03 -2.57354678e-02 1.31569493e-02] [-2.02008567e-02 2.27727631e-02 -1.83024395e-02] [-3.98248179e-03 1.56476692e-02 1.27760298e-02] [ 2.50826562e-05 1.32995554e-02 -2.38057500e-02] [-8.28579494e-03 -1.76480198e-02 1.54996113e-02] [ 1.01608407e-04 4.21429392e-03 3.61079492e-03] [-8.47916905e-03 2.12034569e-02 -1.11324755e-02] [ 7.95667183e-03 -6.64105876e-03 2.39972987e-02] [ 5.47293234e-03 -4.04618065e-03 3.03243490e-02] [ 1.91489558e-02 -6.68557918e-03 -1.16431066e-02] [ 7.71401707e-04 -4.48955562e-03 -2.06480643e-03] [ 7.47333255e-03 -9.81755252e-03 4.61451724e-03] [ 8.02459672e-03 2.06121952e-02 -3.78947933e-03] [-6.76588880e-05 -1.10922864e-02 -1.24275809e-02] [ 3.50837068e-03 -2.30624264e-03 1.71272837e-02] [ 5.54238023e-03 8.90669728e-03 -2.75890014e-02] [-8.65728573e-04 6.42484152e-03 1.53959852e-03] [-1.21404883e-02 -1.43533976e-02 9.22348021e-04] [-9.03754153e-04 -3.73083696e-03 -6.54103388e-03] [ 1.60231542e-03 5.76004618e-03 -2.90836106e-03] [-6.19028996e-04 -9.19885547e-03 2.13623049e-02] [-9.10990235e-03 -8.64447894e-03 -3.62494448e-03] [ 8.09445964e-03 -2.89429914e-03 2.41075630e-03] [ 1.30172058e-03 3.77436589e-03 9.02839127e-03] [-3.01991450e-03 -8.92485119e-03 9.52706045e-03] [ 7.69551299e-03 2.39657719e-02 -7.05257681e-03] [-2.07043633e-02 -7.13044408e-04 8.14458491e-03] [-7.58316512e-03 -1.51572332e-03 -2.40743722e-03] [-9.85413400e-03 -2.52323558e-03 -5.24911201e-03] [ 3.96271120e-03 -7.68917008e-03 5.28627432e-03] [ 2.02155508e-02 1.76795854e-02 5.12900242e-03] [-2.08281314e-02 -1.86991555e-02 1.80492069e-02] [-3.97014325e-03 3.38354449e-03 1.45918400e-03] [ 1.09222603e-02 8.03557102e-03 -1.75138205e-02] [-1.15598864e-01 2.73201763e-01 1.08859687e-01] [-1.12794456e-01 -3.20570418e-01 4.01182654e-02] [-4.35182120e-02 -2.59919814e-01 3.27626313e-01] [ 1.66134481e-02 1.70024828e-01 -5.56354668e-02] [-1.40472219e-01 5.26117662e-02 1.66029380e-01] [ 2.55451874e-01 -1.16202256e-01 -1.63215263e-01] [-1.21559259e-01 2.45494077e-01 -6.37836519e-03] [-6.50659109e-02 1.44246503e-02 -2.46488547e-01] [ 2.07533080e-01 1.54897212e-01 2.23341102e-01] [-7.99930058e-02 -1.62801598e-02 -4.61709778e-02] [-1.46742127e-02 -2.56466054e-01 1.58243306e-01] [-1.15761122e-01 9.23752404e-02 -2.45378728e-01] [-1.18571433e-01 2.65236225e-02 -3.33233721e-01] [-1.74230874e-01 -1.92673088e-02 1.53365658e-01] [ 7.32819829e-02 6.76655976e-02 -1.45018854e-01] [ 5.97750133e-03 1.12055671e-01 1.80151211e-01] [ 2.96715698e-01 -1.82675590e-01 1.98638454e-01] [-5.21590267e-02 1.35861335e-01 -2.93355287e-01] [ 2.67582038e-02 -5.67309851e-02 3.59531733e-03] [-6.60904515e-02 5.40728347e-02 -1.69220443e-01] [ 1.73468785e-01 -9.02701579e-02 -1.34665209e-02] [-2.65143759e-01 3.42532571e-02 6.16514772e-02] [ 3.21445232e-03 6.64107969e-02 1.49035558e-01] [ 9.42242140e-02 1.39293562e-01 1.48756183e-02] [ 2.73522135e-01 2.30539063e-01 -1.27303441e-01] [ 2.23101379e-02 3.67514676e-02 9.79671985e-02] [-8.36426702e-02 -1.51204859e-01 1.59618676e-01] [ 8.16982366e-03 1.00530715e-01 2.65011820e-01] [ 2.56228561e-01 -8.27575580e-03 9.09990986e-03] [-8.93875575e-02 -1.16533661e-01 -2.83104497e-01] [-4.30351669e-02 -2.02791725e-01 8.65101216e-02] [-1.55800420e-01 9.18156478e-02 -1.48238341e-01]] Final stress: [-2.16359808e-04 8.56945832e-05 6.98214411e-05 1.08283449e-04 -1.20083885e-04 3.60004963e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-9.00455155e-02 1.27958010e-01 -4.91975910e-02] [ 4.84137855e-03 -1.22173308e-01 -1.08598127e-01] [ 1.32231588e-01 7.51918344e-02 -6.08980056e-02] [-9.30930125e-03 -1.18850964e-01 1.12622865e-01] [-5.59925470e-02 -9.05895014e-02 -1.24263587e-01] [-1.20860007e-01 -1.09021204e-01 1.68882978e-02] [ 3.94178848e-02 1.27103854e-01 -9.46547930e-02] [-8.37613422e-02 -6.13153090e-02 1.26807740e-01] [ 1.61190575e-03 -1.11107017e-01 -1.20135196e-01] [ 1.20670650e-01 1.06591385e-01 -2.29648731e-02] [-8.28615781e-02 1.23950533e-01 6.89242607e-02] [-1.22938413e-01 -2.04958680e-02 1.06531668e-01] [-1.02537611e-01 -2.85963400e-02 1.23959117e-01] [ 1.20895105e-01 1.07484973e-01 2.80387338e-02] [ 1.28858459e-01 9.79397494e-02 2.49893016e-02] [-1.09117790e-01 -2.13134282e-02 1.20532697e-01] [ 2.29417823e-03 3.03879459e-03 -2.82195142e-03] [ 4.43039139e-04 3.49629359e-03 3.31780780e-03] [ 6.10316974e-03 -3.95147933e-03 -3.55356442e-03] [-1.96557462e-03 9.00722213e-04 -7.40800526e-04] [ 2.53759266e-03 3.76633989e-03 -2.63309932e-03] [-4.49312446e-04 -1.56922661e-03 -3.42870215e-04] [ 4.06304021e-03 -1.10087930e-03 3.39203732e-03] [ 3.19473569e-03 -9.02704041e-03 -3.03941900e-03] [ 9.42149687e-04 -1.37840226e-03 4.12690119e-03] [ 1.11699828e-03 9.28170868e-04 9.68079254e-03] [ 7.79856508e-03 7.59303417e-03 1.81713274e-03] [-2.04415334e-03 1.79662195e-03 -3.15594114e-03] [ 3.40982313e-03 4.28441088e-05 3.05786102e-03] [ 3.91077863e-04 1.34169423e-04 -4.96846722e-04] [ 2.42953205e-03 -2.62675602e-03 -1.92196346e-03] [ 7.58889677e-03 -7.06855741e-03 7.22460666e-03] [-1.54019214e-03 -2.37686005e-03 -2.07191252e-03] [ 3.19660080e-03 2.68651890e-03 -2.66961016e-03] [-2.94972749e-03 -5.78864743e-03 5.47612019e-03] [-1.81367952e-03 2.70909580e-03 2.91439704e-03] [ 4.93155026e-03 -5.56136998e-03 1.54062568e-03] [ 1.07869888e-02 1.04889280e-02 4.98229227e-05] [ 9.99914694e-03 1.00113082e-02 -7.65308434e-03] [ 2.59559164e-03 -3.38850747e-03 -5.78734941e-04] [-6.47771445e-03 7.51432493e-03 7.41486958e-03] [-2.92255693e-03 1.47458258e-03 -1.04259785e-03] [-2.21251766e-03 -4.58930106e-03 -2.19432763e-03] [ 8.65684060e-06 2.63835771e-03 -2.63201748e-04] [ 6.15453021e-03 6.49073503e-03 -3.91523138e-04] [-6.49953086e-03 5.65977705e-03 3.72637541e-03] [-3.25022335e-03 -9.13062044e-04 2.97599515e-03] [-5.91579629e-04 7.80893349e-03 -3.70618381e-04] [ 1.31592827e-04 1.80780514e-03 1.48125613e-03] [-8.42597551e-03 -3.06072997e-04 2.01574322e-04] [-2.66420997e-03 1.61713683e-03 -8.94131673e-04] [ 5.91792670e-03 6.00990504e-03 -2.63896723e-04] [-1.40005555e-03 1.58356272e-03 -1.33774605e-03] [-6.27895396e-03 9.75772830e-04 1.27378294e-03] [ 3.02888518e-03 -6.23303109e-03 3.10781180e-03] [ 1.40103015e-03 -1.98153941e-03 -9.31093498e-04] [ 8.76230719e-04 7.59001170e-03 -7.19357645e-03] [ 1.56423891e-03 -5.73392972e-03 -5.90990518e-03] [-1.50684227e-03 1.36328244e-03 3.98152377e-03] [-4.71674021e-03 -4.90894472e-03 8.96915102e-04] [-2.45201214e-03 2.01378774e-03 -1.94083708e-03] [ 2.30851592e-03 -1.12113868e-04 -2.21757144e-03] [ 2.79418632e-03 -3.40712937e-03 -7.17077463e-03] [ 6.33945139e-03 6.46506713e-03 -3.16409787e-03] [-8.62720362e-02 -6.73114445e-02 -7.55361413e-02] [ 4.56975215e-02 1.07883062e-01 4.16339657e-03] [-2.06152196e-01 -1.26348626e-02 -4.42351365e-02] [-6.71542276e-02 2.87115947e-02 -7.60561285e-02] [ 2.99238339e-02 -1.64222632e-02 1.85555007e-02] [ 9.13604695e-02 4.70195218e-02 1.51008180e-01] [-5.10635121e-02 -1.24313400e-01 1.22122626e-01] [-3.65314018e-02 3.68813708e-02 -4.98666368e-02] [ 6.41408212e-02 4.78965936e-02 3.37640681e-02] [ 1.00694805e-01 5.81873572e-02 -2.14393073e-02] [-2.03042127e-03 -2.02984422e-02 6.85818600e-02] [ 1.09799699e-01 9.27978667e-02 -3.59256895e-02] [ 1.57413841e-02 -1.19742466e-03 -5.82250781e-02] [-3.96558488e-02 -1.34945452e-01 -1.54827606e-02] [ 1.01986175e-01 -8.31784329e-03 9.03052234e-03] [ 3.88202095e-03 4.14396736e-02 -1.03747231e-02] [ 5.00685222e-02 -1.73851926e-02 8.66869407e-02] [ 2.07084758e-02 3.58383000e-02 3.91657583e-02] [ 5.76685045e-02 1.19065559e-01 -2.06538557e-02] [-9.35643227e-02 -4.63287439e-02 -3.25203105e-02] [ 6.54602430e-02 6.11727337e-02 -9.56779785e-02] [ 1.01451158e-02 4.74967872e-02 -9.57185423e-02] [ 3.89650808e-02 -1.01583192e-01 9.62600203e-03] [ 1.04983230e-01 -3.25351471e-02 7.63153314e-03] [-3.84813740e-03 6.03592128e-02 -1.44266531e-02] [-9.79530451e-02 -6.59529120e-02 7.51476628e-02] [ 6.87004213e-02 2.92133407e-02 4.91606595e-03] [-6.32778305e-02 -1.65442414e-01 -7.92477244e-02] [-1.60320518e-01 -8.03582471e-02 6.44782568e-03] [-6.05762301e-02 -7.88147112e-02 -3.24106066e-02] [ 1.85474441e-01 1.30746009e-01 9.42210338e-02] [-1.22902733e-02 -9.02077227e-02 -1.22546725e-01]] Final stress: [ 7.12097549e-05 8.48011900e-05 5.08595177e-05 8.99885312e-06 3.08336867e-06 -5.18317232e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.75659488e-02 -1.00232747e-01 1.26869154e-01] [-4.71005232e-02 -8.84790225e-02 -1.29952041e-01] [-3.99972832e-02 -1.31774333e-01 -8.90220807e-02] [ 7.73934887e-02 1.32720733e-01 -5.71247132e-02] [ 1.28703401e-01 -2.75966869e-02 9.77284427e-02] [-1.15947450e-01 -1.15877660e-01 -3.93391252e-03] [ 9.49893854e-02 1.28648309e-01 -3.67481738e-02] [-1.32729395e-01 8.23600317e-02 4.98622333e-02] [-1.33860824e-01 7.35657738e-02 -5.97057634e-02] [ 9.88779384e-02 -3.28096012e-02 -1.26563799e-01] [-3.40323314e-02 1.29327375e-01 9.51962689e-02] [ 1.15000549e-01 2.41207157e-03 -1.17047531e-01] [ 2.42395671e-02 -1.24254962e-01 1.04338572e-01] [ 3.54328449e-02 1.29301721e-01 -9.45352345e-02] [ 1.22598124e-01 1.40560777e-02 1.07909135e-01] [ 1.34012256e-01 -7.09352602e-02 -6.23539572e-02] [-1.41358761e-03 3.45788319e-05 4.22238871e-05] [ 8.91410664e-04 -3.72952641e-06 2.63712657e-05] [ 2.34429718e-03 6.16611779e-04 6.58538296e-04] [-1.90875485e-03 2.10065551e-04 -5.29760956e-05] [ 4.55625836e-04 -2.02016234e-03 -1.09657397e-04] [-2.53084345e-03 2.87323477e-03 -2.37238436e-03] [ 1.82324878e-03 1.11798839e-03 1.65430712e-03] [-3.15108940e-04 -2.67907017e-03 2.00321773e-04] [-3.64756742e-05 9.87408618e-05 -1.85599743e-03] [-3.21415846e-06 1.46781111e-04 3.17482654e-03] [-2.23826936e-03 -2.22306886e-03 3.11291711e-03] [-1.21989196e-04 -2.48965386e-05 -2.92534687e-03] [ 1.23565169e-03 -9.86880056e-04 1.15321813e-03] [-1.19940978e-03 2.02068373e-03 8.40593439e-04] [-1.23465880e-03 1.81627233e-03 1.24132692e-03] [ 1.35272648e-03 -1.10531371e-03 1.25321688e-03] [-2.11276682e-03 9.21116282e-04 6.85196213e-04] [ 2.34420892e-03 -1.15973073e-03 1.14471333e-03] [ 2.29673448e-03 3.74065427e-04 -3.19039080e-04] [-3.92926663e-04 -8.79753525e-04 -8.00193784e-04] [ 4.01315851e-04 -4.32050075e-04 1.64293627e-03] [-1.50314837e-03 -1.50328835e-03 -2.89472039e-03] [-9.73048321e-05 -1.22454221e-04 -2.51058809e-03] [-2.64120497e-03 2.40381607e-03 3.02859916e-03] [-2.45158093e-03 1.29827134e-03 1.35779491e-03] [ 1.15648851e-03 -1.02034025e-03 1.02718494e-03] [-5.02341408e-04 -1.36420844e-03 -5.43268274e-04] [-1.54311614e-03 1.03019327e-03 1.60542465e-03] [ 7.81383910e-04 9.16389425e-04 -2.69954972e-03] [-7.03887180e-04 8.79712836e-04 3.12671111e-03] [ 1.05303654e-03 -2.20554661e-03 -1.27414804e-03] [-5.63216776e-04 2.29730115e-03 -3.78381904e-04] [ 3.07901032e-03 -1.78797557e-03 -1.57926055e-03] [-2.18375640e-03 1.14286243e-03 -1.08771583e-03] [-1.12327458e-03 9.95385761e-04 -1.87959863e-03] [ 2.51130710e-03 2.32543216e-03 2.60276053e-03] [-2.28278598e-03 1.21257832e-03 -1.29080873e-03] [ 1.71373046e-03 -3.87071147e-04 -2.78542759e-04] [-5.28332608e-04 2.02864004e-03 -6.01790519e-04] [-1.21410418e-03 -2.20927683e-03 1.28630705e-03] [ 1.87474946e-03 2.87275803e-04 -5.02475904e-05] [-1.98075094e-03 1.41807220e-04 -1.09379216e-04] [ 2.87581033e-04 -2.22625537e-04 1.55517127e-03] [-2.95438932e-04 -1.29187230e-04 -3.33541708e-03] [-1.24013655e-03 -2.61542508e-03 -1.08641563e-03] [-5.66301931e-04 1.18435521e-03 4.47011920e-04] [-1.41648243e-03 1.35587077e-03 -2.72947704e-03] [ 4.92822564e-04 2.43508427e-04 2.49640249e-03] [ 1.27937432e-02 4.75119869e-02 -5.28504512e-02] [-2.27308436e-03 6.28871140e-02 5.82720859e-02] [ 5.83349932e-02 7.48654408e-02 -5.93708081e-03] [-1.91964276e-03 -2.00027224e-02 5.01925458e-02] [ 2.38458300e-02 5.31693287e-02 2.09193955e-02] [ 1.70661293e-02 2.15623659e-02 -5.15569439e-02] [ 1.31752786e-02 6.17515030e-02 3.01889607e-02] [-3.50875974e-02 -4.11267008e-02 8.82368073e-03] [-4.55374917e-02 2.46483822e-02 2.62299052e-03] [ 3.45791816e-02 5.10614096e-02 2.37249502e-02] [-5.28048489e-02 -5.27130049e-02 2.64950126e-02] [-2.91034749e-02 6.27861664e-03 7.78758721e-03] [ 2.04444802e-02 1.00614886e-02 2.53667267e-02] [-4.26078571e-02 -3.86797767e-02 1.14394116e-02] [ 2.16440444e-02 -6.25947549e-02 -4.40681099e-03] [ 3.61220887e-03 -1.59288242e-02 6.12849474e-03] [-4.61897314e-02 3.55730535e-02 3.09101048e-02] [ 6.09868623e-02 -9.39923037e-03 4.32944134e-02] [ 8.84976749e-02 -1.67685901e-02 -1.52087125e-02] [-3.23231739e-02 2.27819451e-02 2.81887618e-02] [ 3.06465376e-02 -5.50328106e-02 -4.82746806e-02] [-7.35556906e-02 -1.60913063e-02 4.21602271e-02] [ 3.29093960e-02 -8.60527493e-02 -2.93120988e-02] [-5.93163230e-02 -4.39718207e-02 6.83853797e-02] [ 1.58715436e-02 5.91039678e-02 -4.14773585e-02] [-5.04299465e-02 -4.67811883e-02 1.77644761e-02] [-4.70764407e-02 1.52967432e-02 -5.21453007e-02] [-2.01017043e-03 -4.71226967e-02 3.19422490e-02] [-5.85254559e-02 -2.97768101e-02 -4.02971855e-02] [-7.80725677e-02 -3.24284250e-03 -4.59121076e-02] [-2.04240078e-03 1.70639365e-02 1.04087661e-02] [-6.52959634e-02 1.63452411e-02 3.48467399e-02]] Final stress: [ 7.77806399e-06 -3.02813246e-05 -1.63697246e-05 -8.75322494e-06 -3.85105719e-06 3.72173732e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 4.38290994e-02 -2.27303765e-02 -2.07241077e-02] [-3.00829231e-02 1.28352789e-01 9.77455198e-02] [-1.33693376e-01 -7.39990379e-02 5.97409244e-02] [-3.62884788e-02 -1.29936842e-01 9.33211253e-02] [-4.78397149e-02 1.15053658e-03 -4.63810077e-02] [-5.77984270e-02 -1.33668598e-01 -7.56382281e-02] [ 1.54022240e-02 -2.52337335e-02 4.07754116e-02] [ 8.23875938e-02 4.95948458e-02 -1.32914834e-01] [ 8.04553031e-02 5.19832075e-02 1.33275996e-01] [-6.26118691e-02 5.87754096e-03 6.82080837e-02] [-1.04330773e-01 1.24897944e-01 2.11099507e-02] [-8.20960838e-03 2.09027715e-02 2.93194657e-02] [ 9.95808832e-02 2.80373294e-02 -1.27394364e-01] [-3.04251697e-02 -1.28205011e-01 9.78391106e-02] [ 3.87450284e-02 1.30423405e-01 -9.17997905e-02] [ 1.13451663e-01 4.81013416e-03 -1.18489269e-01] [-2.90740982e-03 2.22584754e-04 -2.23017947e-04] [ 3.71432995e-03 2.59638077e-03 2.62857066e-03] [ 3.53380026e-03 9.83035220e-05 1.24932762e-04] [-3.34240230e-03 1.37973682e-03 -1.37778001e-03] [-9.80627197e-04 -2.58173338e-03 9.77106482e-04] [-1.30280732e-03 2.54947558e-03 -1.28269606e-03] [ 1.45815107e-03 2.70579503e-03 1.49821177e-03] [ 3.93300075e-04 -3.13372765e-03 -4.15534512e-04] [-1.29970053e-03 1.33836852e-03 -4.18262792e-03] [ 1.83547975e-04 1.89175428e-04 4.69352453e-03] [ 1.37038548e-04 1.48146802e-04 4.68548361e-03] [-1.25282521e-03 1.25655758e-03 -5.22154582e-03] [ 1.21464450e-03 -2.57448279e-03 1.21538950e-03] [ 1.32875654e-03 3.51197597e-03 -1.32546504e-03] [ 1.39145163e-04 3.04208360e-03 -1.44396005e-04] [-7.49437188e-05 -3.30872899e-03 -3.33911645e-05] [-3.75859140e-03 -5.47621997e-05 -4.42553173e-05] [ 3.40064967e-03 1.64300703e-03 -1.65251870e-03] [ 3.36887887e-03 -1.36774957e-03 1.37089898e-03] [-3.49793004e-03 -7.35091561e-04 -6.98620304e-04] [ 1.28027647e-03 -1.24275560e-03 4.14257708e-03] [-1.08687725e-03 -1.08745035e-03 -4.04300790e-03] [ 1.46314099e-03 1.43781167e-03 -4.04068382e-03] [ 2.65077322e-03 -2.66891665e-03 4.66779969e-03] [-3.75801108e-03 4.69860894e-04 4.68791938e-04] [ 3.91490088e-03 -2.48191848e-03 2.44601563e-03] [ 4.00824079e-04 -2.32210533e-03 4.22677658e-04] [ 1.41255093e-03 2.51841012e-03 -1.41011559e-03] [-1.57121229e-03 -1.59696933e-03 -5.08738259e-03] [ 1.20102818e-03 -1.14184854e-03 4.02654805e-03] [-4.14491598e-04 -4.01779014e-03 3.70228708e-04] [-7.55924217e-04 2.68953330e-03 -7.42660829e-04] [ 3.74270450e-03 1.87068330e-04 1.37930426e-04] [-3.35809920e-03 1.40617835e-03 -1.41498412e-03] [-1.41170894e-03 1.44441619e-03 -4.25060034e-03] [ 1.82224600e-03 1.81054420e-03 4.50276134e-03] [-4.15966948e-03 7.32332806e-04 -7.67775429e-04] [ 4.28183117e-03 -1.18138715e-03 -1.21229807e-03] [-2.60635081e-03 3.13115572e-03 -2.59848773e-03] [ 2.40107850e-04 -2.93995596e-03 -2.45668699e-04] [ 3.45135505e-03 -9.80447752e-04 9.66501903e-04] [-4.77598954e-03 -2.86654644e-04 -2.80328634e-04] [-5.69515779e-04 6.02293606e-04 4.59799331e-03] [ 1.12388090e-03 1.11732464e-03 -5.02726793e-03] [ 2.41915040e-03 -2.98037774e-03 2.42510419e-03] [-1.13801954e-03 3.49192856e-03 1.12643509e-03] [-8.96142029e-04 9.35165368e-04 -4.22757902e-03] [-2.45001432e-03 -2.43391703e-03 4.68586416e-03] [-1.35207773e-02 4.03617513e-02 2.27759533e-02] [-1.76068299e-02 -8.08608766e-02 -3.59245400e-02] [ 7.09004439e-02 3.67256575e-02 -3.14787357e-03] [ 1.76868997e-02 4.59828885e-02 -3.31425026e-02] [ 2.48932606e-02 -5.66769021e-02 -7.13468338e-02] [-3.96295621e-02 -1.81016075e-02 -1.21356605e-02] [ 4.77552373e-02 4.00876042e-02 -4.05119171e-02] [ 1.58275765e-02 6.16133885e-02 -3.28289053e-02] [ 3.92523005e-02 -1.55229117e-03 2.02603587e-02] [ 2.39562827e-02 4.22289066e-02 2.70455174e-02] [-3.13618383e-03 1.55733753e-02 -1.21291442e-02] [ 5.44411406e-03 -4.47367450e-03 1.73590739e-02] [ 8.11361900e-03 7.55526693e-02 4.02330404e-02] [-4.61864423e-04 2.31077365e-02 -2.91407830e-02] [-4.37846540e-02 -2.03710460e-02 4.16378246e-02] [-2.44672908e-02 -1.87584239e-02 -9.22839301e-02] [ 3.76910085e-02 -2.54376874e-02 -5.09971681e-03] [-3.81489084e-02 -3.66077862e-02 -3.76522104e-02] [-1.50192466e-02 -1.93340123e-02 8.79538118e-02] [ 1.75161246e-02 1.34063058e-02 -4.76484795e-02] [ 5.98570538e-02 -5.18102795e-02 -1.39995080e-02] [ 3.29195835e-03 1.43251115e-02 -3.18774666e-02] [ 3.02875728e-02 -5.26785551e-02 -2.15406047e-02] [ 2.40790150e-02 -2.08437486e-02 1.89383429e-03] [-4.41599300e-02 -6.85123112e-04 4.69410367e-02] [ 3.12473615e-02 5.94019564e-02 -4.56371182e-02] [-5.08800844e-02 -2.38997153e-02 6.38449358e-02] [ 2.48949585e-02 7.69521049e-02 -3.95191329e-02] [-4.79005474e-02 -4.78548109e-02 6.00418977e-02] [-5.64634995e-03 -8.39473215e-02 1.82142371e-02] [-4.97739034e-02 2.71910930e-03 6.62941630e-02] [-5.20378593e-02 -1.79384549e-02 6.28459991e-02]] Final stress: [-1.20985361e-05 1.24010221e-05 -7.52467818e-05 4.30759046e-05 -4.10010636e-05 2.05486844e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 111 steps. Final forces: [[ 1.17665225e-01 -5.38800771e-03 -1.14191522e-01] [-1.16369387e-01 1.15570815e-01 4.21146599e-04] [-7.29936193e-02 -1.33789806e-01 -6.04906987e-02] [ 1.03343248e-01 -2.25075460e-02 1.25406348e-01] [-1.12681698e-01 -6.67405593e-03 -1.19022753e-01] [-7.85253647e-02 1.05457714e-02 8.88414941e-02] [ 6.52746068e-02 -6.96873808e-02 1.33362274e-01] [-1.83649164e-02 -1.06370951e-01 1.23599369e-01] [ 3.38317290e-03 -1.17917573e-01 -1.14075283e-01] [-1.34001337e-01 -7.02197236e-02 6.35467537e-02] [-9.35747117e-02 -3.62197139e-02 -1.29615744e-01] [-1.34084493e-01 -6.91771039e-02 6.45044578e-02] [-5.75782842e-02 3.93563317e-02 1.85168870e-02] [ 1.17528749e-01 1.79711068e-03 1.14484185e-01] [-9.16872264e-02 3.96203363e-02 -1.30212596e-01] [ 1.24807089e-01 -1.04298569e-01 -2.13744907e-02] [-1.87148512e-03 3.35169327e-04 -3.21663977e-04] [ 1.22148709e-03 6.13362211e-04 5.63917671e-04] [ 1.51795784e-03 1.48556384e-03 1.40016095e-03] [-1.84101154e-03 -7.07050793e-04 6.94875245e-04] [-4.49938935e-04 -2.17491029e-03 4.21924886e-04] [ 1.70276883e-03 1.63711656e-03 1.66178780e-03] [ 1.30071671e-03 1.78631212e-03 1.28496999e-03] [ 3.26043327e-04 -2.56613136e-03 -3.70650439e-04] [-6.15533235e-04 6.27407081e-04 -9.04925226e-04] [ 2.12245330e-03 2.14179408e-03 1.03335935e-03] [ 1.19916816e-03 1.19892880e-03 -1.43360101e-04] [ 9.81696712e-04 -1.03481700e-03 -5.32976106e-04] [-9.73289386e-04 -1.19369831e-03 -9.68028741e-04] [-7.25170414e-04 2.54723472e-03 8.65494076e-04] [ 3.70326445e-04 1.35907463e-03 -2.84355095e-04] [-1.03661622e-03 -2.03065352e-03 -1.02351685e-03] [-1.37701108e-03 -1.30410633e-03 -1.35404822e-03] [ 2.29784366e-03 6.34828640e-04 -5.80505386e-04] [ 2.94468385e-03 -6.50201963e-04 7.02396038e-04] [-1.74460301e-03 -1.43465154e-04 -1.38256600e-04] [-6.52529055e-05 1.47241708e-04 1.71869881e-04] [ 7.51204796e-04 6.71287581e-04 1.68961617e-04] [-1.73297943e-04 -1.44514838e-04 -3.16592042e-04] [ 3.82790561e-05 -1.31470621e-05 7.34603146e-04] [-1.86883329e-03 1.89050789e-04 1.44212625e-04] [ 1.81567122e-03 4.57587674e-04 -4.31334378e-04] [-4.10057183e-04 -1.67042213e-03 -4.21023095e-04] [-4.75720396e-04 1.84880798e-03 4.97333148e-04] [-4.30221341e-04 -5.29783932e-04 5.29783890e-04] [-1.05412200e-03 1.12552600e-03 7.36906673e-04] [ 6.35704917e-04 -2.07532881e-03 -6.43082605e-04] [ 1.47445838e-03 2.16729246e-03 1.53315647e-03] [ 1.07607383e-03 7.79810043e-04 6.84946674e-04] [-2.37886172e-03 3.10891354e-04 -2.10818305e-04] [ 4.59790443e-04 -5.14497527e-04 -9.11175149e-04] [ 1.06463253e-03 1.02660957e-03 -1.58346160e-04] [-1.95057632e-03 -7.77373461e-04 6.72584539e-04] [ 1.97326406e-03 4.83402827e-04 5.04435913e-04] [ 1.74851328e-05 1.95610657e-03 2.27345189e-05] [ 2.70447997e-06 -1.60721443e-03 -1.03208189e-04] [ 2.22263828e-03 1.16404738e-03 -9.97778923e-04] [-2.72531733e-03 1.18959903e-03 1.21923095e-03] [-1.23025844e-03 1.24394143e-03 4.55947513e-04] [ 5.88303835e-04 5.81023311e-04 -1.00641286e-03] [ 8.26454708e-04 -2.66698808e-03 8.14700558e-04] [ 1.12991146e-03 1.47978426e-03 -1.09675751e-03] [-5.59735977e-04 5.35994628e-04 -1.31821969e-03] [ 5.96187600e-05 8.08764618e-05 8.07577724e-04] [-3.38224170e-02 1.23641345e-02 4.57284756e-02] [ 6.19291277e-02 -3.79246327e-02 -9.14027927e-03] [ 1.29098789e-02 5.81610913e-02 2.42331173e-02] [-5.16050913e-02 2.17806336e-02 -4.11293774e-02] [ 3.66276365e-02 -4.78693177e-02 -2.48272297e-04] [-4.25042240e-02 5.40773344e-03 4.67071801e-02] [ 1.09998995e-02 4.95537744e-02 4.88133139e-02] [-4.51022983e-02 2.97041022e-03 -6.58614768e-02] [ 2.99511735e-02 -6.65663252e-03 4.53521353e-02] [ 3.18742145e-02 -3.00189001e-02 -4.32798211e-02] [-2.49713543e-02 3.06178811e-02 -4.84177382e-02] [ 6.23408557e-02 2.83000091e-02 4.93293945e-02] [ 2.93067750e-02 8.67111251e-05 -4.75190032e-02] [-1.59723951e-02 3.78114489e-02 -5.38112047e-02] [ 1.36254323e-02 2.13527735e-02 -6.54109441e-02] [ 2.26286164e-03 5.90642177e-02 5.05736327e-02] [ 5.63707714e-02 2.95615565e-02 -2.04625295e-02] [-1.24384832e-02 4.96826758e-02 4.59778287e-02] [ 3.23235080e-02 6.40838883e-02 -3.92985250e-02] [ 6.03778083e-02 2.30089976e-02 -1.74667719e-02] [ 2.99546589e-02 2.42806745e-02 2.51936057e-02] [ 5.13352028e-02 4.09462648e-02 -2.87769083e-02] [ 2.46430748e-02 7.23099809e-03 4.87623815e-02] [ 5.82320082e-02 3.46421968e-02 -1.67584509e-02] [ 1.49162268e-02 -4.65320196e-02 -3.24348977e-02] [-4.86568757e-02 1.30082671e-02 -4.39738586e-02] [ 5.86023572e-02 9.97332045e-03 -9.43092657e-04] [-5.02683105e-02 -2.99186267e-03 -4.19683399e-02] [ 5.26351294e-02 -1.65102191e-02 4.62510227e-02] [ 4.90985853e-02 -1.32171796e-02 8.20296265e-02] [-6.00119566e-02 3.52502636e-02 -3.53525993e-03] [-2.32692599e-02 6.79395396e-02 1.36943745e-02]] Final stress: [-1.10342812e-04 -1.12927502e-04 -7.18085606e-05 -3.62591459e-05 -5.45091078e-06 -3.27511375e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 31 steps. Final forces: [[-0.1119737 -0.01361962 0.11920718] [-0.11122817 0.11936568 0.01584572] [-0.12270772 -0.01572823 0.10777231] [-0.13677021 -0.02632183 -0.08752755] [-0.10954265 -0.04794467 -0.11468087] [-0.10061666 0.02247257 0.12729927] [-0.0674321 0.06965251 -0.13206782] [-0.02784641 -0.08453357 0.13797053] [-0.09324907 -0.02177691 -0.13284823] [ 0.03341866 -0.08222003 -0.13831188] [ 0.08698478 -0.11978021 -0.07374856] [-0.04654622 0.10175526 0.12079953] [ 0.07461761 -0.12994662 0.06705941] [ 0.04099197 0.12019424 -0.10394652] [-0.08862981 -0.11996324 0.06986531] [-0.11041016 -0.0351913 0.11645345] [-0.00491027 -0.00997125 0.01030007] [ 0.00830757 -0.00731223 -0.0075542 ] [ 0.00563879 -0.00099319 -0.00151121] [-0.01275102 -0.00041335 0.00037899] [-0.00965722 -0.00691973 0.01024732] [ 0.00955927 0.01090885 0.00984974] [-0.00354499 0.01259007 -0.00326228] [-0.00477999 -0.00233977 0.00488305] [ 0.00281683 -0.00244673 -0.0100462 ] [-0.00312756 -0.00275004 0.00244015] [ 0.00898067 0.00891415 0.01059615] [ 0.0046405 -0.00444291 -0.00641061] [ 0.00124259 -0.00338916 0.00070792] [-0.00140763 0.01722617 0.00086113] [-0.00057746 0.00237317 0.00101074] [ 0.00585471 -0.01341388 0.00600692] [-0.00435013 -0.00228801 -0.00276592] [ 0.00854718 0.00133846 -0.00099167] [ 0.00832996 -0.00673275 0.00720211] [-0.00325203 0.00131215 0.00164453] [ 0.00615734 -0.00551341 0.00264898] [ 0.00487895 0.00468866 -0.00259769] [ 0.00923167 0.00949234 -0.01093103] [ 0.00431349 -0.00408842 0.01067533] [-0.01655376 -0.00218334 -0.00224393] [ 0.00729616 -0.00878688 0.00876001] [-0.00168534 -0.00632692 -0.00199622] [ 0.00788863 0.01321151 -0.0078663 ] [-0.00806649 -0.0078492 -0.00616859] [-0.00231879 0.0019154 0.0043011 ] [ 0.01078498 -0.01072759 -0.01044064] [ 0.0011514 0.00752051 0.00044653] [ 0.00691841 0.00662598 0.00674822] [-0.00327279 -0.00413911 0.00458705] [ 0.0003186 -0.00068464 -0.01238454] [ 0.00314432 0.00321036 0.01281234] [-0.01114849 0.00483717 -0.00462944] [ 0.01077692 -0.00105076 -0.00133879] [ 0.00037754 0.01297766 -0.00037989] [ 0.00150831 -0.01454839 -0.00167318] [ 0.00424159 0.00384541 -0.00380813] [-0.01369946 0.00186816 0.00111528] [ 0.00671039 -0.00729497 0.01291628] [ 0.00082819 0.00152557 -0.01454356] [ 0.00809555 -0.01139788 0.00848715] [-0.00405833 0.01049327 0.00429456] [ 0.00251219 -0.0021171 -0.00535206] [-0.00760265 -0.00761403 0.00594104] [ 0.03546279 0.16116655 0.02242799] [-0.08759456 -0.12644514 0.01753927] [ 0.02327318 -0.03956909 -0.05030885] [ 0.15488976 -0.10569476 -0.06466986] [ 0.1265385 0.09830901 -0.04466398] [ 0.03880567 -0.02274196 -0.17283907] [ 0.11477439 0.06991001 -0.05607433] [ 0.03096475 0.04397857 0.11285303] [-0.00303378 0.0750783 -0.10164305] [-0.01689923 -0.01073001 -0.02067378] [ 0.05989032 -0.06781535 0.01355063] [ 0.10251393 0.08542375 -0.00937477] [-0.03175078 -0.07934264 0.00743075] [ 0.08186913 0.03479412 0.10740559] [ 0.03408305 -0.03162305 -0.07056553] [ 0.02781367 0.13420084 -0.03385703] [ 0.09696932 0.0125188 0.07803294] [-0.08868475 -0.08329414 0.19678286] [-0.06052823 -0.02173693 -0.0279138 ] [-0.08226321 -0.08551755 0.14782085] [-0.10871766 -0.04771939 0.1089767 ] [ 0.11068558 -0.05391089 -0.06805835] [-0.06368038 0.01608134 0.06996539] [ 0.10604992 -0.06687749 0.07371436] [-0.06528983 0.0602493 -0.22267079] [-0.05152349 -0.0038094 0.13068806] [ 0.10737309 0.13438309 0.01107647] [ 0.01587114 0.04375072 0.01419747] [ 0.1214826 -0.01259534 -0.08045739] [-0.01403293 0.00551736 -0.1661142 ] [ 0.09827333 0.0874602 0.04878178] [ 0.03306627 0.08104774 -0.10146727]] Final stress: [-2.33224671e-05 1.77191958e-05 2.96728180e-06 7.09374098e-05 5.25061786e-06 1.17574946e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-4.54564928e-02 -8.40801757e-02 1.33253412e-01] [ 9.87228822e-03 1.10252492e-01 1.20859786e-01] [-1.32724417e-01 -5.47382681e-02 7.95313357e-02] [ 1.33191770e-01 5.94049697e-02 7.50876259e-02] [ 9.69120552e-02 3.17423664e-02 1.28382054e-01] [-1.20510560e-01 -1.10784916e-01 1.16315847e-02] [ 7.58558955e-02 1.34027308e-01 -5.64832255e-02] [-4.30088841e-02 -8.63838083e-02 1.32639877e-01] [ 9.31302517e-03 1.10163354e-01 1.21272632e-01] [-7.52909932e-02 5.62813200e-02 1.34536805e-01] [ 8.66515962e-02 4.55809513e-02 1.31627278e-01] [-4.62254735e-02 8.57126050e-02 1.32040466e-01] [ 5.88664283e-02 -1.33235483e-01 7.51885469e-02] [ 6.16827256e-02 1.33328173e-01 -7.28922436e-02] [ 1.19254957e-01 1.12230154e-01 8.23261161e-03] [ 3.68624107e-02 -1.30303246e-01 9.24413665e-02] [-5.01829316e-03 2.55632360e-04 -1.59274721e-04] [ 2.86606978e-03 -3.95868107e-03 -3.97820285e-03] [ 1.17197008e-03 2.42627549e-05 1.10305707e-04] [ 4.39481963e-04 3.60121091e-03 -3.67860404e-03] [ 2.23578750e-03 -4.99013131e-03 -2.22817288e-03] [-4.06218701e-03 9.59352622e-04 -4.08036198e-03] [-3.03127464e-03 4.66730238e-03 -3.07141769e-03] [-5.22618003e-04 -2.49336759e-03 6.02194537e-04] [ 2.62497278e-03 -2.72327376e-03 -3.65784907e-03] [-1.71983623e-04 -2.27307298e-04 8.87523747e-04] [-4.99094743e-04 -5.36781632e-04 1.21055575e-03] [ 5.69335764e-04 -5.01595457e-04 -1.47573979e-03] [-4.08125201e-03 -3.76636884e-03 -4.09856007e-03] [ 1.85783856e-04 2.25214912e-03 -4.90562396e-04] [-1.16604556e-04 2.34830995e-03 -1.77276516e-04] [-1.19820992e-03 -2.83265722e-03 -1.38693736e-03] [-1.84167421e-03 -1.48499096e-03 -1.36324705e-03] [ 3.54424833e-03 -8.47725576e-04 8.61046071e-04] [ 1.98302167e-04 -1.38095151e-03 1.24744447e-03] [-2.52568055e-03 9.01675087e-04 8.14683415e-04] [-1.89031051e-03 1.86500850e-03 3.89877026e-03] [ 1.15671417e-03 1.33959738e-03 -2.86717587e-03] [-1.86543023e-03 -1.85694446e-03 -3.13145165e-03] [ 1.94689503e-03 -2.17649143e-03 6.72050596e-04] [-1.69618824e-03 -1.53928638e-05 -1.89739143e-04] [ 3.47438042e-03 2.82042894e-03 -2.92694648e-03] [ 2.96510672e-03 -2.10312177e-03 2.91548534e-03] [-2.14402986e-03 3.75956231e-03 2.15247668e-03] [-9.26697612e-04 -1.02510400e-03 -1.83784641e-03] [ 2.14010350e-03 -2.29627189e-03 8.16549168e-04] [ 9.87994422e-04 -3.09461923e-03 -9.77186601e-04] [-2.84492385e-03 1.09608492e-03 -2.92222726e-03] [ 1.06463251e-03 -7.52787672e-04 -6.83881154e-04] [ 3.46909655e-04 2.43974429e-03 -2.50853500e-03] [-2.97795549e-03 2.95958558e-03 5.25407448e-04] [-2.74258811e-03 -2.75729798e-03 3.16955550e-03] [-1.80497133e-03 5.19984442e-04 -4.48615199e-04] [ 3.69506149e-03 -3.03043139e-03 -3.05240648e-03] [-7.55681786e-04 6.36587589e-03 -7.41273625e-04] [ 4.15411270e-04 -2.37602813e-03 -3.81704775e-04] [ 2.07608465e-04 -1.49688102e-03 1.35966017e-03] [-2.70326993e-03 7.19176948e-04 5.79384231e-04] [-1.09898165e-03 1.22760816e-03 2.21736847e-03] [ 1.74415991e-03 1.89914880e-03 -2.72096066e-03] [ 2.82111834e-03 -2.18844288e-03 2.75603030e-03] [ 8.36278434e-04 2.65356987e-03 -6.92723193e-04] [-2.48665668e-03 2.43904985e-03 6.64281223e-05] [ 4.37753983e-05 2.06488795e-04 5.02567242e-03] [ 4.00143806e-02 6.80096668e-02 -3.34243683e-02] [ 1.92143455e-02 -2.87400086e-02 -3.54880222e-02] [ 1.04798237e-01 -3.80099663e-02 -1.89485864e-02] [-5.90245782e-02 8.92796681e-03 -2.98908439e-02] [-7.29865180e-03 -2.27093500e-02 -1.67481688e-02] [-2.46721171e-02 5.71736720e-03 -7.70999737e-02] [ 1.60261784e-02 6.10510935e-02 -9.91789391e-02] [-3.94052103e-02 -3.34288884e-02 -2.56335422e-02] [-2.91745935e-02 -1.15828619e-02 -3.76475300e-02] [ 5.21988158e-02 6.54252448e-02 -1.04057190e-02] [-2.33441604e-02 -5.83424604e-02 3.80640237e-02] [-5.80483195e-02 8.45738999e-03 -6.93535391e-02] [ 6.37985546e-02 5.62318000e-02 -2.48953354e-02] [-1.32795801e-02 -5.44120531e-02 3.92347320e-02] [ 3.20682386e-02 6.76289400e-02 -3.02652050e-02] [-3.36602740e-02 -7.60530968e-02 -2.11879554e-02] [ 6.85193267e-02 -9.43157286e-02 -3.79944724e-02] [ 1.39258483e-02 7.63238350e-03 -6.88917491e-02] [-1.76722261e-02 -1.71950793e-02 -8.77527770e-02] [-2.57618822e-02 1.97304460e-02 -1.29430711e-01] [-3.54491135e-02 -2.64571902e-02 -3.90493587e-02] [ 4.02801887e-02 -7.40434978e-02 -2.56700563e-02] [-5.49333383e-02 4.61301589e-03 -8.30620010e-02] [-2.62962865e-02 -1.15483385e-02 -1.14289376e-01] [-3.74617889e-02 4.25613536e-03 -3.22318518e-02] [-5.29111958e-02 -5.01314182e-02 -2.23594761e-04] [-1.65710205e-02 2.52349876e-02 -1.78529648e-02] [-9.67258894e-03 -6.82070420e-02 1.25424347e-02] [-1.24832075e-02 -4.43588431e-02 -2.37326360e-02] [-7.79767279e-02 -4.17217245e-02 -3.12104952e-02] [-1.10426048e-02 3.90403990e-02 -6.56699657e-02] [ 1.37347595e-03 3.36957526e-02 -2.59210772e-02]] Final stress: [-2.11352370e-05 -2.49231983e-05 -1.90224426e-05 3.92861925e-05 4.29662540e-07 8.40138717e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-5.94898176e-02 -7.34092305e-02 1.33975743e-01] [ 1.23735145e-01 -1.89803877e-02 1.05851451e-01] [-9.98771834e-02 -1.27018413e-01 -2.83645311e-02] [ 6.19365892e-02 1.34473651e-01 -7.04815422e-02] [ 6.22021468e-02 7.10767441e-02 1.33959231e-01] [-1.27801728e-01 -9.76958625e-02 3.22166514e-02] [ 6.08617504e-02 1.34085012e-01 -7.23569056e-02] [-1.23196464e-01 1.75880984e-02 1.06762438e-01] [ 1.11647782e-01 8.42955097e-03 1.19777435e-01] [-1.27467825e-01 -9.89322211e-02 2.99658152e-02] [ 1.32418519e-01 -5.20842658e-02 8.17604409e-02] [-1.12255145e-01 5.93483875e-03 1.19520557e-01] [-4.65601547e-02 -8.50442063e-02 1.32204592e-01] [ 9.88031496e-03 1.20425223e-01 -1.10799998e-01] [-7.91536800e-02 -1.32945132e-01 5.45425897e-02] [-1.19403548e-01 6.55767006e-03 1.12328837e-01] [-1.85836781e-03 8.23941926e-04 -9.60216137e-04] [-5.89067672e-04 -6.37680886e-04 -6.10461365e-04] [ 1.46255330e-03 -2.27240111e-04 -1.82803336e-04] [-1.32967161e-03 -2.60278938e-03 2.56226969e-03] [-1.52121368e-03 -3.97301203e-03 1.51962004e-03] [ 5.05117795e-04 3.82232580e-03 3.02061679e-04] [ 2.83504844e-03 2.05426037e-03 2.95962098e-03] [ 7.62729617e-05 -2.62687069e-03 -8.30797866e-05] [-9.51824769e-04 9.15643295e-04 -2.26580131e-03] [ 3.87915340e-04 3.49865300e-04 1.40201158e-03] [-2.25641964e-03 -2.14706936e-03 2.75286792e-04] [ 3.14345439e-03 -3.27136484e-03 -8.00082602e-04] [-1.25968653e-03 -2.69705428e-03 -1.49662892e-03] [-8.51730474e-04 1.11151904e-03 9.23067781e-04] [ 3.64657312e-03 1.92105164e-03 -3.62218323e-03] [-1.92330059e-03 -3.45233575e-03 -2.00929584e-03] [-1.65404588e-03 -7.88649001e-04 -8.92041213e-04] [ 2.82694642e-03 2.03415755e-03 -2.05712000e-03] [ 2.26831039e-03 2.97126058e-03 -3.06356048e-03] [-1.02368673e-03 -4.65849606e-03 -4.48498706e-03] [-1.11969474e-04 1.76513895e-04 2.22017231e-03] [-7.74653369e-04 -6.70615899e-04 5.25938802e-04] [-6.61659644e-04 -7.20346372e-04 -2.10507027e-03] [-3.85316722e-03 3.85541230e-03 1.63049768e-03] [-1.81044342e-03 -1.04086680e-03 -8.91463194e-04] [ 2.71539731e-03 1.98431609e-05 -8.13350956e-05] [-1.51107010e-03 -4.34779973e-04 -1.40996632e-03] [-1.58614833e-04 2.70256118e-03 1.46346895e-04] [-1.65748982e-03 -1.55364476e-03 -2.96422282e-03] [ 2.97417397e-03 -2.95603862e-03 2.51843364e-03] [ 4.52173407e-03 -2.42266108e-03 -4.80906049e-03] [ 2.97183069e-04 2.46068201e-03 2.45373363e-04] [ 1.57653396e-03 -1.38522553e-03 -1.55769860e-03] [-1.38796809e-03 4.67415683e-04 -4.11527234e-04] [ 2.07077356e-03 -2.01143529e-03 -1.79109833e-03] [ 3.87904698e-03 4.08815387e-03 1.39645063e-03] [-3.64852196e-03 2.05570106e-03 -2.07459870e-03] [ 2.99136912e-03 5.04357681e-04 5.77156584e-04] [-8.28013972e-04 3.07942808e-03 -1.06616457e-03] [-1.33160727e-03 -1.66115862e-03 1.21418937e-03] [-1.34052315e-04 1.67844941e-03 -1.52081888e-03] [-4.07816261e-04 1.72652908e-03 1.72494398e-03] [-1.27462328e-03 1.26093588e-03 3.09207103e-03] [ 1.41296377e-03 1.23060595e-03 -1.54908565e-03] [-1.95172099e-03 -3.54979467e-03 -2.13907603e-03] [-1.37109987e-03 3.51861469e-03 1.28191870e-03] [-2.46698813e-05 3.75486681e-05 -1.23693604e-03] [-2.48776689e-04 -2.74939347e-04 1.65935238e-03] [ 4.48154097e-02 8.98394786e-03 -5.22212778e-02] [-7.14996380e-02 -2.70401816e-03 -1.20995102e-02] [ 5.13325497e-02 5.28943863e-02 3.29699823e-02] [-2.25112135e-02 -5.59733566e-02 3.93799450e-02] [-3.05467394e-02 6.13210945e-02 -8.56637478e-02] [ 2.90002065e-02 1.15083960e-02 -4.97917567e-02] [ 4.06621531e-02 6.13310804e-02 -2.44864229e-03] [-1.73026612e-02 -3.63100201e-02 -1.37688825e-02] [-7.13415277e-02 -3.81216230e-02 -5.63517739e-03] [ 6.19499780e-02 1.75543080e-02 6.49511900e-03] [-2.73294326e-02 -6.44172289e-02 2.37842079e-02] [ 3.72996329e-03 4.30409303e-02 -5.37506687e-02] [ 3.96631418e-02 6.48533984e-02 -4.97993878e-02] [-2.75982247e-02 -4.64703314e-02 2.64209787e-02] [-9.25845762e-03 -6.27658598e-02 -5.20012136e-02] [-4.01597377e-02 7.15781392e-03 -3.94154767e-02] [ 3.56363868e-02 6.78230438e-02 -6.49426333e-02] [-4.06228975e-02 -6.88349017e-04 -3.56967021e-02] [ 5.35509043e-02 3.63845818e-02 2.14387555e-02] [ 1.01305664e-01 2.01704740e-02 -1.80159520e-02] [-6.82646046e-02 3.10290261e-02 -2.82012420e-02] [ 6.17300654e-02 -1.20420299e-02 -9.63222786e-02] [-2.54631286e-02 2.17129249e-02 -4.96507083e-02] [ 6.68098090e-02 1.50426012e-03 -7.91804498e-02] [ 1.42211961e-02 2.45270814e-02 -6.86716294e-02] [ 3.46284635e-02 -7.97840367e-02 7.39970147e-03] [ 1.15612161e-02 3.34106699e-02 -6.23989492e-02] [-2.87948945e-02 -2.49699964e-02 5.68566807e-02] [ 4.07584655e-02 1.34485077e-03 -8.97139865e-02] [ 2.46360953e-03 9.19192874e-02 2.12791056e-02] [ 5.43516426e-02 -3.82998726e-02 -4.84870269e-02] [ 6.38212181e-02 -7.48861211e-03 -3.90503803e-02]] Final stress: [-7.80423890e-06 -2.50553854e-05 -3.00698173e-05 -5.51523560e-05 1.61803392e-05 -4.74126408e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.87845397e-04 -3.99489288e-04 -2.84073236e-04] [-4.57012241e-03 3.56891196e-03 -9.91617133e-04] [ 2.69097914e-03 6.91593899e-03 4.22264240e-03] [ 9.20819325e-04 -6.31915635e-03 7.23692082e-03] [-2.77864170e-03 5.39242887e-03 2.60541341e-03] [-3.40550623e-03 -7.28681100e-03 -3.87905656e-03] [ 8.51708206e-04 1.78065334e-03 -9.25013766e-04] [ 1.87106800e-03 -8.99824035e-03 7.11783630e-03] [-1.64246373e-03 3.59714692e-03 1.94845069e-03] [-3.35949728e-04 -7.85775272e-04 -4.61089058e-04] [-2.46483473e-03 3.07151735e-03 6.18323622e-04] [-1.37519062e-03 2.69463127e-04 1.64266747e-03] [-2.50724687e-03 -3.13164364e-04 2.82302378e-03] [ 1.78498992e-03 3.61456127e-03 -1.80249031e-03] [ 1.03254753e-03 1.81320788e-03 -7.85058775e-04] [ 1.68007346e-03 -6.44340321e-03 4.75985070e-03] [-5.47842151e-03 1.56853520e-05 -1.75597621e-05] [ 5.48020009e-03 -1.60922839e-05 -1.50364456e-05] [ 5.49868017e-03 -2.13027856e-06 -4.21691538e-06] [-5.49793356e-03 2.36137801e-06 -2.24709243e-06] [ 2.26337130e-06 -2.20987008e-03 -2.50185760e-06] [-2.36995218e-06 2.21623159e-03 -1.90582267e-06] [ 1.65219498e-07 2.21609170e-03 3.35593791e-06] [ 3.49654462e-06 -2.21811027e-03 -4.90649701e-06] [-1.42729113e-05 1.26769939e-05 -5.47802446e-03] [ 6.29103304e-07 2.64809685e-06 5.50025104e-03] [ 1.01386325e-06 5.42624101e-07 5.49923072e-03] [ 1.64322941e-05 -1.82013239e-05 -5.48163176e-03] [ 2.06103248e-05 -2.20105169e-03 1.89609411e-05] [-1.84276713e-05 2.19603156e-03 2.00631897e-05] [ 3.94856480e-06 2.21945911e-03 -1.81600121e-06] [-1.75275212e-06 -2.21629658e-03 -1.70274441e-06] [-5.49859243e-03 -4.06556186e-07 -3.61694529e-06] [ 5.49881705e-03 6.61922884e-06 -6.92910290e-06] [ 5.49302055e-03 -2.38468596e-06 2.49084157e-06] [-5.50107795e-03 -6.79208843e-06 -5.87413491e-06] [ 2.22747144e-05 -2.09155249e-05 5.48363183e-03] [-2.05752301e-06 -3.49743956e-06 -5.50132206e-03] [ 5.36987240e-06 4.85987067e-06 -5.49824056e-03] [-1.65163044e-05 1.83128298e-05 5.47782103e-03] [-5.49720959e-03 5.26142741e-06 4.93961106e-06] [ 5.49691177e-03 -3.74016151e-05 3.73212435e-05] [-2.65114463e-05 -2.23114620e-03 -2.69455175e-05] [ 1.83333327e-06 2.21209827e-03 -2.19267095e-06] [-1.62935609e-05 -1.48632060e-05 -5.51139605e-03] [-1.48839045e-05 1.47855820e-05 5.51682875e-03] [ 4.03527840e-05 -2.21740387e-03 -4.04789425e-05] [ 1.55651553e-05 2.23342925e-03 1.54845484e-05] [ 5.49716923e-03 -5.16201428e-06 -5.26612602e-06] [-5.51592485e-03 -1.98152844e-05 1.94896693e-05] [ 1.86477897e-07 -1.57005661e-07 -5.49650677e-03] [ 2.53048798e-05 2.71557346e-05 5.50973554e-03] [-5.51107973e-03 2.26101780e-05 -2.08835495e-05] [ 5.47663488e-03 1.39469305e-05 1.53608718e-05] [ 5.98898428e-07 2.18372589e-03 4.30663250e-07] [ 7.92560657e-06 -2.21522114e-03 -7.93027339e-06] [ 5.51630528e-03 1.71755541e-05 -1.75554479e-05] [-5.46386043e-03 -6.90266238e-07 -9.17132223e-07] [-9.59683387e-06 9.60184294e-06 5.49701781e-03] [-1.97364605e-05 -2.12868631e-05 -5.47846110e-03] [-1.72481018e-05 -2.19455857e-03 -1.88729589e-05] [-1.58480264e-05 2.22851391e-03 1.43036208e-05] [ 2.33571633e-05 -2.37301465e-05 -5.51426410e-03] [ 1.74900425e-05 1.60090709e-05 5.47783357e-03] [ 8.15913846e-04 8.89457607e-04 1.02680606e-03] [ 3.39478240e-04 -3.22695222e-03 2.16265475e-03] [-3.12942172e-03 -1.87380794e-03 -3.89177879e-03] [ 8.72439536e-04 2.04883836e-03 -4.90695997e-03] [ 3.93467134e-03 1.10897077e-04 -1.18570220e-03] [-1.24438359e-03 -7.96644861e-04 -7.58960591e-04] [ 4.08355585e-04 -5.06226537e-03 -3.14535908e-04] [-1.75042687e-03 4.27701305e-03 -2.27796656e-03] [ 2.78482410e-03 -1.43521529e-03 -2.68929228e-03] [ 2.72452220e-03 2.30969013e-03 3.48758722e-03] [-1.81028693e-03 3.37608517e-04 1.59246793e-03] [ 1.75323273e-04 -3.87780327e-03 2.25779771e-04] [ 2.29859966e-04 4.78420257e-03 4.78892220e-04] [ 9.66777419e-04 -1.83480362e-03 -1.18017409e-03] [ 4.38544874e-04 5.39110518e-03 -2.13804444e-03] [-4.94725417e-04 -2.91356827e-03 3.41686299e-04] [-1.05937106e-03 1.65242906e-03 -1.24009470e-03] [ 2.23169280e-03 -6.85141848e-04 -2.41917733e-03] [-2.44444025e-03 3.23124175e-03 -4.54077549e-03] [ 1.47161669e-03 -7.55483036e-04 1.61062295e-03] [ 2.39757264e-03 -2.28869559e-04 -1.72790842e-03] [ 1.58708392e-03 -1.16503017e-03 1.27172483e-04] [-5.68238794e-05 -2.82137318e-03 1.20743032e-03] [-1.26731487e-04 6.74762739e-04 -1.83226673e-03] [ 2.62706965e-03 1.57911810e-03 -2.58500103e-04] [ 6.18115645e-04 -3.01633613e-03 -3.36055828e-04] [-1.53921682e-04 -1.06330016e-03 -2.77633208e-03] [-2.30806988e-03 -7.23339226e-04 2.32942630e-03] [-1.50998332e-03 -2.23137095e-04 1.35955462e-03] [ 6.70740706e-04 -1.58849458e-03 -5.35054384e-04] [ 6.26914781e-04 4.33064841e-03 -9.38689664e-04] [-2.29994784e-03 2.19811442e-03 -3.79389033e-03]] Final stress: [-1.19888870e-04 -8.73796199e-05 -1.19872733e-04 -7.97789852e-07 -2.00308151e-07 2.61095376e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.0016667 -0.11211856 0.11976781] [ 0.11437994 -0.11643904 -0.00660309] [ 0.07364555 0.13285031 0.06041673] [ 0.09991618 0.1262559 -0.02703327] [ 0.01450886 0.11053965 0.12021791] [ 0.12248878 0.10779235 -0.00991303] [ 0.10337312 0.1247997 -0.0239236 ] [-0.05141307 -0.07615757 0.13575459] [ 0.13357589 -0.08684454 0.0380119 ] [ 0.09227738 0.12980546 0.03865194] [ 0.07203168 -0.132218 -0.06519393] [ 0.12926829 0.09621283 -0.02811833] [-0.03943728 -0.08698549 0.13310418] [ 0.09384283 0.12925598 -0.03517437] [ 0.1015399 0.1256099 -0.02675505] [ 0.08340445 -0.12999572 0.05542424] [-0.01283644 -0.00151454 0.00153891] [ 0.01292147 -0.00132408 -0.00130358] [ 0.01149975 -0.00268652 -0.0026862 ] [-0.01265616 -0.00151538 0.00149066] [-0.00851656 -0.01110949 0.00753693] [-0.00727185 0.01284172 -0.00659358] [-0.00916045 0.01094143 -0.00842298] [-0.00579442 -0.01064646 0.0050052 ] [-0.00570747 0.00438369 -0.01101168] [-0.00706003 -0.00602334 0.01181259] [-0.00687925 -0.00596392 0.01138184] [-0.00755173 0.00616853 -0.01105093] [-0.00154155 -0.0120656 -0.00251598] [ 0.00105484 0.01183985 -0.00020682] [ 0.0023985 0.01212812 -0.00150184] [-0.00207474 -0.01072057 -0.00291556] [-0.00918197 -0.00042458 -0.00048413] [ 0.01404314 -0.00281067 0.0028058 ] [ 0.01377824 -0.00109016 0.00112248] [-0.01038208 -0.00526515 -0.00529189] [-0.00089956 0.001314 0.01195243] [-0.00053728 -0.00135038 -0.01142783] [-0.00341011 -0.00403252 -0.01178235] [ 0.00326543 -0.00271071 0.01171135] [-0.00954881 -0.00344634 -0.00327433] [ 0.01315119 0.00151032 -0.00136174] [-0.00126132 -0.0106597 -0.00229252] [-0.00314049 0.01198585 0.00384587] [ 0.00151676 0.00104278 -0.01182892] [ 0.0053576 -0.00500871 0.01200628] [-0.00927537 -0.01101383 0.0082881 ] [-0.00779793 0.01150948 -0.00695844] [ 0.01123605 -0.00478582 -0.0047246 ] [-0.01275442 -0.00179965 0.00163611] [-0.00280566 0.00143163 -0.01081935] [-0.0067448 -0.00553335 0.01127201] [-0.01315298 0.00069595 -0.00058261] [ 0.01233543 -0.00226768 -0.00216551] [-0.00803044 0.01184931 -0.00713379] [-0.00565143 -0.01176042 0.00471529] [ 0.01359606 -0.00230565 0.00206408] [-0.01079983 -0.00177712 -0.00174055] [ 0.00147842 -0.00124174 0.0117652 ] [ 0.00143555 0.0007015 -0.01165624] [ 0.00125289 -0.01129108 0.00032162] [-0.00162717 0.01174165 0.00233782] [-0.00323787 0.0019602 -0.01146176] [-0.00836672 -0.00730534 0.01116838] [ 0.03130101 0.07017942 -0.04751763] [-0.03888047 -0.03769293 0.09168636] [-0.06001767 0.00132145 -0.0660503 ] [-0.00344923 -0.03577429 -0.01269771] [ 0.05031439 0.02756213 0.02460672] [-0.07572856 -0.00951069 -0.11650151] [ 0.02992788 -0.05439893 0.01816044] [-0.0323283 0.01557254 0.0094162 ] [ 0.0184292 0.01933851 -0.03253831] [ 0.03565938 -0.01454922 -0.01813224] [-0.06216721 -0.03916691 0.05256493] [-0.06279689 -0.08957067 0.03765618] [-0.06313223 0.02319651 -0.06883711] [-0.06995557 -0.08213214 0.0025553 ] [ 0.01109832 0.03162717 -0.0699774 ] [-0.12272283 -0.03537281 0.10677896] [-0.08673028 -0.01263405 -0.06480782] [ 0.00071889 0.04848201 0.01247405] [-0.06041077 -0.00417941 -0.11313434] [ 0.00252382 -0.11340771 -0.00109655] [ 0.00780828 0.07180069 0.02052864] [ 0.02881287 -0.04871917 0.01041548] [-0.09411138 0.01887535 0.09756291] [-0.07131126 0.05604285 -0.09139278] [ 0.01227054 0.06138404 -0.03530375] [ 0.03113001 -0.0864729 -0.04044804] [-0.03665772 -0.05680296 -0.10930686] [-0.0936881 0.00403985 0.04841055] [-0.13225494 -0.02277021 0.06590934] [ 0.00460236 -0.07750774 -0.01983194] [-0.04249841 0.04611898 -0.04845741] [-0.10215531 0.03016263 -0.10391224]] Final stress: [ 8.56355542e-05 1.68968769e-05 1.64326846e-05 2.67596589e-05 -2.72914806e-06 4.52940232e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 71 steps. Final forces: [[ 9.13830788e-02 -1.30129982e-01 3.95981985e-02] [ 3.23218742e-02 -1.25941080e-01 -9.91797200e-02] [ 1.05718456e-01 1.22375546e-01 2.28442083e-02] [ 1.18059491e-01 -8.50330117e-03 1.13187570e-01] [ 1.03938559e-02 -1.17505971e-01 -1.13008820e-01] [ 1.21983290e-01 4.37196122e-03 -1.08993756e-01] [ 6.06255400e-02 1.28967092e-01 -8.00210283e-02] [-7.57740709e-02 1.34195812e-01 -5.56559678e-02] [ 9.53176008e-02 -1.27111837e-01 -3.70973759e-02] [ 1.14815611e-01 -1.02559400e-02 -1.16598447e-01] [ 3.78205078e-02 -1.26664578e-01 -9.62438575e-02] [ 1.34239684e-01 4.75850483e-02 -7.96757498e-02] [ 1.28357464e-01 -9.68536514e-02 -3.05421943e-02] [ 2.87422515e-02 1.23405211e-01 -1.02792423e-01] [ 1.19998728e-01 1.11671879e-01 -5.72467786e-03] [ 7.45982050e-02 -1.32382527e-01 6.02207624e-02] [-3.77210579e-03 -2.25728045e-03 2.66092890e-03] [ 1.01045790e-02 1.13309712e-03 1.50441683e-03] [ 1.00006621e-02 1.48386206e-03 1.49328718e-03] [-3.53068024e-03 9.92610123e-04 -6.26267824e-04] [-3.64841127e-03 -4.13719266e-03 2.05048654e-03] [ 4.75513648e-03 5.46788088e-03 4.00802759e-03] [ 5.66946773e-03 5.66124069e-03 4.94219042e-03] [-1.72538755e-03 -6.46354826e-03 2.93041305e-03] [ 1.44379495e-03 -3.75743665e-03 -3.17525609e-03] [ 3.06496322e-03 2.68568879e-03 5.53618069e-03] [ 7.09372921e-03 6.52693213e-03 6.51027709e-03] [ 1.72324998e-03 -1.22981446e-03 -6.44406391e-03] [-9.46452384e-03 -6.12038849e-03 -8.25512652e-03] [-1.09728949e-02 5.28152015e-03 1.01676748e-02] [-1.19523964e-02 7.10384461e-03 1.15499248e-02] [-1.06715721e-02 -6.41252085e-03 -9.68302264e-03] [-7.78430588e-03 1.52966725e-03 1.75018126e-03] [ 4.45585813e-03 3.35528254e-03 -3.02276258e-03] [ 5.69031183e-03 1.56316465e-03 -1.34585976e-03] [-8.05092367e-03 -1.64338614e-03 -9.86710196e-04] [-1.01068364e-02 8.62818103e-03 6.62374453e-03] [-9.25807522e-03 -8.30550531e-03 -6.52982782e-03] [-5.65189413e-03 -4.21586366e-03 -5.86665913e-03] [-1.14943328e-02 1.03237228e-02 6.39219743e-03] [-7.32860217e-03 3.30878517e-03 2.93261815e-03] [ 6.06920041e-03 -3.78810804e-03 4.20435560e-03] [-6.93354014e-03 -7.15644679e-03 -6.11130025e-03] [-1.14521055e-02 5.06846741e-03 1.02621031e-02] [-1.02782983e-02 -9.06840398e-03 -6.77060681e-03] [-4.67761279e-03 3.09004347e-03 6.89895934e-03] [ 1.53625507e-03 -7.63495320e-03 -6.19955444e-04] [ 7.39225378e-04 5.98338896e-03 -2.35533368e-04] [ 8.25207265e-03 3.25574778e-03 3.05256068e-03] [-3.37178170e-03 -2.39039520e-03 2.36171839e-03] [ 6.98330016e-04 -9.15121996e-05 -7.39502354e-03] [ 5.93028487e-03 4.88968141e-03 7.02105719e-03] [-4.41558459e-03 2.94427545e-05 3.74888686e-04] [ 1.05195641e-02 1.72097663e-03 2.11638635e-03] [ 2.24623028e-03 6.39308073e-03 1.54033931e-03] [ 1.69596586e-03 -6.48197083e-03 -9.42784958e-04] [ 5.25290025e-03 -4.43790352e-03 4.65036913e-03] [-8.23197318e-03 3.79331732e-03 3.88377885e-03] [-1.43921568e-02 1.31636164e-02 5.26789801e-03] [-4.65596818e-03 -3.64620398e-03 -6.98097383e-03] [-7.37584552e-03 -7.71645804e-03 -6.56176199e-03] [-1.46711216e-02 6.47720257e-03 1.40873356e-02] [ 2.67130396e-03 -2.56382112e-03 -6.63573761e-03] [ 1.62476826e-03 1.24651607e-03 5.57173888e-03] [ 6.56355820e-02 8.48238066e-02 3.70089167e-02] [-9.86570205e-02 -1.99990528e-02 1.32506481e-01] [-3.60059380e-02 -1.35388586e-02 -3.53961912e-02] [-3.55205258e-02 7.66301592e-03 -1.30729803e-02] [ 4.82835572e-02 6.32440741e-02 2.78820435e-02] [-1.10138456e-01 -1.79492786e-02 -7.63561104e-02] [ 1.43671101e-02 -4.74730486e-02 -4.28526369e-02] [-1.13466691e-01 5.87088420e-02 5.83075468e-02] [ 1.54809025e-02 4.17108549e-02 -1.74215881e-02] [-1.41910259e-02 -1.86397621e-02 3.63888428e-02] [-1.12886795e-01 2.95472812e-02 1.07611339e-01] [-6.63185545e-02 -2.40006362e-02 1.22307465e-01] [-1.24608134e-01 5.39030574e-02 -3.18837821e-02] [ 3.13478862e-02 -1.87599127e-02 3.12192680e-02] [ 7.79564946e-02 -1.40610815e-02 2.63630408e-02] [-4.34818458e-02 4.17266825e-03 2.90319665e-02] [-1.15997575e-01 3.08872534e-02 -2.99854432e-02] [-7.98359705e-03 2.06138720e-02 8.35384074e-02] [-6.14098659e-03 -1.18821402e-01 -1.08975367e-02] [-5.69295338e-02 -6.06298753e-03 8.12756325e-02] [ 1.36703815e-02 1.75437211e-02 7.73672205e-02] [ 2.04124109e-02 -2.86964442e-02 -2.31392257e-02] [-3.74294511e-02 1.35019107e-02 6.77446127e-02] [-8.29174865e-02 8.86030958e-03 -2.85531741e-02] [ 2.14600452e-02 4.29774809e-02 7.24996745e-04] [ 4.17021387e-02 -8.31156489e-02 2.77642794e-03] [-4.89415745e-02 1.68999858e-02 -5.50133577e-02] [-1.17374891e-01 6.40517088e-02 1.02053739e-01] [-1.49252453e-01 1.36058490e-02 7.10258907e-02] [-3.66140015e-02 -4.88800005e-02 8.76682525e-03] [ 5.89965344e-02 6.61388301e-02 -3.27671564e-03] [-8.84269964e-02 3.28206272e-03 -1.00525446e-01]] Final stress: [ 2.07676897e-04 2.25962469e-05 2.67173693e-05 -2.77752908e-05 -1.82032549e-06 -5.09715292e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.33760799e-02 -2.12320906e-02 -4.42439545e-02] [-6.70553005e-02 -6.59973824e-02 -1.34448423e-01] [ 4.40354858e-02 -8.76745542e-02 -1.31542480e-01] [-9.40357615e-02 -1.30175672e-01 3.37717083e-02] [-5.54254851e-02 -7.80289565e-02 -1.33259372e-01] [ 1.33636955e-01 6.68548436e-02 -6.78361656e-02] [-1.31736358e-01 -4.63546682e-02 -8.61735873e-02] [ 2.83759016e-02 -1.27424066e-01 9.93886941e-02] [-7.83602127e-02 -5.47768473e-02 -1.33368845e-01] [-3.05337145e-02 -1.28562986e-01 -9.72781547e-02] [ 1.31905805e-01 -4.58829724e-02 8.62622123e-02] [-1.26138611e-01 -2.46017272e-02 1.02071749e-01] [-1.25121924e-01 2.12837020e-02 1.03790490e-01] [ 2.13840367e-02 1.25048558e-01 -1.03993876e-01] [ 1.32512654e-01 8.43711292e-02 4.73697869e-02] [-8.79207733e-02 -4.39275690e-02 1.31183068e-01] [-2.05512233e-03 -4.45749458e-05 1.26085679e-05] [ 1.37607500e-03 1.85320954e-05 -3.42002655e-05] [ 2.35342589e-03 1.03567903e-04 3.48631345e-06] [-2.25219804e-03 -1.08979071e-04 2.62984239e-04] [-4.40303085e-04 -2.66950133e-03 6.10358504e-05] [ 4.42736795e-04 2.73028862e-03 7.69221106e-04] [-6.24115262e-04 2.24189115e-03 -1.65559672e-04] [-2.34668520e-04 -2.79939220e-03 -1.53499405e-04] [ 8.46524160e-05 -5.65316505e-04 -2.60207380e-03] [ 5.87892452e-04 9.33395359e-04 2.34686670e-03] [ 5.33691294e-04 9.32770615e-04 2.32159614e-03] [-6.72619426e-04 1.59836995e-04 -2.19716297e-03] [ 7.41235574e-04 -2.60675141e-03 2.15439474e-04] [-2.31080149e-04 2.06658024e-03 6.48998330e-04] [-2.36114168e-04 2.23044442e-03 7.54700154e-04] [ 8.55552417e-04 -2.44281352e-03 2.90021421e-04] [-1.95701627e-03 -3.19788001e-04 -3.74014349e-04] [ 1.95434832e-03 -7.71776480e-04 7.36262234e-04] [ 2.37781897e-03 6.05206512e-04 -5.88341210e-04] [-1.58896413e-03 1.80527124e-04 2.16917003e-04] [ 7.08664226e-04 -2.82200960e-04 2.63400578e-03] [ 6.08314384e-04 2.37928653e-04 -2.16534683e-03] [ 1.21085816e-03 7.21362975e-04 -2.84459129e-03] [-8.26241822e-04 1.25078822e-03 2.50367609e-03] [-1.36928963e-03 6.56169052e-04 5.08788183e-04] [ 2.23888743e-03 1.93177196e-04 -1.14643575e-04] [ 3.26103486e-04 -2.11383330e-03 -5.34443003e-05] [-3.14707017e-04 2.19255249e-03 7.49644199e-04] [ 1.27296209e-03 8.37094165e-04 -2.63401348e-03] [ 1.66353446e-04 2.16312355e-04 2.54571708e-03] [-8.39540408e-04 -2.10063788e-03 4.28858593e-04] [-4.83185144e-04 2.52383732e-03 -2.07118792e-04] [ 1.82865771e-03 -2.26650538e-04 -3.21164322e-04] [-2.29391894e-03 5.66036210e-04 -5.42662052e-04] [-5.91556717e-05 -3.00324143e-04 -2.45133053e-03] [-2.94609298e-04 1.68481962e-04 2.12470171e-03] [-1.87038100e-03 -4.49659966e-04 5.04845723e-04] [ 1.27978713e-03 8.44337775e-04 9.26136280e-04] [ 7.73651973e-04 1.97431355e-03 1.14533541e-03] [-1.58797890e-04 -2.25846711e-03 -2.33521183e-04] [ 2.00789366e-03 -1.70597426e-04 3.12065652e-04] [-1.37069908e-03 1.85420023e-04 2.41302999e-04] [ 6.07800225e-05 2.95162690e-04 1.78179091e-03] [ 1.91355344e-04 -3.00488840e-04 -2.35306931e-03] [-1.54039560e-04 -2.62866053e-03 -5.88386140e-04] [ 6.98846303e-04 2.75581811e-03 -2.45949690e-04] [-9.11247695e-04 5.16382082e-04 -2.54848269e-03] [ 8.67379969e-04 1.26619615e-03 2.27776581e-03] [-3.67528070e-02 -4.09811345e-03 1.71067523e-02] [ 3.59506298e-02 2.93849230e-02 6.81925010e-02] [-2.01724215e-02 4.36111366e-02 5.48349467e-02] [ 2.37163891e-02 7.58464377e-02 -8.24735304e-03] [ 2.64413801e-02 3.48963394e-02 6.43817324e-02] [-5.02583788e-03 2.79109847e-02 3.02454724e-02] [-1.73719077e-02 3.88789100e-02 5.70686341e-02] [ 5.12206495e-02 5.88455527e-02 -3.29766141e-02] [ 2.62904573e-02 4.95244167e-02 6.24373338e-02] [-6.92697077e-02 -3.79271500e-02 3.70692900e-02] [ 5.45320667e-02 2.21999768e-02 3.84613077e-02] [ 2.88323650e-02 3.76239686e-02 7.61951275e-02] [-5.38885556e-02 -3.32637042e-02 2.59075056e-02] [ 6.28448092e-02 1.70429969e-02 4.07983189e-02] [-1.99337466e-02 5.19665664e-02 -5.12073183e-02] [ 3.95089433e-02 9.66347581e-03 6.96244932e-02] [ 1.02572840e-02 7.84113513e-02 2.64191438e-02] [ 2.92780818e-02 3.33747386e-02 3.99115092e-02] [-3.91111487e-03 6.92165166e-02 -4.53783163e-02] [ 2.20399033e-02 4.81800859e-02 5.72641919e-02] [-5.00558121e-02 2.94262176e-02 -4.45432799e-02] [ 5.14874332e-02 -3.35267229e-03 -3.60600091e-02] [-5.69039272e-02 1.14200301e-02 -3.27255916e-02] [ 6.29004866e-02 1.84179256e-02 -5.30118372e-02] [ 5.51417855e-02 -7.86645093e-03 -5.07305083e-02] [-1.68914302e-02 -5.07689960e-02 5.29519612e-02] [ 6.33236792e-02 -3.76400842e-03 -4.06146125e-02] [-5.95936322e-03 -6.85851498e-02 5.53824006e-02] [-5.65528022e-02 -4.55972795e-02 -2.99049918e-02] [-7.87510620e-02 -3.05024037e-02 -8.62306423e-03] [ 4.39290718e-02 2.89767633e-02 -6.58650250e-02] [ 4.05363931e-02 2.15438736e-02 -4.99631482e-02]] Final stress: [-8.75291665e-05 -4.09277305e-05 -4.10596908e-05 -2.28475766e-05 4.97203783e-07 -5.77888245e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 110 steps. Final forces: [[-3.04376392e-02 -9.63124307e-02 1.29431668e-01] [-1.08714030e-01 -1.60287623e-02 -1.21856270e-01] [ 2.72062102e-02 -1.00383565e-01 -1.26818473e-01] [-7.67831660e-02 -1.33245167e-01 5.71390376e-02] [ 5.21503513e-02 -1.32808202e-01 -8.09913325e-02] [-1.06073182e-01 -1.23839007e-01 -1.75577851e-02] [-6.47897664e-02 6.73534247e-02 -1.34880478e-01] [ 3.00858515e-02 -1.29893197e-01 9.56495689e-02] [-5.09752979e-03 -1.13796721e-01 -1.18101225e-01] [ 2.42650434e-02 1.25650483e-01 1.02743626e-01] [ 7.31779667e-02 -1.33391891e-01 -6.14395774e-02] [-6.95397216e-02 -1.33156536e-01 -6.61139449e-02] [-1.34064349e-01 7.13816072e-02 6.21936071e-02] [-9.65507152e-03 1.10637846e-01 -1.20786578e-01] [ 1.33756526e-01 6.60113722e-02 6.84510263e-02] [-7.05692464e-02 -6.34985741e-02 1.33838463e-01] [-3.12840553e-03 -4.00538121e-04 4.34948668e-04] [ 1.42610966e-03 1.75318382e-04 1.69850860e-04] [ 2.66624254e-03 7.09074851e-04 7.41785832e-04] [-2.53401920e-03 9.95724987e-04 -9.72885633e-04] [-3.36994732e-03 -2.18080982e-03 3.30532691e-03] [-2.02966729e-03 1.90794381e-03 -2.09900490e-03] [-1.76765460e-03 2.35510568e-03 -1.76999815e-03] [-3.50567584e-03 -2.44031002e-03 3.53919959e-03] [-2.70169810e-03 2.58815106e-03 -2.40840319e-03] [-2.58855954e-03 -2.58593298e-03 2.02838841e-03] [-9.86569735e-04 -1.00524607e-03 2.06586142e-03] [-2.17964727e-03 2.10623332e-03 -2.48792157e-03] [ 3.44236185e-03 -2.31145271e-03 3.37966498e-03] [ 1.80793892e-03 2.53966965e-03 -1.75957363e-03] [ 1.37697725e-03 2.12431952e-03 -1.34450774e-03] [ 2.97725678e-03 -2.27423218e-03 2.88642257e-03] [-2.27564527e-03 1.65113388e-04 3.28066508e-04] [ 2.35916373e-03 1.20512877e-03 -1.06285643e-03] [ 2.97064318e-03 2.53216042e-04 -2.37061573e-04] [-2.40777718e-03 9.39086855e-04 9.26291006e-04] [ 3.10629641e-03 -3.13968853e-03 2.17373138e-03] [ 2.83493056e-03 2.93320483e-03 -2.79305463e-03] [ 4.18814666e-03 4.22721778e-03 -2.26149980e-03] [ 1.69921994e-03 -1.68558048e-03 2.21653225e-03] [-2.10177573e-03 7.41898403e-04 5.63184409e-04] [ 2.60209054e-03 -2.76924618e-04 2.16287332e-04] [ 2.86958940e-03 -2.21725350e-03 2.87264273e-03] [ 3.39554602e-03 2.36923813e-03 -3.35106058e-03] [ 3.05018088e-03 2.88943121e-03 -2.24970077e-03] [ 1.94956089e-03 -1.93686377e-03 2.51293578e-03] [-1.59837970e-03 -2.92335448e-03 1.51426675e-03] [-2.07895956e-03 2.28118663e-03 -2.06133569e-03] [ 2.08920260e-03 2.52755315e-04 2.02533321e-04] [-2.65209912e-03 -5.63735875e-04 6.14219829e-04] [-2.38602028e-03 2.44164072e-03 -1.92258024e-03] [-1.00920131e-03 -9.60510317e-04 2.48722216e-03] [-2.72964526e-03 8.24194591e-04 -8.20864854e-04] [ 2.64337105e-03 -3.62758299e-04 -3.51942530e-04] [-3.17767743e-03 2.58824269e-03 -3.09792625e-03] [-1.42196917e-03 -2.13028081e-03 1.44624356e-03] [ 2.67150150e-03 -8.34184313e-05 2.07774038e-04] [-2.04823132e-03 2.11768590e-04 2.06185780e-04] [ 2.08300469e-03 -1.88347815e-03 2.31792748e-03] [ 2.29142555e-03 2.27233803e-03 -2.14749310e-03] [ 1.84196364e-03 -2.50833066e-03 1.78884272e-03] [ 2.57032364e-03 1.69986302e-03 -2.47669486e-03] [-2.83892065e-03 2.82900174e-03 -2.32441567e-03] [-3.38919668e-03 -3.26487899e-03 2.44130107e-03] [ 2.22114993e-02 6.42319096e-02 -7.01820618e-02] [ 3.87664685e-02 4.29298466e-02 3.42006303e-02] [-1.43073841e-02 6.90309807e-03 6.63814113e-02] [ 2.84258949e-02 4.28281456e-02 -4.08702314e-02] [ 3.81154705e-02 1.26249214e-02 5.82171728e-02] [-1.20136037e-02 4.32492846e-02 -7.79650328e-02] [ 3.79332140e-03 7.33956003e-02 2.52190466e-02] [ 2.60011009e-02 6.92077461e-02 -2.56281257e-02] [-9.78112556e-03 5.13989471e-02 6.07815807e-02] [ 2.10937583e-02 5.93581248e-02 -1.21704843e-03] [ 9.58264873e-03 -1.69046791e-02 7.29259580e-02] [-3.18995745e-02 9.64576767e-02 3.08441719e-02] [ 5.04295125e-02 4.20909165e-02 2.54327052e-02] [ 4.27428985e-02 -3.23253250e-02 5.43974474e-02] [-2.75842137e-03 6.30757667e-02 -2.08422959e-02] [ 1.64321613e-02 7.92061673e-02 2.92053552e-02] [-1.74631523e-02 -6.74100161e-02 -2.39452778e-02] [ 2.03936696e-02 2.27141658e-02 9.26866763e-02] [ 1.30315189e-02 4.64222085e-02 -5.09118446e-02] [-1.13739135e-02 -4.30863758e-02 -8.15311876e-02] [-2.60507956e-02 3.27397595e-02 6.38926498e-02] [ 6.33673747e-02 9.83367762e-02 8.66897854e-03] [-3.80488856e-02 7.22147563e-02 1.98617572e-04] [ 1.94078768e-02 2.64107970e-02 5.46433238e-02] [ 8.66399347e-02 -3.18511035e-02 -1.45848701e-02] [ 5.01463287e-04 -4.39459040e-02 3.85613013e-02] [ 5.85853995e-02 -4.48119921e-02 -2.39382899e-02] [-1.46151825e-02 -4.96127059e-02 6.45788918e-02] [-4.81068891e-02 -1.77936995e-02 -1.85064648e-02] [-6.32679064e-02 -4.85525274e-02 -2.43221011e-02] [ 3.44144284e-02 5.06336994e-02 -4.11578686e-02] [ 2.68264822e-02 2.56928456e-02 -6.97214076e-02]] Final stress: [ 3.04131470e-06 -9.51551473e-05 -9.57692069e-05 1.01137030e-04 4.64728363e-06 3.94000005e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 21 steps. Final forces: [[ 7.56311240e-02 5.95455882e-02 -1.32314173e-01] [ 2.47810314e-02 -1.26497333e-01 -1.01412013e-01] [ 1.08783557e-01 -1.44088405e-02 -1.21759591e-01] [ 1.27098927e-01 9.95003049e-02 2.80259330e-02] [ 1.30968449e-01 -8.99032674e-02 4.10183107e-02] [ 1.31442261e-01 8.80119999e-02 -4.23249728e-02] [-1.11058274e-01 1.00912969e-02 -1.20380340e-01] [ 5.67528915e-02 7.56314018e-02 -1.33933208e-01] [ 1.02850909e-01 2.17950097e-02 1.26049774e-01] [ 3.88473722e-02 1.30784737e-01 9.09780834e-02] [ 4.89117223e-02 -1.32052824e-01 -8.41788518e-02] [ 1.28569808e-01 9.56737445e-02 -3.47452903e-02] [ 1.32988095e-01 -6.80217282e-02 -6.76349364e-02] [ 6.80795425e-02 1.33195454e-01 -6.71073484e-02] [ 3.27991652e-02 -9.70654319e-02 1.28169355e-01] [-1.34103438e-01 7.53632664e-02 5.64510207e-02] [-7.39000509e-03 -1.69577934e-03 8.64993344e-04] [ 7.44055852e-03 9.45055620e-04 1.71058797e-03] [ 8.62912738e-03 4.51001794e-04 1.31650242e-03] [-7.75971751e-03 6.75507794e-04 -1.53139449e-03] [-2.82365671e-03 -8.29637968e-03 2.83329005e-03] [-9.82980365e-04 4.54304059e-03 -9.51458702e-04] [-2.69782757e-04 4.43729332e-03 -2.66426891e-05] [-6.87717109e-04 -8.80137622e-03 7.44468352e-04] [-1.50518920e-03 7.06594926e-04 -4.56876139e-03] [ 1.73122512e-03 8.11590045e-04 4.26908209e-03] [ 4.78958009e-04 -1.55910289e-04 3.55114550e-03] [-1.98720455e-03 9.40088058e-04 -4.08300728e-03] [-5.71624372e-04 -4.81506474e-03 -4.55298199e-04] [-2.22090429e-03 8.74180990e-03 2.20835273e-03] [-8.54975258e-04 8.36078829e-03 8.42190633e-04] [-3.13221860e-04 -5.89458375e-03 -2.35520869e-04] [-8.06527594e-03 7.35054497e-05 -7.65802502e-04] [ 7.52046968e-03 -1.67213022e-03 2.40644929e-03] [ 8.33433204e-03 -2.09668111e-03 2.82640147e-03] [-7.79466721e-03 -1.21866064e-03 -1.80073509e-03] [ 1.10424682e-03 -3.44570524e-04 3.98818614e-03] [-2.48836654e-03 -1.71121698e-03 -3.72452825e-03] [-1.50671495e-03 -9.40735581e-04 -4.14377729e-03] [ 7.93887055e-04 8.98517947e-05 2.89380738e-03] [-8.23476439e-03 -2.05134647e-03 -2.65989772e-03] [ 7.73991806e-03 -8.93179328e-04 1.74759367e-03] [-1.63369958e-04 -4.95333548e-03 -8.20041953e-06] [-1.00644309e-03 7.86183177e-03 8.62238750e-04] [-1.80136316e-03 -7.86025744e-04 -4.06982649e-03] [ 1.24333317e-03 -5.76871576e-04 4.28361393e-03] [-2.53735694e-04 -8.31720067e-03 1.77406752e-04] [ 4.83537926e-04 5.00093447e-03 5.00856492e-04] [ 7.16676296e-03 1.46537662e-04 9.79415779e-04] [-8.36891082e-03 1.84428193e-04 -8.13107892e-04] [-1.98511660e-03 9.47757226e-04 -3.91944584e-03] [ 1.50380023e-03 7.87080670e-04 4.07361940e-03] [-8.43356413e-03 -1.16269730e-04 -6.79563465e-04] [ 8.22154737e-03 1.33899843e-03 2.39908626e-03] [ 4.72884020e-04 5.03158048e-03 6.42100023e-04] [-1.27547321e-03 -8.22204699e-03 1.07717536e-03] [ 7.80096201e-03 -1.08930016e-03 1.96099616e-03] [-7.54197205e-03 1.02740495e-03 3.52836388e-04] [ 6.39725144e-04 -4.01644287e-04 4.23751856e-03] [-3.31728905e-03 -2.50120206e-03 -3.66866269e-03] [ 6.04691557e-04 -5.07926414e-03 7.25155423e-04] [-8.47449545e-04 8.92586332e-03 8.74183641e-04] [-1.98734577e-03 1.11777135e-03 -4.00761149e-03] [-1.55390185e-03 -2.35425227e-03 4.10359555e-03] [-3.54592547e-02 2.73823865e-02 -5.39682026e-03] [-5.72740650e-02 3.35494817e-03 9.24738151e-02] [-2.73855394e-02 4.76135830e-02 8.17749448e-02] [-2.55313496e-02 -9.84397348e-02 -5.28064537e-02] [ 3.30934155e-02 9.98527960e-02 2.15696843e-05] [-3.15072835e-03 -5.63246974e-02 5.01968355e-02] [-5.89365952e-02 -2.46555636e-02 2.62251080e-02] [-1.00074221e-01 1.75914442e-03 2.85835761e-02] [-2.85656694e-02 8.51481438e-02 -5.46987946e-02] [-7.96664691e-02 -7.19564103e-02 4.51223624e-03] [-5.19406286e-03 4.35601015e-02 9.53431984e-02] [-1.07031754e-01 -7.53800583e-03 2.65701703e-02] [-4.23518907e-02 -3.79257767e-03 3.79204754e-02] [ 9.44115759e-02 -5.39454780e-02 2.13710628e-02] [-5.66155250e-02 -8.07606192e-03 3.37253422e-02] [-8.29643167e-02 -5.76024887e-02 -2.64763245e-02] [ 7.53111436e-03 -1.48259696e-02 3.37113308e-03] [-4.15129287e-02 1.30187816e-03 -9.29385583e-02] [-4.74944526e-03 -5.45244011e-02 8.92623335e-02] [-4.25122362e-02 -9.31073515e-02 -7.23787797e-02] [ 3.60827279e-02 1.10684444e-01 6.61710787e-03] [-7.11327633e-02 -7.43636583e-02 3.23876622e-03] [-9.51298459e-02 -2.73755523e-02 6.40558099e-02] [-3.43218677e-02 -9.07953736e-03 4.30191003e-02] [-8.86171454e-02 7.41924877e-02 3.37166554e-03] [ 1.07772533e-02 -1.11246373e-01 -6.76189858e-03] [-4.07273833e-02 -1.06586978e-03 5.23218566e-02] [-7.24771030e-02 2.53185765e-03 9.20837386e-02] [-6.41174191e-02 8.35724409e-02 -2.06922428e-02] [ 2.51022772e-02 6.41229607e-03 -6.18146634e-02] [ 4.35271282e-02 8.16182517e-05 -4.65525988e-02] [ 7.37136782e-02 -6.93330616e-02 2.21592957e-03]] Final stress: [-4.18091787e-05 2.33178971e-04 -6.65126275e-05 -1.28575588e-06 -1.81592286e-04 -2.33758176e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 38 steps. Final forces: [[-8.70850995e-02 -4.29242726e-02 1.32309653e-01] [-1.69041785e-02 -1.03493779e-01 -1.25559803e-01] [ 1.16233963e-01 1.15829762e-01 -2.05203595e-03] [ 5.02142099e-02 1.33595463e-01 -8.05747563e-02] [-5.39204512e-02 -7.55826058e-02 -1.34921864e-01] [ 5.70588917e-03 1.19706822e-01 1.12146169e-01] [ 1.56767357e-02 1.21083223e-01 -1.09117184e-01] [ 1.30560564e-01 -8.74512410e-02 -4.69889906e-02] [-1.29330759e-01 3.64582669e-02 -9.36948712e-02] [-6.14210316e-02 7.23236666e-02 1.33944795e-01] [ 1.14623170e-01 -1.17003950e-01 -1.25109367e-03] [ 1.30131719e-01 4.86198422e-02 -8.68264986e-02] [ 5.35632076e-02 7.70292444e-02 -1.34434096e-01] [ 5.83198953e-02 1.32607830e-01 -7.64670776e-02] [ 5.46293030e-02 1.32130118e-01 -8.03254303e-02] [-1.24755939e-01 2.20197008e-02 1.03774960e-01] [-8.02662513e-03 -4.65893278e-03 5.53004248e-03] [ 7.61530701e-03 1.85208687e-03 1.15311499e-03] [ 8.71717406e-03 -1.95253606e-03 -2.57509820e-03] [-7.23149025e-03 -2.91865160e-03 3.79728066e-03] [-1.94559288e-03 -5.05768705e-03 2.09991282e-03] [ 1.89242927e-03 8.07208898e-03 1.85832427e-03] [ 9.81996964e-04 7.83038087e-03 9.36728711e-04] [-1.45646376e-03 -5.19331647e-03 1.45350104e-03] [ 2.26565816e-03 -1.75953815e-03 -4.23419394e-03] [-1.17891157e-03 -3.39328011e-04 3.55968313e-03] [-1.37007443e-03 -5.72556663e-04 3.40697167e-03] [ 5.03637415e-04 1.02102904e-04 -4.70427237e-03] [ 1.95088005e-03 -8.53558811e-03 2.00965897e-03] [-1.44290850e-03 4.91054505e-03 1.40752673e-03] [-2.87810274e-03 5.02518458e-03 3.04143028e-03] [ 1.60224214e-03 -7.88861361e-03 1.43064924e-03] [-7.52189544e-03 3.20708877e-03 4.11629055e-03] [ 7.38330531e-03 -9.85599902e-04 3.32468254e-04] [ 7.67421967e-03 1.89978030e-03 -2.57419242e-03] [-8.11717069e-03 2.04198756e-03 2.89816160e-03] [-1.89700406e-03 8.93674645e-04 3.01626402e-03] [ 1.55126624e-03 8.55416325e-04 -4.30279671e-03] [ 3.09673067e-03 2.16386961e-03 -3.90308221e-03] [-2.19273294e-03 1.35246039e-03 4.08197147e-03] [-8.30075645e-03 -1.67810296e-03 -9.09634819e-04] [ 8.08469147e-03 -3.72682567e-03 3.21305589e-03] [ 7.68267629e-04 -8.42591925e-03 7.48099458e-04] [ 1.51346803e-03 5.20086419e-03 -1.36728483e-03] [ 5.18292263e-04 -1.56767231e-04 -4.77123337e-03] [-1.56858266e-03 6.11775619e-04 3.35471059e-03] [-2.94260133e-03 -5.09503076e-03 3.11284742e-03] [ 2.77864974e-04 8.64800799e-03 4.38841893e-06] [ 7.23867394e-03 5.88281082e-04 -4.74659584e-05] [-8.65638771e-03 -5.87626807e-04 1.48313102e-03] [ 2.14425131e-03 -1.48311212e-03 -4.44172771e-03] [ 4.84393808e-05 9.69174534e-04 3.86650895e-03] [-7.52814617e-03 -1.37819446e-03 2.32273029e-03] [ 8.07053721e-03 -9.79709649e-04 -1.79122795e-03] [ 7.74279741e-04 9.26981045e-03 8.55638607e-04] [-2.53611281e-03 -4.49762788e-03 2.65820594e-03] [ 8.42053088e-03 -1.23476626e-03 5.79335929e-04] [-7.31465077e-03 4.82610427e-04 1.36142673e-03] [ 1.67404912e-03 -2.63449079e-03 4.24730915e-03] [ 1.25285323e-03 6.38286445e-04 -3.71235036e-03] [-9.35220913e-04 -8.46624212e-03 -1.03337178e-03] [-5.66456521e-03 5.57187446e-03 5.88830311e-03] [ 2.40915636e-03 -1.80733905e-03 -3.68885263e-03] [-2.25288926e-03 -1.57889227e-03 3.53487082e-03] [ 7.27166946e-02 6.63695189e-02 -3.02896517e-02] [-5.50696018e-03 -4.74883738e-02 4.46342606e-02] [-1.00869444e-01 -2.39036709e-02 -2.67675528e-02] [-2.73064343e-02 -1.15548598e-01 2.68266162e-02] [-2.63650971e-02 6.06725047e-02 5.41106578e-02] [ 1.20198920e-03 -3.06511486e-02 -1.03157590e-01] [ 2.26084710e-02 -1.06994292e-01 8.72558647e-03] [-5.68369765e-03 -1.36132404e-02 2.80393361e-02] [-3.23337824e-02 4.94937865e-02 7.94479527e-02] [ 3.04341252e-02 -1.09387718e-01 -1.46621507e-02] [-1.58521248e-02 -2.50115231e-02 -1.11584090e-02] [ 1.32726090e-02 -1.47698763e-02 3.04188427e-02] [-3.39683329e-02 -3.43297076e-02 -6.73177023e-02] [-6.35186180e-02 -6.39297523e-02 9.36872861e-02] [ 9.26567102e-03 9.79548902e-02 3.87187463e-02] [ 7.60281515e-02 -2.24006495e-02 1.84159997e-02] [-7.07461349e-03 3.16390586e-02 -1.18688471e-01] [ 1.34438034e-02 1.54525421e-02 1.04704135e-01] [-6.78574014e-02 1.79505784e-02 -2.64218670e-02] [ 7.97280591e-02 -9.98283594e-02 -1.00724291e-02] [-4.69949234e-02 9.14391292e-02 6.20780550e-02] [ 6.72984974e-03 -9.93303312e-02 7.44666503e-02] [-1.56934991e-02 1.11999695e-02 -1.93075100e-02] [-6.03635058e-02 2.01213964e-02 7.37098048e-03] [ 3.48539502e-02 4.74168018e-02 7.56058670e-02] [-4.73332407e-02 -7.46873703e-02 8.15499177e-02] [-3.74292000e-02 -6.35644695e-02 1.06323873e-02] [-7.61809831e-03 1.64745005e-03 -1.70737674e-02] [-2.08749915e-02 -2.04118541e-02 4.71449468e-02] [-5.83871773e-02 -1.05737473e-01 7.12859055e-02] [ 8.77361074e-02 4.57496102e-02 -2.68542118e-03] [-1.87008533e-02 -5.90612753e-02 -5.95272418e-02]] Final stress: [-4.01055978e-05 2.53747243e-04 -9.29167255e-05 -8.74282590e-07 1.75990406e-04 -5.87126109e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 25 steps. Final forces: [[-3.45800322e-02 -5.62939515e-02 9.11084419e-02] [ 9.66841235e-02 -1.28609918e-01 -3.24914251e-02] [ 1.33611504e-01 5.83863740e-02 -7.53253623e-02] [ 1.33988325e-01 6.16148653e-02 7.20817952e-02] [ 9.62006545e-02 -1.28891099e-01 -3.28653253e-02] [ 1.07154244e-01 1.23214197e-01 1.64702908e-02] [ 6.67717746e-02 1.33912156e-01 -6.74954343e-02] [-4.35048904e-02 -8.80424243e-02 1.31494266e-01] [ 1.20081188e-01 -1.11585531e-01 8.43209529e-03] [ 3.56747168e-02 9.09063831e-02 5.55096494e-02] [ 1.00398957e-01 -1.27124341e-01 -2.66064813e-02] [ 1.32439332e-01 4.76309341e-02 -8.44060417e-02] [ 5.88108455e-02 -1.33714865e-01 7.48131830e-02] [-2.17440937e-02 1.03496727e-01 -1.25556065e-01] [ 1.31548034e-01 7.92395076e-02 5.22062240e-02] [-4.18966070e-02 -6.38925018e-02 1.06359486e-01] [-5.79773126e-03 1.69944577e-03 -1.67683947e-03] [ 5.81114786e-03 1.61849515e-03 1.59530270e-03] [ 5.83745548e-03 1.61417198e-03 1.60629915e-03] [-5.67225217e-03 1.79500069e-03 -1.78628316e-03] [-2.55317120e-04 2.91739173e-06 2.60735522e-04] [-2.87922136e-04 2.65823731e-03 -3.01003745e-04] [-2.30875659e-04 2.65987213e-03 -2.46983770e-04] [-1.88356422e-04 8.06091981e-06 1.90417328e-04] [-1.76980132e-03 1.73141816e-03 -3.59362935e-03] [ 1.51229751e-03 1.49249442e-03 3.63404785e-03] [ 1.50655640e-03 1.48030533e-03 3.60586059e-03] [-1.77872652e-03 1.73558689e-03 -3.58606481e-03] [-1.58088707e-04 -2.74729030e-03 -1.63784422e-04] [-7.80926985e-05 -2.70362824e-05 6.95749066e-05] [-1.29833314e-04 -5.00010746e-05 1.31540193e-04] [-3.19213395e-04 -2.71438857e-03 -3.24445140e-04] [-5.70943803e-03 -1.54780161e-03 -1.53415704e-03] [ 5.79345974e-03 -1.52857758e-03 1.53143173e-03] [ 5.74700980e-03 -1.60966862e-03 1.60173156e-03] [-5.72575049e-03 -1.62042180e-03 -1.61217736e-03] [ 1.35347221e-03 -1.34116055e-03 3.62423626e-03] [-1.55954623e-03 -1.51727651e-03 -3.65159256e-03] [-1.75493444e-03 -1.71097192e-03 -3.56463737e-03] [ 1.53979357e-03 -1.52552174e-03 3.60889351e-03] [-5.69820665e-03 -1.83841415e-03 -1.82665487e-03] [ 5.81916866e-03 -1.66911027e-03 1.66308304e-03] [-7.18248910e-05 -2.70947862e-03 -7.61802937e-05] [-1.62399803e-04 5.58982539e-06 1.54903849e-04] [-1.67513250e-03 -1.63236622e-03 -3.68160954e-03] [ 1.52261385e-03 -1.50868857e-03 3.63044393e-03] [-1.79289521e-04 8.17047483e-05 1.77298946e-04] [-1.04724638e-04 2.76407907e-03 -1.05168430e-04] [ 5.80469056e-03 1.63582481e-03 1.61980925e-03] [-5.81119924e-03 1.61815385e-03 -1.59364578e-03] [-1.86223304e-03 1.81641451e-03 -3.61458972e-03] [ 1.54902313e-03 1.52996920e-03 3.56968273e-03] [-5.71178637e-03 1.75109863e-03 -1.73198752e-03] [ 5.89928448e-03 1.71954349e-03 1.71611686e-03] [-1.43897581e-04 2.71021951e-03 -1.46088324e-04] [-1.97724954e-04 9.25555928e-06 1.91843687e-04] [ 5.72233261e-03 -1.65936014e-03 1.65105011e-03] [-5.76427738e-03 -1.73523161e-03 -1.72469676e-03] [ 1.39923156e-03 -1.38374280e-03 3.65627641e-03] [-1.61659872e-03 -1.57475386e-03 -3.59509986e-03] [-1.12988027e-04 -2.71161360e-03 -1.17448891e-04] [-3.46370296e-04 -4.83444221e-05 3.48595508e-04] [-1.66145449e-03 1.61421390e-03 -3.60646745e-03] [ 1.50398049e-03 1.48554795e-03 3.61631372e-03] [ 1.72689329e-02 2.66326065e-02 -5.00286963e-02] [-4.76754127e-02 6.67659707e-02 1.46034050e-02] [-6.52637433e-02 -3.05569093e-02 3.89164379e-02] [-6.60481613e-02 -2.66323330e-02 -3.01895812e-02] [-4.59814710e-02 5.67512012e-02 2.19754676e-02] [ 1.41916538e-02 2.87010968e-02 -4.06900059e-02] [-6.43197614e-02 -2.74237594e-02 3.17724482e-02] [-6.67970848e-02 -3.41012679e-02 -3.66550435e-02] [-4.73542424e-02 5.77224510e-02 2.12396629e-02] [-5.21982323e-02 -5.71932702e-02 -1.43106670e-02] [-3.45868615e-02 -7.07425501e-02 2.83643956e-02] [-4.62023479e-02 6.89063951e-02 1.41488710e-02] [-5.38139247e-02 -5.87195943e-02 -5.70019967e-03] [-3.54426928e-02 -5.89310928e-02 3.90529823e-02] [ 2.09044143e-02 4.24299499e-02 -6.75837324e-02] [-5.80310778e-02 5.87495879e-02 -6.54643764e-03] [-1.80725376e-02 -4.58885013e-02 -2.34870653e-02] [-5.60068262e-02 4.84095555e-02 3.03008401e-03] [ 2.00060487e-02 4.48184430e-02 -6.24673644e-02] [-1.94893650e-02 -4.14318800e-02 -3.39771349e-02] [-4.86628179e-02 5.80752189e-02 2.00529942e-02] [-6.26428443e-02 -2.04271176e-02 3.42687531e-02] [-4.97617907e-02 6.80098653e-02 9.06210920e-03] [-6.55092867e-02 -2.43719599e-02 4.21548786e-02] [-2.82267230e-02 6.41519278e-02 -4.09622129e-02] [ 8.83130225e-03 -4.61857423e-02 6.54061834e-02] [-2.86236657e-02 6.57754392e-02 -3.52079607e-02] [ 6.76481422e-03 -5.55608740e-02 5.85419979e-02] [-6.73292166e-02 -4.45659120e-02 -2.88451364e-02] [-6.51560072e-02 -3.52223929e-02 -2.13175208e-02] [ 1.89598369e-02 2.87437583e-02 -5.91957126e-02] [ 1.88454871e-02 3.22387771e-02 -4.87497488e-02]] Final stress: [-7.01325471e-05 -5.92396255e-05 -8.72394934e-05 1.44528564e-06 1.32767387e-06 6.00337005e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 24 steps. Final forces: [[ 7.63010311e-02 -1.33416368e-01 5.76512250e-02] [ 5.92742464e-03 -1.18502129e-01 -1.13318122e-01] [ 1.33838724e-01 6.48818854e-02 -6.94320980e-02] [ 1.33837609e-01 6.21626193e-02 7.17449980e-02] [ 3.88493531e-04 -1.15672292e-01 -1.16335705e-01] [-2.88178033e-02 9.85610233e-02 1.28050255e-01] [ 5.72118702e-02 1.33102600e-01 -7.70085791e-02] [ 1.25353964e-01 -1.03620301e-01 -2.22629174e-02] [ 6.28266846e-02 -1.33902878e-01 -7.10312859e-02] [ 9.84467841e-02 1.27823283e-01 3.01933132e-02] [ 1.01192482e-01 -1.26657080e-01 -2.53061353e-02] [ 1.10645990e-01 -9.79919940e-03 -1.20836236e-01] [-9.17526002e-02 1.27685309e-01 -3.64907111e-02] [ 3.31441294e-02 1.28568174e-01 -9.64271293e-02] [ 1.33436094e-01 7.77915808e-02 5.54313528e-02] [-7.94380980e-02 -5.31030076e-02 1.33484604e-01] [-4.98689483e-03 -1.10313117e-03 1.28519153e-03] [ 4.83150857e-03 -8.38663088e-04 -9.80198228e-04] [ 5.03592310e-03 -1.03733105e-03 -1.15694146e-03] [-4.90866996e-03 -1.21173445e-03 1.39902565e-03] [-6.60662812e-04 -1.87859777e-03 6.61350272e-04] [-2.45484605e-05 1.94012856e-04 -4.56539814e-05] [-1.77169073e-04 1.44622892e-05 -1.89036252e-04] [-4.33118794e-04 -1.88883724e-03 4.31527705e-04] [ 8.25078269e-04 -6.56732271e-04 -3.26435393e-03] [-1.19862008e-03 -9.67129962e-04 3.20560868e-03] [-1.18603333e-03 -9.74654953e-04 3.21619396e-03] [ 8.90548887e-04 -7.31273421e-04 -3.20567903e-03] [ 2.96217788e-04 -2.74251586e-04 2.64831266e-04] [-4.53140749e-04 1.86573238e-03 4.65283934e-04] [-7.43298321e-04 1.81582522e-03 7.63023349e-04] [-4.10982551e-04 -1.57963910e-04 -4.28977618e-04] [-4.85890203e-03 1.29979549e-03 1.47281673e-03] [ 4.95448150e-03 1.21168186e-03 -1.32408586e-03] [ 5.14556978e-03 1.18345952e-03 -1.31733584e-03] [-4.86815866e-03 1.34481215e-03 1.49612804e-03] [-1.30723412e-03 1.06918127e-03 3.00554895e-03] [ 1.11194491e-03 9.47930928e-04 -3.25639660e-03] [ 1.03035119e-03 8.66011946e-04 -2.97249015e-03] [-1.62129159e-03 1.39973971e-03 3.30885815e-03] [-4.91453611e-03 5.40337839e-04 6.92047283e-04] [ 5.05142397e-03 4.58194390e-04 -5.90974189e-04] [ 1.35239055e-04 -1.66214123e-04 1.24235093e-04] [-8.70622595e-05 1.89616838e-03 8.37791550e-05] [ 1.01681472e-03 8.11419360e-04 -3.41101429e-03] [-1.26070033e-03 1.03061996e-03 2.98293360e-03] [-2.56293374e-04 -1.78895285e-03 2.63206953e-04] [-1.59407485e-04 2.44348957e-04 -1.60285684e-04] [ 5.01599207e-03 -9.32886679e-04 -1.10011127e-03] [-5.04079376e-03 -9.46649731e-04 1.12796045e-03] [ 8.50671181e-04 -3.29247707e-03 -9.05924335e-04] [-9.31126162e-04 -7.08691225e-04 3.22817894e-03] [-4.82931763e-03 -7.66295975e-04 9.28486729e-04] [ 5.02799724e-03 -5.88547788e-04 -7.35983261e-04] [ 4.13670797e-05 2.42531865e-04 4.34042240e-05] [-6.24190204e-04 7.22370425e-04 -2.07082395e-03] [ 4.94780564e-03 5.90885999e-04 -7.12363414e-04] [-4.81132004e-03 8.50566971e-04 1.01344343e-03] [-1.17468361e-03 9.50682298e-04 3.21524032e-03] [ 7.87892597e-04 6.07844216e-04 -3.11573653e-03] [-6.58994428e-04 -3.24941533e-04 -6.63274492e-04] [-9.24796107e-04 1.80232715e-03 9.30408154e-04] [ 9.97965448e-04 -8.49938722e-04 -3.13665674e-03] [-1.11458284e-03 -8.75775939e-04 3.09669891e-03] [-4.02051952e-02 5.99936692e-02 -3.23577134e-02] [-3.23389344e-03 5.18272452e-02 5.64322948e-02] [-6.21619867e-02 -3.62093988e-02 3.31903280e-02] [-6.64197633e-02 -3.38500322e-02 -2.93722795e-02] [-8.28096296e-03 5.44894154e-02 5.23654251e-02] [-3.50648947e-02 6.93641633e-02 -2.84703373e-02] [-6.44932896e-02 -2.95748022e-02 3.13790301e-02] [-6.32518278e-02 -3.21923329e-02 -3.11450106e-02] [-8.11905520e-03 4.76703512e-02 5.74725712e-02] [ 8.87263576e-03 -4.33267164e-02 -5.98431026e-02] [-2.60651446e-02 -6.62349072e-02 3.29621048e-02] [ 8.87295286e-04 5.25902290e-02 5.46726508e-02] [ 1.22814865e-02 -4.51437793e-02 -6.18509516e-02] [-3.94516532e-02 -5.71846644e-02 4.37421661e-02] [-5.89569554e-02 5.28328150e-02 9.38156506e-03] [-2.50858168e-02 6.77482065e-02 3.05466765e-02] [-5.13321890e-02 -5.64335550e-02 -2.19915974e-02] [-3.64616458e-02 6.12707564e-02 4.13363605e-02] [-5.71673698e-02 5.58585883e-02 5.53624269e-03] [-4.62882857e-02 -5.84999137e-02 -8.36974685e-03] [-5.19502368e-02 6.12844301e-02 1.95556764e-02] [-5.20869314e-02 5.00228363e-03 5.68648516e-02] [-4.25760888e-02 5.92033873e-02 1.28649101e-02] [-4.92611220e-02 4.33551088e-04 5.57002993e-02] [ 5.09162729e-02 -6.21147280e-02 1.82003504e-02] [-2.52486529e-02 -5.79984265e-02 5.40530782e-02] [ 4.80442654e-02 -5.74896265e-02 8.05301554e-03] [-1.68488165e-02 -6.04929764e-02 4.53090181e-02] [-6.00803253e-02 -4.27956779e-02 -2.30259643e-02] [-7.08868541e-02 -3.65886489e-02 -1.84092300e-02] [ 3.63918758e-02 2.26728527e-02 -7.09709934e-02] [ 3.76740818e-02 2.69857522e-02 -6.58796314e-02]] Final stress: [-9.38348665e-05 -4.60512513e-05 -5.57050519e-05 -5.34658455e-06 4.44517129e-06 -1.88800690e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[-2.06261081e-02 -1.03705072e-01 1.25452935e-01] [ 6.40809835e-02 -1.31902956e-01 -7.33624119e-02] [ 9.37252373e-02 1.29846155e-01 3.44219765e-02] [-6.05661872e-02 -1.34266568e-01 7.17752413e-02] [ 5.96478376e-02 -1.33757743e-01 -7.31113482e-02] [ 1.58371697e-02 1.22132564e-01 1.08093937e-01] [ 9.79681767e-02 1.27505516e-01 -3.08780225e-02] [-1.16567168e-01 1.15318179e-01 4.12939813e-03] [ 7.56058992e-02 -1.33877613e-01 -5.64914720e-02] [-5.99726925e-02 7.07680592e-02 1.35169919e-01] [-6.04505482e-02 -7.15121571e-02 -1.34730071e-01] [ 1.34375204e-01 6.54967734e-02 -6.69292715e-02] [ 1.21820541e-01 -1.08757776e-01 -1.36007288e-02] [ 1.12763582e-01 1.18859801e-01 -1.06542715e-02] [ 1.32391872e-01 6.00715846e-02 7.55969404e-02] [-1.09050075e-01 -9.24953917e-03 1.22147133e-01] [-8.32887380e-03 -1.99008698e-03 1.32206166e-03] [ 8.10102169e-03 -9.81416813e-04 -1.72189339e-03] [ 8.40299433e-03 -1.36538176e-03 -2.10769525e-03] [-7.73969304e-03 1.51335121e-03 -2.27775360e-03] [-4.06713525e-03 -4.13795083e-03 3.30391680e-03] [-5.27990202e-05 2.80119854e-03 -8.52215209e-04] [-5.38096856e-04 3.95883922e-03 -1.40534703e-03] [-3.29907617e-03 -3.60645531e-03 2.57503421e-03] [-2.22117547e-03 2.02338834e-03 -8.71626768e-03] [-2.30783802e-03 -2.28385457e-03 5.33588306e-03] [ 1.77739120e-03 2.02565986e-03 5.83011378e-03] [-3.21392505e-05 -1.50132187e-04 -8.54516291e-03] [-3.73957636e-03 -3.96636990e-03 -2.89797667e-03] [ 1.70798895e-03 4.39880695e-03 -1.00342570e-03] [-7.49423477e-04 4.56711562e-03 1.54510137e-03] [-2.87501647e-03 -4.78906492e-03 -2.22911640e-03] [-7.59793236e-03 -1.10322780e-03 -3.08232709e-04] [ 7.50272487e-03 3.46413735e-03 -2.73390199e-03] [ 8.63327840e-03 2.09977417e-03 -1.34161384e-03] [-7.23584574e-03 -1.36572906e-03 -5.89553831e-04] [-2.38798916e-03 2.07302422e-03 8.49009912e-03] [-5.82850352e-04 -4.68626029e-04 -5.04098365e-03] [ 1.34940662e-03 1.45005090e-03 -4.53046011e-03] [ 2.59125810e-04 -3.90111495e-04 8.56772433e-03] [-7.42038165e-03 -1.53685676e-03 -8.95085735e-04] [ 8.94830439e-03 -5.81291463e-04 1.42071516e-03] [-2.53088619e-03 -4.66200901e-03 -1.82595854e-03] [ 2.38639019e-03 4.33890065e-03 -1.61527475e-03] [-2.89618247e-03 -2.75470757e-03 -5.90725665e-03] [-7.92076431e-04 5.89076807e-04 7.91608477e-03] [-2.27841628e-03 -3.26327694e-03 1.43484117e-03] [-2.61548426e-04 4.79682101e-03 -1.11726680e-03] [ 7.97405826e-03 3.61729241e-03 2.79199540e-03] [-7.93287344e-03 -3.83861134e-03 3.09837005e-03] [-2.07298737e-03 2.11494591e-03 -8.69795107e-03] [-1.51215614e-03 -1.46080436e-03 5.82867962e-03] [-7.60037583e-03 -1.32979030e-03 6.07366618e-04] [ 8.87198348e-03 2.51202204e-03 1.70511670e-03] [ 2.98692754e-04 3.63602716e-03 -3.83413398e-04] [-1.68691816e-03 -3.98958009e-03 9.84399694e-04] [ 7.70199054e-03 8.89855409e-04 -8.05705123e-05] [-8.47063324e-03 -3.52951081e-03 -2.80451684e-03] [-6.07666533e-04 5.81161766e-04 8.24419647e-03] [-4.65442166e-04 -4.28896811e-04 -4.75693626e-03] [-3.10223055e-03 -4.04598858e-03 -2.46793189e-03] [-3.36003226e-03 4.19292847e-03 4.12783587e-03] [ 1.09690183e-03 -1.44458805e-03 -8.58343448e-03] [-4.75471300e-04 -3.75105285e-04 5.11830718e-03] [-3.36547152e-03 1.10524800e-02 -5.43015204e-02] [-3.47575221e-02 6.14249753e-02 1.14317977e-01] [-5.97404452e-02 1.42466188e-02 -6.22322304e-02] [ 5.24542804e-02 -1.64121076e-02 -6.02266923e-02] [-5.14088260e-02 2.15449591e-02 -8.12085198e-03] [ 1.86075281e-02 9.08954635e-02 -1.00471414e-01] [ 1.90264897e-02 -8.84524206e-02 4.29614223e-02] [-2.62527526e-02 6.91829602e-02 6.95780397e-02] [-2.10637236e-02 1.14381215e-02 -4.92675204e-02] [ 3.16588797e-02 -5.60425372e-02 2.09473343e-02] [-6.70214624e-02 -2.02130352e-02 5.01116807e-02] [ 6.48859366e-03 3.74772781e-02 6.98198813e-02] [-4.60154917e-02 2.01953955e-02 -9.32134920e-02] [-9.73246506e-03 -4.59637873e-02 -1.92622739e-02] [ 2.20657977e-02 -4.95585838e-02 1.19024628e-02] [ 2.44016564e-02 6.77535553e-02 3.62543345e-02] [-3.66213648e-02 1.13305498e-02 -9.18069905e-02] [-3.42127974e-02 -1.00980882e-03 5.23574120e-03] [ 6.16142363e-02 -2.95704251e-02 -8.17496250e-02] [ 4.26173361e-02 -2.85364371e-02 -1.32257044e-02] [-7.54575045e-03 -4.91971733e-04 6.29129140e-02] [ 3.20431596e-03 -4.29452739e-02 5.92446650e-02] [ 3.50937776e-02 7.13814898e-02 9.04851838e-02] [-9.43405246e-02 7.74509578e-03 -4.68560065e-02] [-6.94479738e-02 6.29211526e-04 1.79365755e-02] [-4.08479534e-02 -1.17743378e-01 -2.15068953e-02] [-2.16572712e-02 1.02424686e-01 -4.06913223e-02] [-1.35295971e-01 -2.29063227e-02 6.90103433e-02] [-8.43548168e-02 -1.42682964e-02 3.63356997e-02] [ 1.44063119e-02 -7.09800045e-02 -6.86434993e-02] [ 1.47379623e-02 7.45698013e-03 -2.93194107e-02] [ 4.85311805e-02 1.81404081e-02 -1.27999335e-01]] Final stress: [-4.18710253e-05 -8.59134056e-05 2.49110887e-04 -2.57525204e-06 1.33416717e-06 -1.71704763e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[-1.68860859e-03 -1.14119263e-01 1.17880810e-01] [-2.80714809e-02 -9.87797087e-02 -1.27893977e-01] [-3.68978566e-02 9.31001668e-02 1.30026603e-01] [ 7.55912226e-02 -5.77675535e-02 1.33253999e-01] [ 2.79683337e-02 -1.28270057e-01 -9.79351837e-02] [ 9.01221159e-02 1.29558358e-01 4.46703955e-02] [-1.04888018e-01 1.98767401e-02 -1.24069353e-01] [-5.69876245e-02 -7.64628078e-02 1.33505494e-01] [ 3.35278018e-02 -1.29893398e-01 -9.38729703e-02] [ 3.30636654e-02 1.27286899e-01 9.77977618e-02] [ 1.13067710e-01 -1.18731073e-01 -5.82339023e-03] [ 1.07343240e-01 1.23443508e-01 1.30691738e-02] [-1.30191704e-01 3.55446921e-02 9.29144173e-02] [ 2.44357452e-02 1.23884539e-01 -1.04918338e-01] [ 1.32654655e-01 5.50687450e-02 7.88658217e-02] [ 5.97422426e-03 -1.19668189e-01 1.11772365e-01] [-8.29949875e-03 2.29291238e-03 -1.42846543e-03] [ 7.93956189e-03 -2.54511960e-03 -1.93711562e-03] [ 8.09158904e-03 2.67770288e-04 9.57072935e-04] [-8.16594148e-03 3.36614067e-03 -2.49514715e-03] [-3.82134013e-04 -4.41597233e-03 1.14884357e-03] [-2.93329572e-03 3.17657481e-03 -2.41368179e-03] [-2.93251820e-03 3.89697547e-03 -2.30975018e-03] [ 1.55498261e-03 -4.37159291e-03 -6.54621399e-04] [-1.53393153e-03 1.45306950e-03 -6.26792605e-03] [ 1.79805054e-03 1.99920218e-03 7.48854749e-03] [ 1.53585469e-03 1.51991236e-03 8.98749405e-03] [-8.54951971e-04 6.90022714e-04 -5.51696946e-03] [ 4.29485590e-03 -4.15743759e-03 3.43733404e-03] [-1.92279289e-03 4.43476206e-03 1.16709473e-03] [-2.71651506e-03 3.84225596e-03 2.07474372e-03] [-1.39511525e-03 -5.08269942e-03 -2.19117270e-03] [-7.94931316e-03 2.25366762e-03 1.59891330e-03] [ 8.35521735e-03 1.43966766e-03 -1.97656516e-03] [ 8.47154280e-03 -6.67458263e-04 -4.46719266e-05] [-7.64122814e-03 2.71524195e-03 1.98011606e-03] [ 2.65022989e-03 -2.66036108e-03 5.65430071e-03] [ 1.70796723e-03 1.82746186e-03 -8.00994395e-03] [ 1.86651181e-03 2.00756725e-03 -7.61920094e-03] [-7.47225043e-04 6.07394309e-04 5.81577556e-03] [-7.85004527e-03 2.06844557e-03 1.12025698e-03] [ 7.00178030e-03 -2.62647591e-03 1.97916985e-03] [ 1.56907417e-03 -4.48256401e-03 7.39474875e-04] [-2.14842810e-03 4.03412840e-03 1.44022657e-03] [ 2.36478099e-03 2.37548358e-03 -8.91465023e-03] [-1.01137882e-03 9.40549152e-04 5.08817099e-03] [ 6.27039615e-04 -3.74883216e-03 6.36600763e-05] [-1.24524886e-03 4.02982634e-03 -6.37684065e-04] [ 8.15026262e-03 -3.17294109e-03 -2.62054521e-03] [-8.44358757e-03 2.15498490e-03 -1.50874373e-03] [-1.03770653e-03 8.86295967e-04 -5.61359892e-03] [-2.47536273e-04 -2.32466357e-04 8.35251748e-03] [-7.45928837e-03 1.44290896e-03 -6.58020076e-04] [ 8.53483725e-03 3.43590852e-04 1.01339711e-03] [-1.42620907e-03 3.77640441e-03 -8.17954404e-04] [ 2.17598693e-03 -3.46778786e-03 -1.53051416e-03] [ 7.79570504e-03 -5.49057291e-04 -6.71355908e-06] [-7.81519917e-03 -4.56059220e-04 -1.21461872e-03] [-3.60704898e-03 3.45169901e-03 5.66335812e-03] [-1.24795816e-03 -1.16844133e-03 -7.71914855e-03] [-1.27189147e-03 -4.09003569e-03 -2.05819655e-03] [-1.00276825e-03 4.35902876e-03 4.86462177e-04] [ 7.41368979e-04 -7.20212545e-04 -5.12151459e-03] [ 1.60549283e-03 1.75829710e-03 8.44330700e-03] [ 2.40030948e-02 6.65235116e-02 -4.10393243e-02] [-4.65928815e-03 1.99114961e-02 1.13232032e-01] [ 3.32423085e-02 -5.91357959e-02 -1.02601407e-01] [-6.27783207e-02 3.28402903e-02 -4.79366878e-02] [ 4.41844058e-02 6.64932508e-02 1.61633824e-02] [-2.16178933e-02 4.80038673e-02 -1.03857942e-01] [ 1.70842802e-02 -4.25119754e-02 -5.97856482e-02] [-2.33473842e-02 -5.00300343e-02 2.43864578e-04] [ 5.44334169e-02 6.50474694e-02 -2.96698514e-02] [-6.69756767e-02 -2.57252555e-02 2.19445375e-02] [ 3.62155737e-02 -2.59743535e-02 6.84562502e-02] [-3.87139742e-02 1.26328660e-02 7.48723065e-02] [-6.04994941e-02 -4.44102155e-02 -6.95131972e-02] [-2.21723879e-03 -3.64368564e-03 -1.73076650e-02] [ 7.59610631e-02 8.47789978e-02 -1.92764011e-02] [-2.26004610e-02 1.27085090e-02 6.31772110e-02] [-1.16510228e-02 -5.71590316e-02 -7.90575988e-02] [ 3.33709531e-02 6.48518656e-02 -1.88465081e-02] [-7.89383933e-03 2.08542118e-03 -1.34735096e-01] [-3.79505714e-02 1.30537258e-02 8.21212966e-03] [ 4.88483969e-03 1.01682123e-01 -2.87125619e-02] [-6.96333237e-02 -2.34732736e-02 1.97533597e-02] [-9.12777769e-02 2.22938011e-02 5.57661056e-02] [ 6.10297296e-03 -1.06751609e-01 -4.07497126e-02] [ 8.04618786e-02 5.07543691e-02 3.96955451e-02] [-4.80716327e-02 -4.76735394e-02 3.85809672e-02] [ 4.14917229e-03 -2.35630913e-02 -1.14939740e-01] [-2.40811237e-02 -8.95781976e-02 1.14779589e-01] [-3.62673838e-02 -5.28697309e-02 1.44837571e-02] [-5.96101296e-02 -1.06440156e-02 -5.64754124e-02] [ 4.19716510e-02 8.45940658e-02 -2.11582733e-02] [-4.67864330e-02 3.00198483e-02 -5.63547429e-02]] Final stress: [-4.07161742e-05 -8.40151186e-05 2.32637422e-04 -2.10902020e-07 1.99522141e-07 1.51289850e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.08144870e-02 -3.84500589e-02 4.93147562e-02] [ 3.47725823e-03 -1.17619423e-01 -1.14405578e-01] [ 3.22491866e-02 1.09670981e-01 7.71589051e-02] [ 3.04657222e-02 2.06008636e-02 9.91096676e-03] [-8.23763041e-02 -1.00203801e-02 -9.25848553e-02] [ 1.30102622e-01 9.30228899e-02 -3.69614580e-02] [ 3.85898155e-02 1.06072203e-01 -6.77497863e-02] [-2.94137787e-02 2.72089243e-02 2.28503979e-03] [ 9.01511787e-02 -1.29723189e-01 -3.99644708e-02] [-1.59973683e-02 2.30965366e-03 1.83153677e-02] [-5.53640774e-03 -1.05025904e-01 -1.10468940e-01] [ 1.33616543e-01 5.72870194e-02 -7.62348283e-02] [-8.50744974e-03 -2.74999950e-02 3.58487159e-02] [ 3.33554526e-02 1.29097930e-01 -9.57498447e-02] [ 5.23448537e-02 7.23808060e-02 -2.02806265e-02] [ 7.25411583e-02 -4.86318443e-02 -2.37413839e-02] [-6.13246940e-03 -2.00507970e-03 2.10219480e-03] [ 6.17378200e-03 1.90651966e-03 1.99287594e-03] [ 6.16473048e-03 1.98461968e-03 2.07259055e-03] [-6.12425006e-03 -1.93329525e-03 2.01639269e-03] [-2.02773590e-03 -3.77559192e-03 2.07700431e-03] [ 1.87911453e-03 3.78027769e-03 1.91964471e-03] [ 1.79618003e-03 3.79728940e-03 1.84375554e-03] [-2.00806032e-03 -3.82519596e-03 2.05769035e-03] [-4.71893888e-05 3.54469251e-05 1.49815850e-04] [-4.29767333e-05 -3.72215145e-05 3.10713467e-03] [ 8.55426899e-05 8.34586671e-05 3.08682116e-03] [-3.35318208e-05 2.09596810e-05 1.07210264e-04] [-1.85154256e-03 -3.81602530e-03 -1.89707852e-03] [ 1.75768337e-03 3.74021253e-03 -1.79991557e-03] [ 1.72774952e-03 3.81845260e-03 -1.76966428e-03] [-1.99000635e-03 -3.81161294e-03 -2.02850886e-03] [-6.11572994e-03 -1.88286381e-03 -1.96861270e-03] [ 6.17283930e-03 1.85777463e-03 -1.93354278e-03] [ 6.11511545e-03 1.94514955e-03 -2.02888811e-03] [-6.13130704e-03 -1.95564390e-03 -2.03953197e-03] [-5.18001481e-05 4.05915658e-05 -1.14793243e-04] [-6.01678864e-05 -5.95880897e-05 -3.13073883e-03] [-1.44710653e-04 -1.32558626e-04 -3.11597619e-03] [-5.35629167e-05 4.23193724e-05 -1.60607902e-04] [-6.08452907e-03 -1.88230794e-03 -1.97416197e-03] [ 6.15743309e-03 1.79356459e-03 -1.86662453e-03] [-1.76654174e-03 -3.75801954e-03 -1.82153951e-03] [ 1.63519084e-03 3.85605811e-03 -1.67496883e-03] [-3.92511534e-05 -3.66496199e-05 -3.14003790e-03] [ 1.46483682e-04 -1.58719527e-04 -1.82031446e-04] [-1.99092869e-03 -3.77008730e-03 2.04606327e-03] [ 1.78575472e-03 3.79212959e-03 1.82376727e-03] [ 6.08679862e-03 1.93515634e-03 2.01595036e-03] [-6.11358774e-03 -1.97994285e-03 2.05861813e-03] [ 2.37032976e-05 -3.00637685e-05 1.20038485e-04] [-5.85586938e-05 -5.77041536e-05 3.11616845e-03] [-6.14201730e-03 -2.04685694e-03 2.14383420e-03] [ 6.16783767e-03 1.91559786e-03 2.00406347e-03] [ 1.77082923e-03 3.81445614e-03 1.81802254e-03] [-1.81594295e-03 -3.79606225e-03 1.86074368e-03] [ 6.12441308e-03 1.71714999e-03 -1.80900131e-03] [-6.11322717e-03 -1.86007984e-03 -1.94029110e-03] [-1.43657913e-04 1.41011866e-04 -1.11675676e-04] [ 8.35872772e-05 8.37235326e-05 -3.08022342e-03] [-1.82281166e-03 -3.81135915e-03 -1.87405810e-03] [ 1.64439346e-03 3.83687942e-03 -1.67951148e-03] [-4.25401636e-05 3.06418749e-05 6.87133031e-05] [-9.30581121e-05 -8.17519496e-05 3.07643982e-03] [ 9.35862453e-03 1.43650464e-02 -2.55081405e-02] [-4.68095888e-03 6.17349952e-02 5.73032719e-02] [-1.53602961e-02 -6.28090394e-02 -3.09452884e-02] [-1.51646780e-02 -2.96178056e-03 2.33566998e-03] [ 1.27925840e-03 5.14665171e-02 5.87133524e-02] [ 1.36903201e-03 2.36984885e-02 -2.35558332e-02] [-1.51527342e-02 -4.74344500e-02 -4.47327943e-02] [-1.56989186e-02 -1.73365775e-02 -1.09510644e-02] [ 4.32276676e-02 6.05291744e-04 4.61540044e-02] [-6.18373745e-02 -3.82968155e-02 1.28156328e-02] [-2.07433423e-02 -5.85934430e-02 2.96548784e-02] [ 3.60765911e-02 9.20625036e-03 4.58142345e-02] [-6.46493714e-02 -5.06724095e-02 2.31096594e-02] [-1.92291129e-02 -4.55696234e-02 3.97131491e-02] [ 1.76449905e-02 -1.75943095e-02 -3.46302542e-03] [-4.72296037e-02 6.68799168e-02 2.04952763e-02] [ 6.26796212e-03 -8.21846461e-03 -3.46275611e-03] [-4.17454207e-02 5.86891869e-02 2.34541327e-02] [ 1.09418008e-02 -7.46723268e-03 -1.53935024e-03] [ 8.28926387e-03 4.81132158e-03 -1.44003303e-02] [ 4.49322115e-03 4.57114638e-02 5.60943767e-02] [-6.36021149e-02 -2.14107501e-02 3.03739744e-02] [ 4.19427017e-04 5.74219125e-02 5.28059124e-02] [-6.61492180e-02 -3.47613986e-02 4.31697958e-02] [ 6.67325635e-03 9.30207590e-03 -1.96258139e-02] [-1.51466777e-02 -5.68015016e-02 5.29297103e-02] [ 2.70537844e-03 1.92732510e-02 -1.65179005e-02] [-1.89509052e-02 -6.99894987e-02 4.09666361e-02] [-2.81670486e-02 -4.32583823e-02 4.67090943e-03] [-2.58162275e-02 -2.89258609e-02 1.73322604e-02] [-3.44843948e-02 1.92325375e-02 8.96403982e-03] [-3.76435405e-02 2.95576481e-02 1.15958705e-02]] Final stress: [-5.94024799e-05 -1.03059996e-04 -6.21489479e-05 -3.70693866e-07 -3.04847035e-07 3.91285850e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 17 steps. Final forces: [[ 7.98851651e-03 -6.98375478e-02 6.16737067e-02] [ 5.97921519e-02 -1.33834032e-01 -7.38996699e-02] [-1.64591399e-02 -1.17818409e-02 4.55176940e-03] [-7.76377846e-02 -2.79820196e-02 -4.96829358e-02] [-1.98123126e-02 -1.04912358e-01 -1.24698942e-01] [-1.21838610e-01 -1.09198745e-01 1.28413251e-02] [-9.61409639e-02 3.25019728e-02 -1.28976565e-01] [ 2.35569905e-02 -1.13891461e-01 9.01041538e-02] [ 6.79975725e-02 -1.34004783e-01 -6.60793387e-02] [ 3.94298043e-02 2.29191757e-02 -1.65299661e-02] [ 3.10325621e-02 -1.09764136e-01 -7.84299396e-02] [ 4.19583968e-02 1.14982294e-02 -3.03490883e-02] [-1.28848551e-02 -3.52263820e-02 4.79923325e-02] [ 1.70095734e-02 7.82964487e-02 -6.12484069e-02] [ 4.76705294e-02 4.92722758e-02 -1.79041923e-03] [-6.29495740e-02 -7.11250322e-02 1.33880978e-01] [-6.06369901e-03 1.89088383e-03 -1.95532111e-03] [ 6.07700354e-03 -1.77055358e-03 -1.84363283e-03] [ 6.10442759e-03 -1.75729318e-03 -1.83434377e-03] [-6.11553010e-03 1.90270157e-03 -1.97304349e-03] [ 1.66925658e-03 -3.73867752e-03 -1.70302128e-03] [-1.76238456e-03 3.75129126e-03 -1.79567282e-03] [-1.79839680e-03 3.74160934e-03 -1.84895035e-03] [ 1.80759055e-03 -3.84205008e-03 -1.83767824e-03] [-6.25651686e-05 5.47600728e-05 -3.02178949e-03] [ 2.21441499e-04 2.27340095e-04 -1.45448667e-04] [ 1.33020533e-04 1.35737349e-04 -1.00589446e-04] [-1.22904730e-04 1.26319462e-04 -3.04744844e-03] [ 1.86269399e-03 -3.80258791e-03 1.89711934e-03] [-1.88015196e-03 3.75931569e-03 1.91439552e-03] [-1.90704149e-03 3.77880648e-03 1.94783022e-03] [ 1.85022395e-03 -3.77212027e-03 1.86725237e-03] [-6.05202786e-03 2.02008948e-03 2.10444880e-03] [ 6.06589257e-03 -1.66340462e-03 1.75516781e-03] [ 6.06517564e-03 -1.86794699e-03 1.94978703e-03] [-6.10268974e-03 1.97246605e-03 2.04289036e-03] [-3.08288841e-06 -1.25647321e-06 3.05527020e-03] [ 7.77517867e-05 8.25954405e-05 7.02728294e-05] [ 2.44251956e-04 2.53688445e-04 1.21534829e-04] [-5.88611487e-05 4.82114852e-05 3.04065821e-03] [-6.07678333e-03 1.94890658e-03 2.01899921e-03] [ 6.06272138e-03 -1.89664219e-03 1.97662482e-03] [ 1.80258724e-03 -3.79339029e-03 1.82521760e-03] [-1.72071217e-03 3.75757104e-03 1.76288335e-03] [ 7.81441478e-05 8.59239497e-05 8.78340546e-05] [-5.23800757e-05 4.71986675e-05 3.05254852e-03] [ 1.75803141e-03 -3.83504309e-03 -1.79192627e-03] [-1.69248640e-03 3.77068291e-03 -1.74263621e-03] [ 6.10077924e-03 -1.76642389e-03 -1.84108514e-03] [-6.16735607e-03 1.92032419e-03 -2.00114302e-03] [-3.82847071e-05 3.32767482e-05 -3.06433135e-03] [ 1.66111282e-04 1.70194033e-04 -1.12891121e-04] [-6.05794197e-03 2.07791734e-03 -2.14605969e-03] [ 6.06537706e-03 -1.81717345e-03 -1.89278411e-03] [-1.82248597e-03 3.74636711e-03 -1.85721992e-03] [ 1.77549277e-03 -3.79973052e-03 -1.80054826e-03] [ 6.12362577e-03 -1.87684720e-03 1.95443147e-03] [-6.08546731e-03 1.91131741e-03 1.98539446e-03] [-1.45106500e-05 2.78049636e-05 3.07966715e-03] [ 3.33907840e-05 4.24116826e-05 1.19123467e-04] [ 1.76695886e-03 -3.77783054e-03 1.80355066e-03] [-1.90787102e-03 3.75954177e-03 1.95486689e-03] [ 5.52572005e-05 -6.44502909e-05 -3.07723768e-03] [ 2.24834041e-05 3.69431249e-05 -1.61231713e-04] [-2.78832323e-03 2.84252238e-02 -3.66423019e-02] [-2.95948238e-02 7.19912423e-02 3.15542577e-02] [ 5.17358499e-03 4.63437311e-04 -2.07587779e-03] [ 4.02034028e-02 1.79578226e-02 2.54703319e-02] [-2.82441650e-02 6.13004529e-02 4.13625248e-02] [-4.67615624e-03 4.16672714e-02 -2.43682770e-02] [ 1.19405189e-02 8.72729337e-03 -4.81177496e-03] [ 3.46162004e-02 8.61918876e-03 2.42715003e-02] [ 1.20502011e-02 4.54189336e-02 6.69508553e-02] [ 6.07917295e-02 5.87161513e-02 -9.11659858e-03] [ 4.26914806e-02 -2.10986851e-02 6.15478119e-02] [ 8.20465621e-03 5.83967485e-02 5.65174849e-02] [ 5.76150326e-02 4.90047839e-02 -6.24367537e-03] [ 4.77681174e-02 -1.12020320e-02 6.51372561e-02] [-9.39489949e-03 5.02205184e-02 -5.05373513e-02] [-3.27068296e-02 7.49744006e-02 2.61050213e-02] [-2.21567359e-02 -1.62454722e-02 9.06474932e-03] [-3.30218372e-02 5.92118546e-02 3.98601010e-02] [-1.04957450e-02 6.22397658e-02 -3.78366549e-02] [-1.70108353e-02 -6.56508779e-03 6.72706025e-03] [-1.26627670e-02 4.92556150e-02 4.47243722e-02] [-1.80313338e-02 -6.24876807e-04 1.27371507e-02] [-1.62490893e-02 6.08175757e-02 3.31644252e-02] [-2.17478039e-02 -1.08293866e-02 1.48778451e-02] [ 7.08155248e-03 1.22411535e-02 -2.84203613e-02] [-6.42387604e-03 -3.31380150e-02 3.22190923e-02] [ 5.76131528e-03 2.50822475e-02 -1.73216494e-02] [-1.18327068e-02 -4.36149944e-02 2.92590753e-02] [-2.66604227e-02 -2.86169219e-02 1.25723576e-03] [-2.18447919e-02 -1.96481311e-02 2.48877986e-03] [ 3.21380685e-02 2.86784207e-02 -7.04623347e-02] [ 3.03703481e-02 4.30049602e-02 -5.76108030e-02]] Final stress: [-6.07911466e-05 -1.00816538e-04 -6.21126600e-05 -4.67691138e-07 -9.27461409e-07 -3.59672408e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 37 steps. Final forces: [[ 5.18206538e-02 8.23333218e-02 -1.31879031e-01] [ 9.85122615e-02 -1.28208736e-01 -2.61574019e-02] [-1.25281102e-01 -1.04363605e-01 1.82466872e-02] [ 4.02122308e-02 -8.52613315e-02 1.34223385e-01] [-1.22570533e-02 -1.10097997e-01 -1.20796139e-01] [ 7.79388438e-02 -5.18278643e-02 -1.34570261e-01] [ 6.51666749e-02 -6.47270250e-02 1.35369484e-01] [ 3.92875887e-02 -1.28884062e-01 9.34275159e-02] [ 9.22183131e-02 -1.29892260e-01 -3.81600550e-02] [-1.31920094e-01 -8.27731450e-02 5.14239325e-02] [-5.13930834e-02 -8.15007107e-02 -1.32706317e-01] [ 1.22621722e-01 1.07033683e-01 -1.95939839e-02] [-1.08521731e-01 1.22042139e-01 -1.20927444e-02] [ 1.08610254e-01 -7.88133552e-03 1.22344784e-01] [ 9.55925788e-02 1.29229315e-01 -3.11515507e-02] [-3.94895877e-02 -9.05259198e-02 1.30948093e-01] [-3.23488206e-03 -3.27654623e-04 4.82852909e-04] [ 2.23774963e-03 -5.80276115e-04 -5.95750439e-04] [ 2.37296141e-03 -3.60075591e-05 -4.35353927e-04] [-3.31527881e-03 2.52277474e-03 -2.15123954e-03] [-6.26770781e-04 -2.14544095e-03 3.30713334e-04] [-9.54061003e-04 3.40127701e-03 -9.57118481e-04] [ 1.28166764e-05 3.56713712e-03 7.28795826e-05] [ 1.25930156e-03 -2.20402512e-03 -1.56846997e-03] [-1.95055880e-04 -1.97789190e-06 -2.99512488e-03] [ 1.92080735e-03 1.90865404e-03 2.54950982e-03] [ 6.28011352e-04 4.71283117e-04 4.96413953e-03] [-1.58095387e-04 -6.53582587e-05 -2.61104933e-03] [ 8.99174395e-04 -4.13644529e-03 1.06022256e-03] [-1.66702397e-03 2.47792255e-03 1.66244867e-03] [-4.10099517e-04 3.79722771e-03 3.67799227e-04] [-1.07988759e-03 -1.80356280e-03 -9.35446450e-04] [-4.17610118e-03 -2.00205264e-03 -2.06840375e-03] [ 2.72052392e-03 3.85932300e-04 2.08740027e-05] [ 2.94082293e-03 -1.06958034e-03 1.17789738e-03] [-2.78761530e-03 -1.70922168e-03 -1.98310284e-03] [-2.62394681e-04 -5.91304018e-05 3.37032993e-03] [-6.61352157e-04 -5.12592310e-04 -2.54110478e-03] [-7.97087020e-04 -5.15911026e-04 -2.28311822e-03] [ 8.16204571e-04 -9.33016639e-04 2.53624832e-03] [-3.10222530e-03 -1.45341458e-03 -1.65957567e-03] [ 1.11822498e-03 2.03507154e-03 -1.92251025e-03] [-1.70457482e-03 -2.18692533e-03 -1.80820305e-03] [ 7.54925410e-06 3.91461958e-03 -8.80788577e-05] [ 2.36836235e-03 2.37869893e-03 -2.73601566e-03] [-8.83989171e-04 9.36471423e-04 3.05880134e-03] [-2.93963544e-03 -2.16115207e-03 2.76292495e-03] [ 6.15003178e-04 2.32337652e-03 5.52003753e-04] [ 3.50659442e-03 -3.69567903e-03 -3.52354164e-03] [-3.42891614e-03 8.82046267e-04 -8.12296681e-04] [ 7.22332490e-04 -5.86276059e-04 -1.83070127e-03] [-1.23441566e-03 -8.65178787e-04 2.29476252e-03] [-2.96206025e-03 -1.25105443e-03 1.56848253e-03] [ 2.09109853e-03 -1.80565279e-03 -1.82600356e-03] [-9.06190387e-04 3.31458636e-03 -6.87967181e-04] [ 3.00122861e-03 -2.77838563e-03 -2.85891980e-03] [ 3.43868589e-03 4.72408145e-04 -1.86533907e-04] [-2.86188547e-03 -9.52757252e-04 -6.68976841e-04] [-5.13465779e-04 6.03341104e-04 3.26063724e-03] [-1.36868586e-03 -1.35647795e-03 -2.29423380e-03] [ 6.39119921e-04 -2.22862018e-03 6.47675786e-04] [ 2.74925496e-03 3.48213789e-03 -3.25964274e-03] [-1.20115375e-03 1.18807913e-03 -3.48638776e-03] [-1.75778931e-03 -1.50389745e-03 3.48675150e-03] [-1.19560283e-02 -6.77145910e-02 4.99164863e-02] [ 3.97048261e-03 8.70308128e-02 -1.41435275e-02] [ 5.51717547e-02 5.53699702e-02 -1.02364306e-02] [ 7.95856162e-03 5.90594804e-02 -6.59250397e-02] [-7.39473823e-02 3.96883183e-02 4.03285502e-02] [-2.59300377e-02 -3.10282334e-02 3.49083691e-02] [ 7.69378035e-02 8.93904296e-02 5.59018882e-03] [ 1.63952544e-03 -1.03053472e-02 -7.21688997e-02] [ 4.40858992e-02 7.14762269e-02 5.33872008e-02] [-2.25056964e-02 2.69575878e-02 6.36719422e-02] [-6.16524094e-02 -2.16169990e-02 -5.12016127e-02] [-2.83965094e-03 6.31865261e-02 7.86578385e-02] [-4.99757955e-02 1.80343278e-02 7.57711910e-02] [-5.15815078e-02 -1.97589149e-02 -8.64447111e-02] [-2.99157710e-02 3.08115529e-02 -6.48309858e-02] [-5.74347185e-02 8.92082733e-02 2.68410017e-02] [ 6.32397596e-02 8.49499107e-03 -1.40435957e-02] [-6.45261286e-02 5.08694013e-02 1.30674668e-02] [-1.59761771e-02 7.38758113e-02 -5.14712405e-02] [ 5.02160090e-02 8.56794917e-02 -1.49543497e-02] [ 5.42365287e-02 3.18197958e-03 3.71776362e-02] [-6.84382109e-02 -3.06204420e-02 3.68322006e-02] [-5.46099416e-03 6.13085122e-02 7.43760492e-02] [-5.37633356e-02 -4.60452008e-02 1.79101457e-02] [ 2.36833816e-02 -3.12296296e-02 4.54532978e-02] [-3.28225615e-02 2.04607773e-02 -5.50565515e-02] [ 4.46128267e-03 -6.80874991e-02 -4.94243354e-04] [-2.34609277e-02 -1.44704382e-02 -4.98300434e-02] [-4.06636208e-02 -5.51034871e-02 1.58338979e-03] [-2.61930878e-02 -2.52133945e-02 1.45139854e-02] [ 1.08602706e-02 1.00968112e-02 -8.49214925e-02] [ 8.58917632e-03 1.03183108e-01 -5.85936980e-02]] Final stress: [ 1.02062261e-04 -6.30039469e-05 1.02016581e-04 -1.93977470e-07 -3.27269534e-08 2.57573603e-08] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[ 9.71279854e-03 3.45564269e-02 2.44227436e-03] [ 2.52071945e-02 -3.00327398e-02 7.42277597e-02] [-1.22421695e-02 2.04865651e-02 -1.24358948e-02] [-7.48078518e-02 -2.33048739e-02 3.23643374e-02] [-3.71739197e-03 -1.79603463e-03 -3.15929745e-02] [-1.52392876e-02 -2.61975933e-02 5.64382258e-02] [-7.43096988e-02 -4.03594282e-02 1.54792928e-02] [ 2.56885240e-02 -5.92379926e-03 -1.00812518e-02] [-3.41005694e-02 -5.14942663e-02 1.63610472e-02] [-1.47098699e-02 1.04360473e-02 -8.99787130e-02] [ 6.09575784e-02 6.74200524e-02 -3.53224005e-02] [-1.83517443e-02 -3.75255173e-02 5.96490478e-02] [ 8.84846933e-02 1.01262316e-01 1.91014513e-01] [ 4.06091554e-02 -1.43543791e-02 -2.25449619e-02] [ 1.21347336e-03 -1.38659335e-02 4.62018939e-02] [ 7.18143653e-02 3.30605220e-02 1.58961613e-02] [-6.04138476e-02 -6.06491065e-02 5.09062071e-02] [ 1.07330961e-01 1.62724579e-02 2.06314967e-02] [-6.48128398e-02 -6.14003533e-03 -1.07083275e-02] [-1.12492533e-01 6.57465579e-02 4.64121644e-02] [ 1.75226531e-02 -1.84606978e-03 7.45275598e-02] [-2.07865481e-02 9.82102841e-02 4.67566795e-03] [ 1.39496785e-01 6.75306081e-02 -2.89781045e-03] [ 2.95547002e-02 -2.91291427e-02 -1.65489499e-02] [-9.57222468e-02 8.03808505e-02 -1.09870000e-02] [ 1.79500186e-02 4.96238897e-03 1.45102225e-02] [ 1.33332973e-01 -7.27746170e-02 1.36668234e-02] [-8.95083990e-02 8.22933041e-03 4.55629076e-02] [-4.19514493e-02 5.26505816e-02 -4.95932730e-02] [-5.81872202e-02 -4.53904662e-02 6.76094304e-02] [-7.47416504e-02 8.64934294e-03 2.34659617e-02] [ 1.40745181e-03 1.18660633e-02 7.68887074e-02] [-5.81500630e-04 4.86674022e-02 2.25142775e-02] [-9.44776986e-02 1.26964616e-02 8.66666506e-02] [ 1.30758135e-02 4.27935465e-02 5.63565651e-02] [ 4.24761108e-02 7.71868326e-02 1.98621890e-02] [-8.11696522e-02 8.35321602e-03 2.46094831e-02] [ 5.14287771e-02 5.30974866e-02 3.79072308e-04] [ 1.62147365e-01 1.43016396e-01 -1.40329688e-02] [-3.41534783e-02 -5.28517937e-03 -1.12304150e-01] [-4.36880562e-03 -4.24510959e-02 -3.69314207e-02] [ 7.13671230e-02 -4.15146416e-02 -2.59828220e-02] [ 1.50811918e-02 -4.02136416e-02 -4.91544624e-02] [ 2.12913605e-02 1.39242698e-02 -4.82558986e-03] [ 5.90427816e-02 -3.54438145e-02 -3.42157589e-02] [-5.18997903e-02 1.54814115e-02 9.87407279e-03] [-6.56542038e-02 -1.02859313e-01 6.32777621e-02] [-1.24160827e-01 -1.87116847e-02 -4.25415343e-03] [ 6.66008801e-02 -1.41230568e-02 9.95298041e-03] [-4.53433151e-02 -8.04096194e-03 5.66392072e-02] [-2.51983340e-02 -1.87346925e-02 -6.02862481e-02] [ 5.34391393e-02 3.82193641e-02 7.74277655e-02] [-4.89486864e-02 -3.42601355e-02 1.91854790e-02] [-3.65288613e-02 1.96527128e-02 -1.70087250e-02] [-7.22086193e-02 -1.61433294e-02 -4.50409032e-02] [ 1.01279919e-01 -3.24597148e-02 -7.18992680e-02] [-2.37749641e-02 -7.55252881e-03 -3.57644811e-02] [-6.43383434e-03 4.80239939e-02 6.45260880e-02] [ 7.19446816e-02 -2.26482702e-02 -2.06894145e-02] [ 2.64267482e-02 1.29262218e-02 9.40920513e-02] [-1.38192897e-02 -2.42944369e-02 -1.31614050e-02] [ 6.98359402e-03 8.72109896e-03 7.77966139e-03] [-2.40402362e-02 2.48080124e-02 -1.70367754e-02] [ 8.68675671e-02 4.46534057e-02 -5.01735254e-05] [ 6.84174666e-02 1.17907107e-01 9.27193425e-02] [-8.09849378e-02 1.96709306e-02 -1.85676359e-01] [ 2.10139382e-01 7.14039646e-02 -2.13788908e-02] [ 1.51500731e-01 -8.84216748e-03 -2.80693896e-01] [-7.91521428e-02 5.76130571e-02 -2.48774994e-01] [ 8.98451281e-02 -2.47287271e-01 1.72436289e-01] [ 9.71949998e-02 1.76235035e-01 -1.18471549e-01] [ 6.86033764e-02 -8.72260850e-02 6.93395590e-02] [ 1.55379452e-01 2.32064276e-01 2.16654805e-02] [-6.37263063e-02 -4.21092664e-01 1.50438240e-01] [-3.36659033e-01 -1.50425831e-01 2.54949121e-02] [ 1.54285485e-01 6.81155197e-02 1.46347268e-01] [ 1.60579598e-01 -9.12339411e-02 2.05154476e-01] [ 1.84550317e-01 -1.08193388e-01 -6.17265624e-02] [-2.90531094e-01 -1.13264026e-01 -1.10965225e-01] [-2.67462469e-01 -1.72015867e-01 1.52431550e-01] [-2.44021228e-01 1.60922379e-01 -5.38580747e-03] [ 2.57078683e-01 1.71880398e-01 -2.90451802e-01] [ 2.05780938e-01 -1.06939914e-01 -9.11066933e-02] [ 1.72961654e-01 3.66924176e-02 2.00330952e-01] [ 2.10305181e-01 -9.10570188e-02 -1.04346450e-01] [ 6.09512769e-03 -1.74441251e-01 -1.33899626e-01] [-8.45080407e-02 -1.60124063e-01 4.16205131e-02] [-2.02715609e-01 8.16487819e-02 -5.93689561e-02] [ 1.78322142e-01 -1.44978931e-01 -9.14122917e-02] [-4.83747743e-02 4.73447053e-02 -2.29811304e-01] [-4.10856817e-01 -3.90251668e-01 -3.72542231e-01] [-2.35154902e-01 2.41709854e-01 2.70053060e-01] [-6.58886891e-01 1.00826607e+00 7.02427423e-01] [ 7.91790209e-01 -5.75725678e-01 -8.30101816e-01] [-9.08141265e-02 4.00785688e-02 6.34923449e-03] [-6.98604579e-02 1.43124974e-01 2.72561423e-01]] Final stress: [ 1.18967743e-02 1.20041332e-02 1.22495904e-02 1.96832715e-04 3.84996535e-06 -8.54906874e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 64 steps. Final forces: [[ 4.85955691e-02 7.83606091e-02 -1.35180082e-01] [-1.79841162e-02 -1.04388776e-01 -1.24362838e-01] [ 1.49214686e-02 -1.01899282e-01 -1.26940763e-01] [-5.59883874e-02 -1.43802191e-01 5.70261577e-02] [-1.02291545e-01 -3.66811921e-02 -1.21642782e-01] [ 4.77783180e-02 -8.60419120e-02 -1.31122971e-01] [-6.57628974e-02 5.52950162e-02 -1.38649055e-01] [ 9.89137277e-02 -1.30643864e-01 1.17603640e-02] [ 1.12460138e-01 -1.18338632e-01 -3.05608638e-03] [-1.29936135e-01 -9.78157909e-02 1.83452327e-02] [-9.68218836e-02 -1.34743888e-02 -1.31567103e-01] [ 1.21134472e-01 3.00867094e-02 -1.05795346e-01] [ 3.09527757e-02 9.44254970e-02 -1.29800092e-01] [-1.15596675e-01 -1.94165072e-02 -1.14194162e-01] [ 1.24661780e-01 1.03843396e-01 2.17171105e-02] [ 9.53208429e-02 -1.26778814e-01 4.09833198e-02] [-4.90401331e-03 -1.75445978e-03 1.35291912e-03] [-2.77696120e-04 3.11782200e-03 3.36734798e-03] [ 1.71540424e-03 -1.79362760e-03 -1.67699581e-03] [ 3.57602101e-03 2.61355108e-04 -2.43526454e-05] [-6.86135327e-03 -3.78955313e-03 6.52312486e-03] [-7.21777851e-04 -4.33357068e-04 -1.49022924e-03] [ 1.92401621e-03 -8.92303992e-04 2.19299778e-03] [-2.90073566e-04 1.10632731e-03 1.20307000e-03] [-3.54464857e-03 3.17443990e-03 -3.40987263e-03] [-1.99837885e-03 -1.24372319e-03 2.72639188e-03] [ 4.96971414e-04 -5.75116491e-04 1.86628368e-03] [-2.47309683e-03 -7.85973960e-03 8.69938711e-03] [ 6.47239594e-03 -2.95669917e-03 6.00750252e-03] [-5.88985714e-03 3.46237309e-03 5.72484970e-03] [ 6.33504467e-03 -3.18571236e-03 -5.39555660e-03] [-4.36621196e-04 5.48205413e-03 6.72213473e-03] [ 2.02158541e-03 1.34133059e-02 1.39064543e-02] [ 1.10822340e-03 3.36343492e-03 -3.19877821e-03] [ 1.14488581e-03 -1.02793561e-02 1.09436204e-02] [-3.66811405e-03 5.76693355e-03 6.46215245e-03] [-4.66377774e-03 4.45571347e-03 -4.04629305e-03] [ 1.26255839e-02 1.25043218e-02 2.95394127e-03] [ 2.16355582e-03 2.71902148e-03 -1.28956081e-03] [ 5.89214809e-03 -5.22703059e-03 -2.87804531e-03] [-1.45068228e-03 4.82322973e-03 4.48384763e-03] [ 2.64797822e-03 -7.78704280e-03 7.24928676e-03] [ 4.94510439e-03 -2.87856309e-03 5.94061575e-03] [-1.71256692e-03 2.59122518e-04 1.47523067e-03] [ 5.73329340e-04 8.74346454e-05 -4.86597606e-03] [-3.69227709e-04 -7.78185285e-05 2.04306993e-03] [ 1.06131697e-03 6.27831502e-03 -1.08576833e-02] [ 3.25293315e-03 6.16203171e-03 3.94201908e-03] [ 6.90293877e-03 7.74881528e-03 7.73934890e-03] [-3.94841621e-03 -6.56688996e-03 7.77454253e-03] [-8.71377891e-03 9.80006918e-03 -3.91091410e-03] [ 6.90119915e-03 7.05626930e-03 1.80627742e-03] [-3.20578860e-03 3.58412785e-03 -3.30023640e-03] [ 3.51184065e-03 9.42704642e-03 9.73619904e-03] [ 4.33996201e-03 -4.34981782e-04 4.54835281e-03] [-6.81707946e-03 -2.47953105e-03 7.93225833e-03] [-1.91404727e-03 4.48117095e-03 -3.77785025e-03] [-1.10631597e-03 9.40002682e-05 -4.53846299e-04] [-4.57723775e-03 -2.33262561e-03 -6.69026819e-03] [-4.08330080e-03 -3.65794342e-03 -2.59069060e-03] [ 7.13590372e-03 5.03236906e-03 6.78002958e-03] [-1.37406340e-02 -2.01938183e-03 1.42564861e-02] [ 7.37389737e-03 -7.04914594e-03 1.76182897e-04] [ 2.39124708e-03 2.69008466e-03 -2.05913934e-03] [-4.43914136e-02 -2.30075284e-02 8.58956654e-03] [-3.26780247e-02 -1.27032064e-01 8.48229469e-02] [-9.62687490e-02 1.30740092e-02 7.52988012e-02] [-1.67537777e-02 6.88564187e-02 -9.17122653e-03] [ 4.40706756e-02 1.00403432e-01 -3.60725682e-02] [ 5.33874747e-03 2.52822368e-02 1.89033901e-01] [ 7.06570195e-02 -2.29089556e-02 1.29050100e-01] [-1.46147832e-02 1.51952732e-01 1.58358485e-01] [-1.33847981e-03 -1.31719025e-01 3.49145048e-02] [-9.14300885e-02 7.87595586e-03 6.17258644e-02] [ 9.92268224e-02 -3.70333601e-02 -6.72715263e-02] [ 1.43484105e-01 1.07189845e-01 -1.14797833e-01] [-3.17266160e-02 4.02175979e-02 1.99172027e-02] [-1.82002447e-01 1.29801431e-01 1.46858553e-01] [-1.67695971e-03 1.16447463e-01 9.56804414e-02] [-1.02609882e-02 4.41833880e-02 -2.08524204e-02] [ 2.13841288e-01 -7.80604985e-02 6.24142020e-02] [ 5.48482785e-03 -4.41615336e-03 3.88823163e-02] [ 9.90494854e-03 7.21043354e-02 4.40607352e-02] [-3.15842880e-04 1.28370913e-01 -6.88992365e-02] [-3.14814577e-03 6.80368833e-02 1.05837754e-01] [ 4.71225763e-02 -8.23202780e-02 -6.80265689e-02] [-8.84613714e-02 -1.40548706e-02 1.50925356e-01] [ 5.89889777e-02 -7.19065501e-02 -4.01942002e-02] [ 9.61595439e-02 4.53220018e-02 7.89433895e-02] [ 1.40505574e-02 -8.56971315e-02 7.03555994e-02] [ 8.51327798e-02 -6.98668858e-02 -4.88759516e-02] [-1.39456901e-01 8.74824504e-02 2.72412051e-02] [-7.92729869e-02 -6.90724811e-02 2.19178180e-02] [-5.35553017e-02 4.70116074e-02 -1.07354674e-01] [-1.65033719e-02 7.02468840e-02 1.99856630e-02] [-1.09109074e-01 5.94297323e-02 -3.54387399e-02]] Final stress: [ 3.32926894e-05 9.28277260e-05 9.20746936e-05 4.11150713e-05 -1.07925480e-06 6.30160660e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 33 steps. Final forces: [[ 1.09926080e-02 -9.82085096e-02 8.73147621e-02] [-4.24003965e-02 8.32561466e-02 4.08259516e-02] [-6.63514221e-02 -8.60868717e-02 -2.01960099e-02] [-4.20915406e-02 7.73927624e-02 -1.18727804e-01] [ 1.53726476e-02 1.05076107e-01 1.20455257e-01] [-4.57282851e-02 -1.01380514e-01 -5.59975902e-02] [-9.99149748e-02 -1.27395495e-01 2.69571844e-02] [-1.68725224e-02 3.40493400e-02 -1.76588605e-02] [-8.30870995e-02 8.76624753e-02 4.73569238e-03] [ 4.55606933e-02 -1.21769854e-02 -5.63969446e-02] [ 5.85288878e-02 -4.90674609e-02 9.59186064e-03] [ 5.87289248e-02 2.83521737e-02 -3.09221610e-02] [-1.24662321e-02 9.71136135e-03 2.23172488e-03] [ 1.09785243e-01 1.21397179e-01 -1.22199049e-02] [-1.11108307e-02 2.43414876e-02 -3.45744150e-02] [-7.26245040e-02 -6.09982727e-02 1.33955421e-01] [-6.09757119e-03 9.06906962e-06 -1.46647919e-05] [ 5.83075493e-03 4.60925861e-05 4.59874669e-05] [ 6.26954003e-03 1.76911704e-04 1.74711246e-04] [-6.02495499e-03 -7.70054704e-05 7.13952542e-05] [-6.43562132e-05 -4.12907596e-03 6.53468185e-05] [ 8.33565390e-05 3.92586297e-03 9.61549681e-05] [ 2.19218747e-04 3.82294158e-03 2.28048733e-04] [ 1.29660659e-06 -4.16299692e-03 2.74675573e-06] [-1.14010260e-04 1.02579340e-04 -5.25620868e-03] [ 1.89307985e-04 1.74585362e-04 5.31774511e-03] [-9.87296441e-06 -5.56626802e-06 5.13447376e-03] [ 1.42275899e-04 -1.45052572e-04 -5.11857278e-03] [ 1.95358506e-04 -3.93913517e-03 2.05874627e-04] [-1.02381513e-04 4.06388354e-03 1.20824144e-04] [-1.34841406e-05 3.89482603e-03 -2.95870340e-06] [ 2.15601746e-04 -3.84668821e-03 2.13288232e-04] [-6.10301647e-03 1.76357363e-05 5.72088195e-06] [ 6.01252932e-03 -1.92999915e-04 2.05424093e-04] [ 6.32310514e-03 2.87459963e-04 -2.82510943e-04] [-5.98975469e-03 -1.37670443e-04 -1.41476543e-04] [ 2.12507623e-04 -2.08624149e-04 5.17512228e-03] [-1.49479603e-04 -1.45296933e-04 -5.18745434e-03] [ 6.04529935e-05 6.08310647e-05 -5.24460866e-03] [-3.90793091e-04 3.89356755e-04 5.48152679e-03] [-6.12540145e-03 -8.85959289e-05 -9.23218679e-05] [ 5.96444007e-03 -1.42539961e-04 1.39427653e-04] [ 5.58418040e-05 -3.80959536e-03 4.96919284e-05] [ 1.02888851e-04 3.99956546e-03 -9.34753626e-05] [ 7.46963680e-05 8.04246364e-05 -5.26461234e-03] [ 1.40534893e-04 -1.35044316e-04 5.13835366e-03] [ 1.69385596e-04 -3.85767974e-03 -1.82144253e-04] [-1.25277356e-04 3.98885428e-03 -1.39205942e-04] [ 5.92828898e-03 -6.46120748e-05 -5.53067648e-05] [-6.17300368e-03 3.04632964e-04 -3.12307691e-04] [ 1.74592088e-04 -1.84033584e-04 -5.10429058e-03] [ 1.91361380e-04 1.98707520e-04 5.11373527e-03] [-6.00988471e-03 2.36233045e-05 -2.21921401e-05] [ 6.19347265e-03 -1.17793587e-04 -1.20741123e-04] [-2.12751148e-04 4.12770603e-03 -2.18404867e-04] [ 1.01068239e-04 -3.88850536e-03 -1.05581316e-04] [ 5.97104030e-03 -1.09307629e-04 1.07403510e-04] [-6.16398568e-03 1.54528000e-04 1.66341134e-04] [ 2.93834843e-04 -2.89647958e-04 5.21677659e-03] [ 8.41433713e-05 7.37084912e-05 -5.36705313e-03] [-2.45900678e-04 -4.26271021e-03 -2.46195352e-04] [ 1.53910627e-04 3.98842856e-03 -1.58815056e-04] [-3.20808596e-04 3.26354435e-04 -5.29576581e-03] [-1.20480095e-04 -1.29267013e-04 5.29147970e-03] [ 2.08718544e-03 5.67872786e-02 -4.39485630e-02] [ 1.59182205e-02 -4.91460018e-02 -2.38613023e-02] [ 3.02577774e-02 4.83817651e-02 1.34883507e-02] [ 2.79663228e-02 -4.56287681e-02 5.86808382e-02] [ 2.44194450e-02 -3.29897100e-02 -2.05422883e-02] [-1.16030838e-02 3.36823417e-02 -3.99875355e-02] [ 3.85239651e-02 3.63327054e-02 2.31480118e-03] [ 1.76834570e-02 -3.06338984e-02 5.31596937e-02] [-4.36335508e-03 -4.25323351e-02 -5.57995454e-02] [ 2.53047883e-02 4.20437481e-02 2.70569997e-02] [ 3.91896322e-02 7.23350951e-02 -1.43889372e-02] [-1.34441993e-02 -5.83132045e-02 -6.09700044e-02] [ 1.87734732e-02 5.44302294e-02 3.34638956e-02] [ 5.42656586e-02 5.36989045e-02 -1.37049218e-02] [ 1.13685445e-02 -1.12940716e-02 5.43121444e-03] [ 3.31087246e-02 -4.89426898e-02 -4.69833553e-03] [-3.18339049e-02 1.88264104e-02 2.51326416e-02] [ 4.67649642e-02 -3.13032614e-02 4.66046705e-03] [ 6.27114971e-03 -2.14132114e-02 1.36195112e-02] [-1.72326363e-02 -4.54031985e-03 2.61651017e-02] [-1.71973499e-02 3.30549376e-02 -2.45323521e-03] [-2.52045714e-02 -2.50075650e-02 8.62042261e-03] [-3.22285387e-02 1.32224558e-02 -6.20940669e-03] [-3.19261801e-02 -8.00011281e-03 2.02438957e-02] [ 1.01469543e-02 5.88722684e-03 -2.67913371e-03] [-4.90975094e-02 -6.66914229e-02 6.36608231e-03] [ 1.24616501e-03 -1.30037447e-02 3.52134211e-03] [-5.87441584e-02 -4.69337786e-02 1.63051350e-03] [ 2.04111175e-03 -7.16304316e-03 1.35127998e-02] [ 9.42713055e-03 -2.08205822e-02 2.29532650e-02] [ 4.17028121e-02 3.88856641e-02 -6.88988561e-02] [ 2.92891711e-02 2.06949113e-02 -6.09946665e-02]] Final stress: [-2.47700629e-05 2.88730480e-05 -9.62086302e-05 7.11832282e-07 -2.66311255e-06 1.69362734e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 26 steps. Final forces: [[ 2.42298783e-02 -1.23681802e-01 1.05118175e-01] [ 1.16067500e-01 -2.84527060e-03 1.15994707e-01] [ 1.30948708e-01 8.29743632e-02 -5.40076204e-02] [ 1.23027006e-01 1.03293986e-01 3.43080196e-02] [-5.83285760e-02 -8.45552792e-02 -1.27953838e-01] [-1.39490496e-01 -7.49116236e-02 4.41098827e-02] [ 1.03118407e-01 -2.70924921e-02 1.24520943e-01] [ 3.61649438e-02 9.46433260e-02 -1.28874705e-01] [-5.17252171e-02 6.39744744e-02 1.65300566e-02] [ 1.34456411e-01 4.75611722e-02 -8.11610041e-02] [-1.22453403e-01 1.05301899e-01 -2.98784471e-02] [-1.10752080e-02 -1.37270504e-01 -9.14055342e-02] [ 9.89518966e-02 4.78961446e-02 -1.22437182e-01] [-1.35485336e-01 -5.05770482e-02 -7.76667182e-02] [-8.58403699e-02 -1.35255707e-01 3.63284523e-02] [-1.22617360e-01 3.27026880e-02 1.04342257e-01] [-4.11451627e-03 6.07867778e-03 -5.85087040e-03] [ 4.72446571e-03 1.70593185e-03 1.69988728e-03] [ 7.43968273e-03 -3.11953250e-03 -3.45199469e-03] [-4.19054477e-03 2.58811653e-04 1.93394182e-04] [ 3.00334110e-03 -5.19475420e-03 -2.67344315e-03] [-3.73249122e-03 5.29693848e-03 -3.48656807e-03] [ 4.50817604e-03 5.85484144e-03 4.52427367e-03] [-3.85422312e-03 -2.95288730e-03 3.92075930e-03] [-3.21017709e-03 3.27645551e-03 -8.78682673e-04] [-6.82132379e-03 -6.90894784e-03 3.29266258e-03] [-3.30984734e-03 -3.20697922e-03 5.70365815e-03] [ 2.60507377e-03 -2.51998871e-03 -5.81533717e-03] [-9.97286275e-03 -5.74800152e-03 -9.87157471e-03] [-3.03141859e-03 2.79615615e-03 3.04505266e-03] [ 4.22345659e-03 3.16011950e-03 -4.05265477e-03] [ 2.34978399e-03 -2.30130336e-03 2.21900883e-03] [-2.23310800e-03 -2.83666038e-03 -2.49342751e-03] [ 4.17400523e-03 -2.78703180e-03 2.92676946e-03] [ 5.51658584e-03 -2.28747949e-04 2.97226966e-05] [-5.43532269e-03 -8.68471164e-04 -5.59100986e-04] [-8.22529426e-03 8.48525801e-03 6.27158212e-03] [ 3.63180295e-03 3.74598869e-03 2.79600273e-04] [-1.15048231e-03 -9.66619287e-04 -3.55394365e-03] [-3.82190138e-03 3.78842491e-03 1.86294822e-03] [-5.59744619e-03 -2.71578319e-03 -2.90749236e-03] [ 8.95610839e-03 5.99414014e-03 -5.76911017e-03] [ 9.37632684e-04 -3.96191121e-03 1.30906938e-03] [ 1.05199552e-03 5.74877960e-03 -1.18659328e-03] [-4.97362071e-03 -5.35419350e-03 -9.99828051e-04] [ 1.82863893e-03 -2.00126562e-03 3.00722461e-03] [ 6.10772771e-04 -5.34199962e-03 -8.21010281e-04] [-2.80925224e-03 7.02910308e-03 -3.03490876e-03] [ 5.05286708e-03 -5.34296404e-03 -5.21409324e-03] [-3.35206466e-03 -4.36044452e-03 4.50164440e-03] [ 1.47119908e-03 -1.37416884e-03 -1.49028169e-03] [ 1.53018978e-03 1.64211868e-03 3.93565936e-03] [-7.00497324e-03 -1.50505209e-03 1.45377607e-03] [ 5.97542503e-03 -2.78737579e-03 -2.49051470e-03] [-5.65629691e-03 3.60509770e-03 -5.49178209e-03] [ 1.65419538e-03 -2.40176647e-03 -1.34537677e-03] [ 2.35334525e-03 2.45960722e-03 -2.20502544e-03] [-3.45907815e-03 3.41522545e-03 3.34315232e-03] [ 4.71427532e-03 -4.57059930e-03 2.73613401e-03] [ 2.50266460e-04 2.76606964e-05 -3.80058821e-03] [-2.69387466e-04 -4.92887754e-03 -3.97538056e-04] [-1.59485193e-03 4.04139049e-03 1.99053176e-03] [-3.15901666e-04 6.19452969e-04 -4.25895115e-03] [ 3.31515175e-04 1.87177256e-04 6.12954182e-03] [ 3.78750486e-02 5.84151643e-02 -3.92782773e-02] [-1.09993261e-02 -2.38511312e-02 -2.00343173e-04] [-1.09814556e-01 -3.20601601e-02 9.05199460e-02] [-2.81654017e-02 -4.58292783e-02 -7.24600075e-02] [-8.38595079e-02 1.53073012e-02 -1.20173846e-01] [-5.16738568e-02 4.52712183e-03 -7.36363550e-02] [-1.24541899e-02 -1.42326652e-02 3.36182460e-02] [ 5.90660295e-05 -9.80356091e-02 3.85570597e-03] [ 2.27140046e-02 2.93186301e-02 7.31787386e-02] [ 8.23505291e-02 -9.98864387e-03 4.19081069e-02] [-2.22652723e-02 6.57226036e-02 -5.57006667e-02] [ 5.21988238e-02 8.18036470e-02 -2.41425181e-02] [ 9.12142547e-02 5.03700010e-03 1.33994957e-02] [-3.22475546e-03 3.20672653e-02 2.18773745e-02] [-2.12355665e-02 -2.37301462e-02 5.83266370e-02] [-2.87729993e-02 -1.29501832e-02 2.19860598e-02] [-7.33634539e-02 -3.20692674e-02 -4.27699325e-03] [ 1.01309440e-01 -7.10889295e-03 -3.26635735e-02] [ 4.66914241e-03 -6.54565055e-03 4.89090634e-02] [-7.25622099e-02 4.50951516e-02 9.60154831e-02] [ 1.82196477e-02 -9.41281687e-02 8.93028511e-02] [-4.50014592e-02 1.33595041e-01 4.17256634e-02] [ 6.65444411e-02 -7.45667372e-02 1.05762873e-02] [-7.49356804e-02 1.84822826e-01 -4.30591039e-02] [-5.92407172e-02 -1.36323462e-01 1.54437502e-02] [ 9.26689792e-02 -4.46141105e-02 5.98010879e-02] [-1.02253044e-01 -3.44156319e-02 -9.34458138e-03] [ 9.20526563e-02 -1.68440485e-02 9.39041434e-02] [ 3.86283455e-02 6.01058257e-02 -1.48547509e-02] [ 6.62425739e-03 1.13944163e-01 1.86834619e-02] [ 5.30093424e-02 1.31555333e-03 -4.89051845e-02] [ 1.89768204e-02 -5.88728636e-02 -1.42478706e-01]] Final stress: [-1.04226527e-05 -9.61988707e-05 4.23842210e-05 1.15024051e-06 6.76914732e-05 8.71589106e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 45 steps. Final forces: [[-1.28758832e-01 3.16144600e-02 9.66107634e-02] [-1.32297160e-01 7.97653183e-02 -5.53753776e-02] [-3.38450103e-02 -1.28924239e-01 -9.57656395e-02] [-7.43252130e-02 -1.32505605e-01 6.20894766e-02] [ 1.24473315e-01 -1.92834337e-02 1.05217762e-01] [-1.34656150e-01 -7.96860721e-02 4.96376921e-02] [ 1.07318201e-01 -1.51716608e-02 1.23243783e-01] [-1.09054149e-01 1.21840337e-01 -1.41356960e-02] [ 6.28802705e-02 6.88896056e-02 1.35006537e-01] [ 7.80218729e-02 1.32053110e-01 5.84714300e-02] [ 1.61366852e-02 -1.23899087e-01 -1.06396954e-01] [-1.83519565e-02 -1.24318151e-01 -1.05484511e-01] [ 1.31630690e-01 -9.08361369e-02 -3.67460457e-02] [ 7.47274699e-02 -6.04295411e-02 1.33062441e-01] [ 1.17926444e-01 7.06557029e-04 1.14116420e-01] [ 1.30598276e-01 -9.24320388e-02 -3.64871462e-02] [-1.59651841e-03 8.15118184e-04 -7.95912174e-04] [ 1.34749766e-03 1.81143838e-04 7.34299876e-05] [ 1.28761960e-03 -5.61248142e-06 -2.05190681e-05] [-8.04301076e-04 7.87142297e-04 -7.56308383e-04] [ 4.25845767e-04 -3.85471942e-03 -4.73785432e-04] [-1.78892899e-03 3.23421224e-03 -1.70910414e-03] [ 1.20166501e-03 3.88035497e-03 1.11543409e-03] [ 1.07373076e-04 -3.46505592e-03 -8.61745809e-05] [-5.93338026e-04 6.06248358e-04 -3.37957073e-03] [ 8.51551116e-05 1.47158444e-04 3.72720155e-03] [-9.57657115e-04 -8.87806701e-04 3.66927725e-03] [ 5.43183910e-04 -5.04367040e-04 -4.23305555e-03] [-6.12130533e-04 -2.99856602e-03 -5.52843661e-04] [-2.40861322e-04 3.11224683e-03 2.37508778e-04] [-8.80436904e-05 3.07213590e-03 2.31567229e-05] [ 1.16654473e-04 -2.80738933e-03 1.81481310e-04] [-1.26662087e-03 -3.90138805e-04 -4.37577889e-04] [ 5.52769614e-04 3.59961835e-04 -4.13587704e-04] [ 1.46166430e-03 7.56816567e-04 -7.44349258e-04] [-1.23424053e-03 4.68465482e-04 4.76444514e-04] [-3.59250303e-04 4.30380642e-04 3.59904177e-03] [ 5.13023833e-04 4.77799492e-04 -3.41225961e-03] [ 1.71631180e-04 2.48154293e-04 -2.90943775e-03] [-1.07404698e-03 1.01295857e-03 3.36299556e-03] [-1.47469303e-03 -5.83963170e-04 -6.07168684e-04] [ 1.84404051e-03 -3.49885889e-04 4.45033887e-04] [ 5.26893119e-04 -3.51527522e-03 5.11116928e-04] [ 1.44437031e-03 3.29287385e-03 -1.51834078e-03] [-9.83086543e-04 -9.62605299e-04 -3.34332456e-03] [-4.13588672e-04 4.00418616e-04 3.08066875e-03] [-6.22935554e-04 -3.40143990e-03 5.52290921e-04] [-2.85192847e-04 3.61301250e-03 -2.37376531e-04] [ 1.33947527e-03 -9.01457828e-04 -9.10530090e-04] [-1.41862791e-03 3.59772341e-04 -2.76272230e-04] [-4.24981138e-04 4.64203963e-04 -2.62756285e-03] [-2.12396079e-04 -2.44257636e-04 3.16697856e-03] [-1.42350479e-03 -1.37245084e-03 1.36622145e-03] [ 1.61304255e-03 -1.60202191e-04 -1.42562702e-04] [ 1.20529015e-04 3.44341835e-03 8.64601120e-05] [ 4.64064930e-04 -2.85789833e-03 -4.21198285e-04] [ 1.07501886e-03 2.63189112e-04 -2.79595991e-04] [-1.08416287e-03 9.66525863e-05 9.09680303e-05] [ 1.03121911e-03 -1.01762827e-03 3.31201123e-03] [ 7.11563582e-04 6.21052271e-04 -3.40093422e-03] [-3.53043102e-04 -3.86461709e-03 -4.39937095e-04] [-3.47121394e-04 3.66017029e-03 3.74836206e-04] [-2.27876829e-04 2.50769415e-04 -3.38998144e-03] [ 5.57086541e-04 4.58993564e-04 3.48068023e-03] [ 6.77924325e-02 -1.46699294e-02 -4.36693742e-02] [ 5.30737296e-02 -3.72952167e-02 3.88834119e-02] [ 1.62488602e-02 6.22942512e-02 4.59822813e-02] [ 4.42624814e-02 5.55283518e-02 -4.26026536e-02] [ 4.59141693e-02 -4.14936013e-02 2.21962225e-02] [ 5.79495023e-02 -2.32468674e-02 -3.66117086e-02] [ 1.09288436e-02 6.34019073e-02 5.07661948e-02] [ 4.79923838e-02 5.74984356e-02 -2.47547225e-02] [-5.30453577e-02 7.27981410e-03 -4.33804053e-02] [ 7.52741969e-02 2.38133509e-02 -1.01516813e-02] [-4.97281852e-02 8.97043162e-03 -5.60810242e-02] [-5.82776835e-02 6.96949887e-03 -6.02427046e-02] [ 6.47797779e-02 3.58247956e-02 -1.48646623e-02] [-3.76093431e-02 1.94759011e-02 -6.07918395e-02] [ 6.01631916e-02 -5.42765560e-02 1.22476826e-02] [-2.83464116e-02 -1.78735420e-02 -7.07882020e-02] [-4.39315205e-02 -5.78390243e-02 -3.78080695e-02] [-1.79004621e-02 -2.63861335e-02 -6.50691103e-02] [ 6.39824230e-02 -5.50014249e-02 -4.69023169e-03] [-4.54330093e-02 -4.32436007e-02 -3.24171186e-02] [-7.63004082e-03 6.71535545e-02 4.82358262e-02] [ 9.38454205e-03 5.78962134e-02 4.27149663e-02] [ 2.26166943e-03 5.44313600e-02 4.89559521e-02] [ 2.72182666e-03 6.20878088e-02 4.99376430e-02] [-6.02786853e-02 3.17180222e-02 9.32465691e-03] [-4.54595232e-02 2.86384589e-02 -6.25062739e-02] [-7.92861052e-02 3.35296811e-02 8.67109278e-03] [-4.56336121e-02 3.13536232e-02 -6.96372296e-02] [-5.61872051e-02 1.14988635e-02 -5.65099833e-02] [-6.63455805e-02 -4.14531154e-03 -4.65477745e-02] [-7.53098522e-02 4.59443344e-02 2.36236673e-02] [-6.34064438e-02 4.04096394e-02 1.51062696e-02]] Final stress: [-8.07919148e-05 -1.03502430e-04 -1.02579792e-04 4.66175113e-06 5.55747387e-06 5.66346892e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 47 steps. Final forces: [[ 2.02948912e-02 -1.23983639e-01 1.05473096e-01] [ 1.28808348e-01 -2.84063557e-02 9.73767907e-02] [-9.52683548e-02 3.38749229e-02 1.29093946e-01] [ 8.21679912e-02 1.32367171e-01 -5.00521565e-02] [ 1.66463119e-03 -1.16392138e-01 -1.15308220e-01] [ 8.24231404e-02 1.32035741e-01 5.08480445e-02] [ 1.28421482e-01 9.59065503e-02 3.41087103e-02] [ 1.22913262e-01 -1.07775284e-01 -1.28640348e-02] [ 5.96073172e-03 1.14709920e-01 1.17071949e-01] [-1.26031802e-01 -1.02719825e-01 2.23803631e-02] [-1.52993387e-02 -1.08327306e-01 -1.22311242e-01] [ 2.55708252e-02 1.25253953e-01 1.02743200e-01] [-6.31207789e-02 -6.98413369e-02 1.34197472e-01] [ 8.04953841e-02 1.32818466e-01 -5.25595401e-02] [ 9.65880159e-02 1.28376489e-01 -3.26282238e-02] [-1.51764674e-02 -1.05098669e-01 1.25033772e-01] [-8.00995801e-03 -3.53185458e-04 2.45779261e-04] [ 6.47644414e-03 -1.70445603e-03 -1.68448807e-03] [ 5.77026446e-03 -1.31837563e-03 -1.31172451e-03] [-8.12082308e-03 -4.90250839e-04 7.08304072e-04] [ 8.79781509e-04 -8.11745157e-03 -1.56724275e-03] [ 1.06178640e-03 8.53813699e-03 1.53779287e-03] [-2.73796746e-03 8.28765616e-03 -2.02153234e-03] [ 7.80888761e-04 -8.47998386e-03 -1.49787152e-03] [ 1.61115960e-03 -2.40320818e-03 -3.91968886e-03] [ 9.60577567e-04 1.70550735e-03 4.81429540e-03] [ 1.49680690e-03 2.30814119e-03 4.03846835e-03] [ 3.99462037e-04 -1.28179544e-03 -3.99545938e-03] [-3.64336303e-03 -8.25861235e-03 -4.46140583e-03] [-1.76105347e-03 7.85824064e-03 2.45187911e-03] [-2.57899079e-03 8.10458927e-03 3.33700801e-03] [-3.71208625e-03 -7.37521815e-03 -4.47498622e-03] [-5.81024529e-03 -2.58852346e-03 -2.61557864e-03] [ 8.72112596e-03 -2.39176331e-03 2.25607463e-03] [ 8.38685587e-03 3.88682115e-05 1.84974263e-05] [-6.11094108e-03 1.12161162e-03 1.17141199e-03] [-1.21013405e-03 1.74506715e-03 5.01487033e-03] [-1.51271358e-05 -5.25148756e-04 -3.96063864e-03] [-4.50298231e-03 -5.14148140e-03 -4.34747184e-03] [-1.12492519e-03 1.72413068e-03 4.09377894e-03] [-5.47180876e-03 -3.38369158e-03 -3.32877398e-03] [ 8.73100404e-03 1.28860136e-03 -1.31980991e-03] [-8.07177361e-04 -8.30691423e-03 -1.61757050e-03] [-2.56601672e-03 8.56555444e-03 3.28618806e-03] [-2.01573213e-03 -2.63580816e-03 -4.26229771e-03] [-1.12355795e-03 1.70935775e-03 3.64321054e-03] [-7.91398964e-04 -7.72161693e-03 9.77697921e-05] [-3.75397318e-04 8.49104271e-03 1.72348750e-04] [ 5.75177981e-03 -2.92221414e-04 -2.11319841e-04] [-8.10332519e-03 9.42607628e-04 -9.24290926e-04] [ 8.02999224e-04 -1.76882956e-03 -4.38868690e-03] [-2.43742923e-03 -1.60665602e-03 4.32069405e-03] [-7.84255194e-03 -6.43846596e-04 4.86718484e-04] [ 5.94164872e-03 -1.64016009e-03 -1.62645688e-03] [-6.67917486e-04 8.52526835e-03 -1.91543377e-05] [-1.79176533e-03 -8.48832713e-03 1.14307942e-03] [ 8.55592939e-03 3.09428353e-04 -2.40489898e-04] [-5.89330049e-03 1.99640238e-05 4.05527111e-05] [ 5.36521982e-04 -1.81853301e-04 4.53317558e-03] [-6.53073686e-04 -1.30181381e-03 -4.18760621e-03] [-9.80325229e-04 -7.96765273e-03 -1.73376285e-03] [-7.72390901e-04 8.49122565e-03 1.35556585e-03] [ 8.71398901e-04 -1.68722668e-03 -4.35753852e-03] [-5.06410689e-04 2.09056709e-04 4.27217613e-03] [ 3.92214450e-02 3.76745525e-02 -7.37364421e-02] [-9.44986846e-02 -1.09494694e-02 2.40378049e-03] [-1.46419284e-02 1.77810932e-02 -7.74531820e-02] [ 2.73431025e-02 -2.73579851e-02 2.48459368e-02] [-1.54016051e-02 2.86122102e-02 -4.32983265e-02] [-5.82420068e-02 5.51195169e-02 -3.90182829e-02] [ 6.90987764e-02 -5.01847003e-02 -2.55617249e-02] [-7.28186686e-02 -5.20116119e-02 2.40713624e-03] [ 2.69364681e-02 9.74235400e-02 3.52835823e-02] [ 1.70699435e-02 -6.47017869e-02 -6.80078066e-03] [-7.50188100e-02 -5.86644455e-02 -2.49810300e-02] [-6.34367798e-02 1.04425130e-02 5.90179158e-02] [-6.59748317e-02 -2.23058673e-02 -5.41450892e-02] [-9.37275280e-03 -3.53906297e-02 2.27529788e-04] [ 7.02145592e-03 4.96281724e-02 -3.00368198e-02] [-6.98227438e-02 -9.12699335e-02 2.18804439e-02] [ 8.17937471e-03 7.76097937e-02 -4.36784818e-02] [ 3.98081485e-02 -7.30724516e-03 -6.98070608e-02] [-1.24391200e-01 4.69113872e-02 -3.71529975e-03] [ 1.06054513e-01 -3.86145690e-03 1.12865007e-02] [ 4.50647043e-02 1.03950590e-01 2.33209143e-02] [ 3.37573089e-02 -9.71633170e-02 -2.19994024e-02] [-4.81401976e-02 2.36539719e-02 9.08620374e-02] [-6.74115592e-02 -3.47494691e-03 -9.43671585e-02] [ 4.33008181e-02 -9.24179899e-03 -9.38622523e-02] [ 1.00934033e-04 -4.47863636e-02 7.83900412e-02] [ 1.48613397e-02 4.04390741e-02 -4.13422594e-02] [-5.42922584e-02 -7.48577245e-02 -7.64484428e-03] [-7.19673855e-02 -7.32779846e-02 5.81667021e-04] [-6.57379838e-03 -3.39128256e-02 4.21343077e-02] [ 1.50678390e-02 4.33382739e-03 -1.12565302e-01] [-1.68911792e-02 5.24132080e-02 -5.01957734e-02]] Final stress: [ 2.31808603e-04 -4.33489326e-05 -8.22800620e-05 -1.45806635e-04 -5.69742082e-07 2.08984349e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 27 steps. Final forces: [[ 4.69657189e-02 -1.31814000e-01 8.57183963e-02] [ 2.03247760e-02 -1.22695515e-01 -1.06656994e-01] [ 1.27770673e-01 9.83233160e-02 -3.05277873e-02] [ 1.25562168e-01 1.04299730e-01 1.65862829e-02] [-2.59140771e-02 -9.94126286e-02 -1.27446132e-01] [ 6.97386308e-02 -6.70283145e-02 -1.32465125e-01] [ 6.89569886e-02 1.33283982e-01 -6.60839405e-02] [ 1.30677952e-01 -4.66698952e-02 -8.73848531e-02] [ 7.79928732e-02 -1.32857104e-01 -5.52452056e-02] [-5.45249847e-02 -1.32849698e-01 -7.93638457e-02] [-1.27550269e-01 9.94902007e-02 -2.71412185e-02] [ 1.31946617e-01 8.58100945e-02 -4.59158349e-02] [ 1.14931249e-01 8.34402177e-05 -1.17109660e-01] [ 1.88441438e-02 1.22094869e-01 -1.07616759e-01] [ 1.17128436e-01 1.14904789e-01 1.10655234e-03] [ 4.53745150e-02 -1.31300095e-01 8.67701499e-02] [-5.46907290e-03 -4.50267035e-04 6.05212780e-04] [ 8.03712166e-03 1.74050842e-03 1.75930916e-03] [ 8.20120430e-03 1.80147750e-05 -7.54088603e-05] [-5.35168253e-03 -6.12583181e-04 8.07819098e-04] [-4.45448068e-03 -8.03670621e-03 5.23993603e-03] [ 4.26872226e-04 7.75012426e-03 -3.23857980e-04] [-5.12647121e-04 7.49223504e-03 -1.18829976e-03] [-1.20600503e-03 -8.54508134e-03 2.01737089e-03] [-1.75642520e-03 2.28582285e-03 -4.17650644e-03] [-6.03566754e-04 -1.21777087e-03 3.97569990e-03] [ 4.66519649e-04 -1.73440254e-04 4.14999938e-03] [-2.26670480e-03 2.93568793e-03 -4.29876811e-03] [ 8.35965129e-04 -8.11009627e-03 1.54573467e-03] [ 7.63163872e-04 7.61353648e-03 -1.45104320e-03] [-2.80230850e-03 7.86387189e-03 2.25986740e-03] [-1.37789631e-03 -8.40602996e-03 -7.45007042e-04] [-8.11485205e-03 7.96115167e-04 8.58930234e-04] [ 5.81160232e-03 2.47249521e-03 -2.29344788e-03] [ 5.55066554e-03 -5.93473978e-05 7.69336139e-05] [-8.37791472e-03 2.08558207e-03 2.22301505e-03] [ 7.11500581e-05 -9.46611214e-04 3.74410464e-03] [ 8.77193233e-04 1.75038071e-03 -4.49289669e-03] [ 1.90908928e-03 2.87891112e-03 -4.04678353e-03] [ 6.12864163e-04 -1.36532742e-03 4.15025975e-03] [-7.69357534e-03 1.88997869e-03 1.82567936e-03] [ 5.72690273e-03 -1.14662996e-03 1.28034610e-03] [ 2.19287967e-03 -7.95097593e-03 2.88426365e-03] [-1.81143322e-03 7.29315747e-03 1.11419386e-03] [ 3.35145149e-04 1.15131855e-03 -4.34705824e-03] [ 8.89237323e-04 -1.76325441e-03 3.36977590e-03] [-3.17335486e-03 -7.69259871e-03 3.90815126e-03] [-2.23526669e-03 8.49357425e-03 -2.96961743e-03] [ 7.98469008e-03 1.45153388e-03 1.45950307e-03] [-5.19464037e-03 1.07090293e-04 -1.13865093e-04] [-1.43035192e-03 2.02992551e-03 -4.84985424e-03] [-6.98152397e-04 -1.28936794e-03 3.70624584e-03] [-4.83705819e-03 -3.41176359e-04 4.88117477e-04] [ 8.83220715e-03 1.24790552e-03 1.40160107e-03] [-1.05520531e-03 7.82783272e-03 -1.84132068e-03] [-2.68395198e-03 -8.00830393e-03 3.44946489e-03] [ 5.68182450e-03 -2.16380676e-03 2.31141726e-03] [-8.29554011e-03 -2.19013852e-04 -2.24457110e-04] [-2.88603418e-03 2.04048259e-03 4.19852679e-03] [ 7.88884348e-04 1.48470234e-03 -3.91798396e-03] [ 4.27802531e-04 -7.62421195e-03 1.16199270e-03] [-1.90726861e-03 8.18850531e-03 1.24797447e-03] [-1.25918747e-03 1.84984694e-03 -3.83568420e-03] [-1.20491006e-03 -1.68533550e-03 3.75781374e-03] [ 3.03141314e-02 8.70883493e-02 -1.02192039e-02] [-5.68436214e-02 5.12760900e-02 3.02242118e-02] [-8.62224966e-02 -8.69912662e-02 4.45240545e-02] [-3.78313140e-02 -7.23884422e-02 -7.52644616e-03] [ 1.24322072e-02 2.00698236e-02 6.71032429e-02] [-6.87380443e-02 3.01295658e-02 -7.28831955e-02] [-4.70912093e-02 -5.05042523e-02 -3.04032305e-02] [-1.10594871e-01 -1.03651827e-02 4.61589285e-02] [ 3.00846831e-02 1.57247527e-02 5.69978110e-02] [-1.27461148e-04 4.91311027e-02 4.09630623e-02] [-6.55371709e-02 1.04051443e-03 5.54016098e-02] [-5.44166120e-02 4.15557397e-02 3.40430328e-02] [-8.96248929e-02 3.18867909e-02 4.70395317e-02] [ 2.75621423e-03 -9.18662372e-02 1.51833502e-02] [ 1.32272197e-02 7.68379928e-02 6.25553518e-02] [-4.63561717e-02 7.05371188e-02 1.13215674e-03] [-1.97769272e-02 3.94156663e-02 5.91414979e-02] [ 1.83380259e-03 2.03475707e-02 6.96320542e-02] [-8.63511305e-02 -7.99706013e-03 -1.03852786e-03] [ 5.62015760e-02 7.60680140e-02 3.15717589e-02] [ 9.00557232e-02 -4.09742874e-02 5.42216157e-02] [-9.13815583e-03 -2.14798420e-02 -2.58107281e-02] [ 2.03414349e-02 -1.80506542e-02 -6.47161149e-03] [-8.90054055e-02 -5.55056814e-02 4.58418391e-02] [-1.13587264e-03 4.68892506e-02 7.30437499e-02] [ 2.74596435e-02 -7.22835016e-02 3.13220156e-02] [-7.24481890e-02 -1.93853626e-02 1.28407054e-02] [-8.22408208e-02 -2.87472911e-03 8.81260977e-02] [-1.13724084e-01 -4.31414035e-03 5.52764050e-02] [ 1.96794453e-03 -8.46572744e-02 -3.59392997e-02] [ 4.23071159e-02 8.30846184e-02 -1.01889142e-03] [-5.77661537e-02 -1.00394223e-02 -6.40443734e-02]] Final stress: [ 2.28384726e-04 -3.96248181e-05 -7.56868916e-05 1.54846534e-04 3.38467471e-06 -1.92224718e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-2.28255623e-02 -4.95532158e-02 7.24972307e-02] [ 5.94176743e-02 -5.35729007e-02 5.58150630e-03] [ 9.75487990e-02 9.52202466e-02 -2.71293201e-03] [ 1.26457441e-01 1.01576091e-01 2.50327508e-02] [-4.68383318e-02 -3.03649908e-02 -7.72379539e-02] [ 5.69304836e-02 1.33487740e-01 7.67225946e-02] [ 4.68558285e-02 1.32127602e-01 -8.53129975e-02] [-9.83701245e-02 3.48949085e-03 9.51658892e-02] [ 3.82925647e-02 -5.29616732e-02 -1.46895175e-02] [-1.31183823e-02 4.00742785e-02 5.34492617e-02] [ 1.00782971e-02 -2.81760391e-02 -1.82396894e-02] [ 7.68966331e-02 8.63170827e-03 -6.83776120e-02] [-4.19796055e-02 -8.70609562e-02 1.28939379e-01] [ 2.85137736e-02 1.27522341e-01 -9.92882752e-02] [ 1.22965785e-01 9.61124964e-02 2.70784752e-02] [ 3.26494798e-02 -1.28759923e-01 9.63893407e-02] [ 6.65084859e-05 -9.29314652e-05 9.79034308e-05] [ 3.02880928e-03 -2.12889433e-04 -2.14004588e-04] [ 3.02866212e-03 5.87237387e-06 6.88018626e-06] [ 1.36742356e-04 4.32355980e-06 3.53771443e-06] [ 1.77582987e-03 -6.06164595e-03 -1.70843933e-03] [ 1.79911481e-03 6.05689749e-03 1.72433501e-03] [ 1.73441504e-03 6.05098199e-03 1.66123756e-03] [ 1.70577604e-03 -6.07758284e-03 -1.63867843e-03] [ 1.82349421e-03 -1.81229643e-03 -3.75380658e-03] [ 1.70894428e-03 1.69430067e-03 3.71234879e-03] [ 1.77123959e-03 1.74717890e-03 3.76781229e-03] [ 1.83527772e-03 -1.82360598e-03 -3.73317976e-03] [-1.92548838e-03 -6.04577056e-03 -1.86957624e-03] [-1.92956119e-03 6.05700189e-03 1.86570442e-03] [-2.01544262e-03 5.98117959e-03 1.95651998e-03] [-2.18537714e-03 -6.01025843e-03 -2.12598928e-03] [-3.04523403e-03 -4.32078916e-05 -4.06039957e-05] [-5.00596501e-05 2.68904834e-05 -2.43692707e-05] [-4.51586009e-05 3.50687282e-05 -3.01574970e-05] [-2.93300603e-03 -4.70887861e-05 -4.40249566e-05] [-1.76512693e-03 1.72409578e-03 3.82079759e-03] [-1.80739192e-03 -1.78619361e-03 -3.74707579e-03] [-1.92643297e-03 -1.89371866e-03 -3.70690852e-03] [-1.80508126e-03 1.77440925e-03 3.79763720e-03] [-2.96447290e-03 -1.63617863e-04 -1.67655913e-04] [-5.36596143e-05 -8.27315326e-05 8.51108940e-05] [-1.85434064e-03 -5.95861900e-03 -1.80058423e-03] [-1.97087119e-03 6.05433193e-03 1.91492495e-03] [-1.84145979e-03 -1.80947126e-03 -3.86526029e-03] [-1.68064322e-03 1.63977581e-03 3.68062542e-03] [ 1.89746239e-03 -5.99312134e-03 -1.83207065e-03] [ 1.81514933e-03 6.06816125e-03 1.74237580e-03] [ 2.99199771e-03 -1.29276030e-04 -1.32972751e-04] [ 1.06255820e-04 -9.38791375e-05 8.88109298e-05] [ 1.79403266e-03 -1.77857606e-03 -3.72916942e-03] [ 1.68366799e-03 1.66234603e-03 3.78766523e-03] [ 9.53309911e-05 -7.01584076e-06 8.07933254e-06] [ 3.02833305e-03 -2.34073945e-05 -1.68570774e-05] [ 1.90731276e-03 6.08391643e-03 1.84081440e-03] [ 1.88291427e-03 -6.02394031e-03 -1.81238079e-03] [-1.64359550e-04 -1.69938484e-04 1.68601385e-04] [-3.01780478e-03 -1.00217355e-04 -9.94850510e-05] [-1.83661575e-03 1.80144088e-03 3.78718240e-03] [-1.82328978e-03 -1.79669837e-03 -3.75318114e-03] [-2.00859537e-03 -6.04427349e-03 -1.94883405e-03] [-2.06048939e-03 6.06974653e-03 1.99264079e-03] [ 1.76390933e-03 -1.75972849e-03 -3.76524516e-03] [ 1.73826853e-03 1.72061510e-03 3.73622661e-03] [ 1.02186739e-02 2.56287666e-02 -4.13929441e-02] [-2.48210549e-02 2.63483967e-02 -5.45082998e-03] [-4.05066132e-02 -4.83668986e-02 7.54565881e-03] [-6.23738213e-02 -5.26285038e-02 -6.91072583e-03] [-3.45196789e-02 2.72940587e-02 4.18885485e-03] [ 1.19721198e-02 2.16512832e-02 -3.07731207e-02] [-5.38701958e-02 -4.95640761e-02 -6.85575873e-03] [-6.00159444e-02 -4.79590175e-02 -1.69509103e-02] [ 1.68558020e-02 1.69644843e-02 4.51757140e-02] [-3.32504514e-02 -6.53598088e-02 -4.34933433e-02] [-2.26372363e-02 -6.05869826e-02 3.73424507e-02] [ 2.85777849e-02 1.43680326e-02 3.38742640e-02] [-2.35600573e-02 -6.34552135e-02 -3.26983281e-02] [-2.45636586e-02 -6.61325080e-02 4.43583036e-02] [ 4.72607375e-02 6.97852182e-04 -5.19062952e-02] [-1.32699554e-02 2.54497502e-02 2.83580017e-03] [ 1.11309065e-02 -1.84448532e-02 -2.09741672e-02] [-2.49800758e-02 2.78732705e-02 1.54376087e-02] [ 4.78042707e-02 -4.48699500e-03 -4.46837037e-02] [-1.90421060e-04 -2.07832057e-02 -3.24166097e-02] [-1.15495401e-02 1.51443818e-02 1.75395057e-02] [-4.24928012e-02 -6.61101585e-03 2.69423887e-02] [ 3.80195247e-04 1.37488685e-02 3.68003907e-03] [-3.17110868e-02 -4.81758070e-03 3.76969591e-02] [ 1.98259043e-02 4.46735911e-02 -6.71013600e-02] [-1.64422647e-02 -6.43280733e-02 5.27374188e-02] [ 2.20791481e-02 3.95280199e-02 -6.08783017e-02] [-1.36327807e-02 -5.96890626e-02 4.32206408e-02] [-5.91455846e-02 -4.70282324e-02 -1.81929323e-02] [-6.11418769e-02 -4.99244984e-02 -8.66892611e-03] [-1.88487180e-02 6.40791706e-02 -5.49467096e-02] [-1.44659641e-02 6.05074707e-02 -4.29653525e-02]] Final stress: [-6.14564307e-05 -6.24505980e-05 -9.79521581e-05 3.23200101e-06 1.39401653e-08 5.07720757e-08] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 34 steps. Final forces: [[ 8.18382587e-03 -9.23460149e-02 8.38438232e-02] [ 3.82047353e-02 2.15657072e-02 6.07163298e-02] [-4.53094874e-02 -1.31619861e-01 -8.68900781e-02] [-2.22019583e-02 -1.25297512e-01 1.03611831e-01] [-1.32504342e-01 8.44221537e-02 -4.74231338e-02] [ 3.71272387e-02 -9.22088465e-02 -1.30601407e-01] [-8.11502517e-02 5.19423923e-02 -1.32831726e-01] [ 2.36592218e-02 1.03485922e-01 -1.25155638e-01] [ 8.54461303e-02 4.68509008e-02 1.31993107e-01] [-1.25376615e-01 -2.35425538e-02 1.03177559e-01] [-1.81817199e-02 1.24978120e-01 1.04747217e-01] [ 1.15410382e-01 -7.14769924e-04 -1.16603892e-01] [ 7.33236011e-02 6.01219857e-02 -1.33973230e-01] [-7.48958007e-02 -1.33926050e-01 5.83579960e-02] [ 4.95463271e-02 -8.35885927e-02 1.32285817e-01] [-8.57504728e-02 1.31913919e-01 -4.68175802e-02] [-2.43316299e-03 9.62475947e-05 2.68362093e-05] [ 8.56622224e-04 1.19670479e-04 1.24189689e-04] [-7.48928385e-04 -1.30788842e-03 -1.14531050e-03] [-3.52434713e-03 1.44873902e-03 -1.44702470e-03] [-2.00508874e-03 -5.58131717e-03 2.20679693e-03] [-1.44634847e-03 5.35588138e-03 -1.35100365e-03] [-1.72506083e-03 5.61479799e-03 -1.78649121e-03] [ 1.06218637e-03 -5.26601396e-03 -9.88911330e-04] [-2.17139927e-03 2.45220764e-03 -3.39362699e-03] [-3.51076844e-04 -3.42262055e-04 3.95004198e-03] [-2.26745757e-05 -1.51421029e-04 4.60398257e-03] [-1.98239684e-03 2.13615138e-03 -3.59598776e-03] [ 2.14721545e-03 -5.16152600e-03 2.16166363e-03] [ 1.09254000e-03 6.80206614e-03 -1.34783371e-03] [ 5.33862762e-04 6.61550294e-03 -5.97007923e-04] [ 1.44708442e-03 -5.30452193e-03 1.54123275e-03] [ 7.92848079e-04 1.74703482e-03 1.80838046e-03] [ 2.20042024e-03 3.67930055e-04 -3.92626489e-04] [ 3.98839126e-03 -8.94275844e-04 6.89733803e-04] [-6.12196217e-04 2.17192323e-04 9.22027342e-05] [ 3.26150963e-04 -4.88578744e-04 1.97230822e-03] [ 3.54013911e-04 4.55968701e-04 -4.33606204e-03] [ 1.42193690e-03 1.54533941e-03 -3.21805174e-03] [ 1.80805186e-03 -1.89483021e-03 3.73430214e-03] [-3.41082983e-04 -8.50623669e-05 -1.26989795e-04] [ 1.92370773e-03 -5.95756264e-04 4.51413946e-04] [ 2.38253622e-03 -5.37607755e-03 2.35104608e-03] [ 1.94792202e-03 5.33184128e-03 -2.10045842e-03] [ 1.52083848e-03 1.50777358e-03 -3.08099338e-03] [ 1.91118436e-03 -1.82978136e-03 3.34214616e-03] [-2.27002483e-03 -5.47495802e-03 2.33463128e-03] [-1.15775285e-03 5.42095257e-03 -9.51781721e-04] [ 2.99590278e-04 -8.73897751e-05 6.98300328e-05] [-3.45868408e-03 9.62060255e-04 -8.35956204e-04] [-1.29877770e-03 1.31420808e-03 -3.32213740e-03] [-2.20877660e-03 -2.35124325e-03 3.50502815e-03] [-2.42337699e-03 -3.20148758e-04 3.35478713e-04] [ 1.97486186e-03 -1.24156971e-03 -1.26920436e-03] [-3.51503886e-03 6.58278782e-03 -3.58894523e-03] [ 2.44046999e-04 -6.38195841e-03 -1.55799596e-04] [ 3.52899638e-03 -1.52334842e-03 1.57058289e-03] [-2.02431330e-03 9.05949579e-04 7.31366761e-04] [ 1.22430008e-03 -1.31799011e-03 3.13985497e-03] [ 1.66859268e-03 1.75657216e-03 -5.79073342e-03] [ 2.84004145e-03 -6.86053111e-03 2.72593546e-03] [-9.15117231e-06 3.96408396e-03 -5.84284706e-05] [ 2.35476994e-04 -2.28782689e-04 -2.09186280e-03] [-3.43082241e-03 -3.56860468e-03 4.32445332e-03] [ 3.75906885e-02 8.02746650e-02 -3.42338352e-02] [-2.25500451e-02 -2.13072979e-02 -5.17897324e-02] [ 2.77208889e-02 6.42528151e-02 6.18743828e-02] [ 1.51221326e-02 5.45125347e-02 -4.07584480e-02] [-1.29106205e-02 -2.22105330e-02 -1.10921231e-02] [-4.38873783e-02 5.94588910e-03 -6.07686454e-02] [ 2.10990588e-02 5.89361527e-02 4.05533091e-02] [ 6.04941258e-03 4.41609536e-02 -5.33003058e-02] [ 1.01029767e-01 -1.56445686e-02 2.38202872e-03] [-5.28122890e-03 5.30246215e-02 4.91021645e-02] [ 5.42435730e-02 -5.87587511e-02 1.94031707e-02] [ 2.45416902e-02 -6.72390757e-02 3.13291855e-02] [-2.60754236e-02 4.63058710e-02 8.18940017e-02] [ 1.23039924e-02 3.86658866e-04 9.98385669e-02] [ 1.95202691e-03 -3.74654944e-02 3.84442497e-02] [-4.54442541e-02 -2.05111773e-02 -8.40956542e-02] [ 5.34783249e-02 5.25906625e-04 -4.19710782e-02] [-2.46891538e-02 -2.71993217e-02 -2.40597490e-02] [-2.01640738e-02 -5.84517127e-02 6.05908311e-02] [ 5.22517010e-02 1.22498956e-02 -5.34737756e-02] [ 3.89741143e-02 -1.98585567e-02 -5.08625500e-02] [-4.05700391e-02 2.17547780e-02 3.25017633e-02] [-3.30895777e-02 -8.42144186e-02 -5.65615017e-02] [-5.46271768e-02 -1.33705537e-02 6.11699878e-02] [-1.57643827e-02 -2.53528701e-02 5.73078480e-02] [ 5.15441247e-02 7.27743469e-02 -2.62503771e-02] [-4.55912894e-02 -3.39265714e-02 8.61197253e-02] [ 3.68869007e-02 8.43263174e-02 -3.24523903e-02] [-3.51016181e-02 5.32825066e-02 -6.62105029e-02] [-1.70526112e-02 4.15425195e-02 -6.77689763e-02] [ 4.54897545e-02 -6.10014740e-02 1.40947503e-02] [ 1.64169697e-02 -6.88660773e-02 5.97864746e-02]] Final stress: [ 4.46298431e-05 -6.32150331e-05 -1.69776606e-04 -2.26559203e-06 2.16933549e-06 6.50043355e-05] Minimization stopped after hitting the maximum of 200 steps. Final forces: [[-1.54168087e-01 -9.87057140e-02 6.48392767e-02] [ 1.21929605e-01 -4.77879332e-02 -9.52121586e-02] [-1.90505107e-01 9.44139308e-02 4.63827216e-03] [ 1.97533281e-01 9.69968858e-03 -5.21956624e-02] [-2.08208217e-01 -2.32698244e-02 8.92991481e-03] [ 1.56438083e-02 1.90396250e-01 -4.91378943e-02] [ 1.35564863e-01 7.32332446e-02 -5.52394107e-02] [-1.92192455e-02 -7.91826228e-02 1.27925903e-01] [ 1.04015266e-01 2.74504489e-01 -1.12489794e-01] [ 1.66539026e-01 1.87455269e-02 4.06627593e-02] [ 1.97327999e-01 7.73893537e-03 -5.53039406e-02] [ 2.64982559e-02 1.07449685e-01 -1.94219302e-01] [ 5.95194287e-03 -3.88373268e-02 1.51583432e-01] [ 9.22147074e-02 9.83907100e-02 -9.42791295e-02] [-1.30329073e-01 -7.86403946e-02 -7.74302600e-03] [-8.11155843e-02 -1.02194928e-01 5.67583463e-02] [-1.34437384e-03 4.63677913e-02 -7.83361566e-02] [-7.20860802e-02 6.26241582e-02 5.68092097e-02] [-5.40085230e-02 4.00042854e-02 3.68419472e-02] [ 9.51615206e-03 -5.37035189e-02 2.30477464e-02] [-8.06247469e-02 1.66962453e-02 8.41989692e-02] [ 2.36152058e-02 -4.92895345e-02 3.03932739e-02] [ 1.11399616e-02 -1.76879112e-02 2.98083444e-02] [-6.21443358e-02 6.14757744e-02 4.55705077e-02] [-3.55612100e-02 3.32273770e-02 -2.08383103e-03] [ 4.65653960e-02 4.25585730e-02 -1.24339178e-01] [ 1.01049836e-01 9.43637346e-02 -3.06272423e-02] [ 1.65046164e-02 -1.84535772e-02 3.18080058e-02] [ 9.20732393e-03 8.78144693e-02 1.01904002e-03] [-4.11817370e-02 -2.22638838e-02 4.88014083e-02] [ 1.62986339e-02 -4.75669846e-02 -3.77307418e-02] [-3.90464174e-02 -1.32569346e-03 -7.21286835e-02] [ 5.51525037e-02 -4.96502457e-02 -5.69688695e-02] [ 9.63876399e-03 2.10465099e-03 1.41608349e-02] [-2.44712881e-02 -4.11017628e-02 2.73969727e-02] [ 1.29010422e-01 1.16464263e-02 4.65681305e-02] [ 6.98201156e-02 -8.76575581e-02 -7.84182472e-02] [ 2.30309312e-02 2.79113497e-02 3.56097018e-02] [ 6.64860595e-02 9.23123415e-02 -5.73982877e-02] [-2.61487394e-02 2.09050679e-02 -6.74370497e-02] [ 9.00561605e-03 -8.80291067e-02 -1.54733872e-01] [-7.99495199e-02 -7.13709590e-03 2.89523664e-02] [ 2.47789574e-02 4.45459529e-02 1.90250978e-02] [-5.83895127e-02 -8.36076336e-02 5.95651627e-02] [ 4.82620518e-04 3.53425384e-02 4.82765783e-02] [ 2.41502683e-02 -7.38963263e-02 -1.32037901e-01] [-3.28012878e-02 9.35191764e-02 4.70314591e-02] [ 5.19564208e-02 -6.11095767e-03 5.26335496e-03] [-5.25815339e-02 -5.84514735e-03 -6.01167062e-03] [ 1.19293252e-02 -1.06092009e-02 -1.09857560e-02] [-3.40464852e-02 -1.77008287e-02 3.01663727e-02] [ 9.96966128e-02 1.24206715e-01 -6.47319976e-02] [-3.77915733e-03 2.66889131e-02 1.42277050e-02] [-4.39713667e-03 -4.80146333e-02 -2.68144153e-02] [-3.84156655e-02 9.43817500e-03 -6.51484458e-02] [ 1.71050636e-02 9.24503020e-03 -3.40791159e-02] [-3.25657031e-02 -4.99884839e-02 3.84866030e-02] [ 1.61969560e-02 3.19781794e-02 2.87120352e-02] [ 9.34654435e-02 -6.28696204e-02 -4.89017827e-02] [-5.17259596e-02 -6.40656860e-02 -9.01232778e-03] [-7.13566557e-03 -3.44302503e-02 -1.39101868e-03] [-1.01234222e-01 -2.38937855e-02 7.73743054e-02] [ 5.05971471e-02 -6.91742070e-02 -5.02266157e-02] [ 2.88990253e-02 -4.06745416e-03 -2.05669445e-02] [ 1.34348505e+00 3.97232705e-01 1.30428323e-01] [-5.59772080e-02 2.75377418e-02 -2.55639296e-01] [ 2.23667702e-01 -6.08311535e-01 -5.45828127e-02] [-1.12974343e-01 1.22599721e+00 -1.49390013e-01] [-4.38875086e-01 -5.36692746e-02 -1.87669339e-01] [-4.51529475e-01 -4.34773347e-02 -7.49921874e-01] [ 6.02964620e-01 -5.24555174e-01 2.76958809e-01] [-1.07649068e-01 -6.64089361e-01 -1.60701530e-01] [ 3.96935663e-01 2.18068250e-01 -4.80176829e-01] [-3.89013418e-03 -5.40691698e-01 2.33991283e-01] [-8.63604152e-01 -9.43670868e-02 -1.31732926e-01] [ 6.50769676e-02 2.78404029e-01 -1.29950078e-01] [ 7.56215122e-02 -6.00357004e-01 -4.88399977e-01] [-1.90183612e-01 1.82469808e-01 -2.89207910e-02] [ 1.11061313e-01 1.13303747e-01 3.57863675e-01] [-4.85918217e-01 7.00547706e-02 6.94700157e-01] [-4.12656058e-01 -1.51251074e-01 -4.31015057e-01] [-1.51207890e-01 -1.09625675e+00 7.83778530e-01] [ 3.60342682e-01 3.76897815e-01 2.96013140e-01] [-1.49559336e-01 7.08146777e-02 1.19715115e-01] [-3.16606105e-01 -6.68371333e-01 -4.25213330e-01] [ 7.13311015e-01 4.68374057e-01 -9.98435965e-02] [-4.45827239e-01 -4.93235782e-01 -2.90096128e-01] [ 4.23472691e-01 -4.01523009e-01 6.09255643e-01] [-2.36465177e-01 1.13462221e-01 -2.97579063e-01] [-4.77407425e-01 2.26198126e-01 -2.13595357e-01] [-9.55118879e-02 3.93843655e-01 4.15543297e-01] [-2.56427101e-01 3.30581833e-01 1.98397051e-01] [ 1.80942575e-01 -2.01731450e-01 -4.71099757e-01] [-3.98452186e-01 7.01458528e-01 7.79542168e-01] [ 1.42200887e-01 -7.22130164e-01 1.93476020e-01] [ 6.50305508e-01 1.28652930e+00 5.37341975e-01]] Final stress: [ 1.24054120e-03 -1.51381065e-03 7.52297219e-04 -4.67976571e-04 4.94457805e-05 9.92102055e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 29 steps. Final forces: [[-2.42993110e-02 -9.75073476e-02 1.29088294e-01] [ 2.52824392e-02 -1.30920926e-01 -9.44600959e-02] [ 1.21514000e-01 1.08889895e-01 -1.16027119e-02] [ 1.39429968e-03 1.23477584e-01 -1.07196600e-01] [ 6.80389284e-02 -1.34525016e-01 -6.30875213e-02] [-7.87571582e-02 5.02606629e-02 1.34773047e-01] [ 9.30086883e-02 1.27839905e-01 -3.89960323e-02] [ 1.21407693e-01 -1.46489157e-02 -1.08628401e-01] [ 8.32280003e-02 4.10013961e-02 1.35337218e-01] [-1.57687504e-02 -1.26407595e-01 -1.02453415e-01] [ 2.71325258e-02 -1.28263919e-01 -9.78606450e-02] [ 1.28442482e-01 3.84636487e-02 -9.29041743e-02] [-4.40890128e-02 1.33150794e-01 -8.42025752e-02] [ 4.75392816e-02 1.28627664e-01 -8.79791279e-02] [ 9.96635090e-02 1.28947140e-01 -1.34319079e-02] [-1.28012041e-01 1.99218730e-02 1.00062267e-01] [-5.82631880e-03 2.11529780e-03 -1.24722374e-03] [ 3.80368736e-03 1.95956694e-03 2.00311364e-03] [ 3.12113990e-03 3.16724583e-03 5.29058067e-03] [-6.87425945e-03 7.25020191e-03 -5.48925827e-03] [-5.87655819e-03 -4.97221436e-03 5.98883299e-03] [ 2.22358800e-03 8.70049138e-03 2.48310253e-03] [-1.92647209e-03 7.76738497e-03 -1.27053663e-03] [-5.48294191e-03 -2.92201673e-03 5.34284542e-03] [-6.80755002e-03 6.72834306e-03 -6.47544100e-03] [ 6.75525194e-03 5.05346396e-03 2.35511537e-03] [ 4.61053385e-03 5.47619244e-03 8.71709583e-03] [-3.44808191e-03 3.41601642e-03 -3.19984654e-03] [ 2.20847802e-03 -9.03945632e-03 2.39696543e-03] [ 5.56747073e-04 3.22963830e-03 -5.84388813e-04] [-7.16045144e-03 4.91440485e-03 7.37469639e-03] [ 1.26405533e-03 -9.75463983e-03 1.27964642e-03] [-5.80521330e-03 -5.82994930e-03 -4.49433795e-03] [ 3.66996799e-03 -1.74715054e-03 8.62052046e-04] [ 5.22703858e-03 -2.10113486e-04 3.10487951e-04] [-5.99639825e-03 -4.77662328e-03 -3.05910827e-03] [ 3.10321115e-03 -4.91312377e-03 4.79327138e-03] [-8.24599040e-03 -8.58579443e-03 -6.36654457e-03] [ 5.66918073e-04 -1.68929075e-04 -4.48574358e-03] [ 1.66142187e-03 -2.92908324e-03 7.76499551e-03] [-8.80780108e-03 -1.05725466e-02 -9.03994788e-03] [ 6.52021044e-03 -1.39120757e-02 1.37056234e-02] [-1.00068386e-03 -9.87460853e-03 -6.76314345e-04] [ 7.52661290e-03 3.97214315e-03 -7.43581794e-03] [-9.70897713e-03 -1.05387156e-02 -7.07410247e-03] [ 4.48980177e-03 -6.05695339e-03 6.85080953e-03] [ 4.09727163e-03 -5.63759900e-03 -4.09510105e-03] [ 8.67180860e-04 7.09671383e-03 5.20395052e-04] [ 7.14389939e-03 4.51210783e-03 4.63001064e-03] [-6.29452298e-03 2.04162832e-03 -9.51556117e-04] [-5.01789056e-03 5.92088158e-03 -4.94649459e-03] [ 9.30684810e-03 1.08092949e-02 9.73822640e-03] [-9.35277028e-03 1.21894885e-02 -1.07791359e-02] [ 6.74417237e-03 4.95376652e-03 4.16709943e-03] [-3.26235656e-03 8.66547063e-03 -3.24416949e-03] [-1.99131430e-03 -4.54757715e-03 2.26168106e-03] [ 6.00807331e-03 -8.24213766e-03 7.54742895e-03] [-5.97545874e-03 -8.97823822e-03 -8.08544067e-03] [ 1.14551456e-02 -1.28664401e-02 8.75466992e-03] [-9.86854130e-04 -1.60293132e-03 -3.78224501e-03] [-2.90470811e-03 -7.56015332e-03 -2.93066722e-03] [-1.14305104e-02 5.61124814e-03 1.13357525e-02] [-3.73352984e-03 3.61559197e-03 -6.29253774e-03] [ 2.81620283e-03 3.77880813e-03 5.67850137e-03] [ 2.72010841e-02 6.74875398e-02 -8.73503009e-03] [-1.13703446e-01 -1.22447512e-01 1.02968968e-01] [-2.93626477e-02 5.93076297e-02 -5.33268717e-02] [ 5.80328125e-02 -2.21373912e-01 -2.31156372e-02] [ 1.16444200e-01 1.92703091e-01 -2.92566165e-02] [-7.95927146e-03 -1.58952325e-02 -1.54763866e-01] [ 4.74073975e-02 -6.43027052e-02 7.27624201e-02] [-4.66642275e-02 -4.82020381e-02 1.08972153e-01] [ 2.13911879e-02 7.87185493e-02 -1.91240997e-02] [ 3.43784808e-02 -6.11180776e-02 -2.72561713e-02] [-9.09176866e-02 -6.41316065e-02 3.68078854e-02] [-3.86838893e-02 -6.73583208e-02 8.63214078e-02] [-3.19788203e-02 3.89347713e-02 -3.87695058e-02] [-6.13678129e-02 -5.69816815e-02 4.19730008e-02] [-5.12275805e-02 1.11383517e-01 6.38535439e-02] [-3.09197735e-03 2.69551397e-02 -1.18552754e-01] [-7.69936624e-02 1.51085206e-01 -5.13535987e-03] [-6.41093910e-02 -4.42464173e-02 -6.18578113e-02] [-1.53867791e-01 -5.93817576e-02 8.14325488e-02] [ 6.17477682e-02 4.01437475e-02 1.10229383e-01] [-5.95633114e-03 5.46415437e-03 4.11277890e-02] [-1.30604651e-02 -5.05733954e-02 7.94396390e-02] [ 3.01196811e-02 6.79971277e-02 4.11293213e-02] [-8.69907237e-03 6.73791278e-02 3.42012263e-02] [ 7.66758421e-02 6.28148104e-02 -1.22981274e-02] [-5.59538337e-02 -1.06039775e-01 3.06194118e-02] [-4.33240581e-02 -9.81412814e-02 -2.37908617e-02] [-3.75868229e-02 1.22168929e-02 1.01700693e-01] [-6.00898832e-02 -1.14848071e-01 -5.97527373e-03] [-1.98857889e-02 -1.23716996e-01 1.25852127e-02] [ 5.02825823e-02 8.42894397e-02 3.93769483e-02] [-6.75199337e-03 6.86486943e-03 -1.26148224e-01]] Final stress: [ 2.41878281e-05 2.00864683e-04 3.04229970e-05 1.31673128e-06 -2.87462901e-05 1.56514373e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 19 steps. Final forces: [[ 4.97778659e-03 1.48080880e-02 -1.89480933e-02] [-2.39294065e-02 5.42895527e-02 3.03405335e-02] [-4.90840704e-02 -1.32061919e-01 -8.41613125e-02] [-1.33866600e-01 -7.77773798e-02 -5.45643270e-02] [-1.08774664e-01 1.22175241e-01 1.35219763e-02] [-2.21151942e-02 -1.26039828e-01 -1.02749929e-01] [-1.05336127e-01 -6.77664145e-02 -3.72836843e-02] [ 7.48811692e-02 5.91956862e-02 -1.33506344e-01] [ 1.24708626e-01 -6.44734671e-02 5.94469908e-02] [ 2.96834188e-02 1.04192566e-02 -1.96169867e-02] [-7.06641790e-02 1.17218047e-01 4.75329870e-02] [ 9.06239750e-02 1.90982620e-02 -7.14544640e-02] [-1.12252025e-01 1.14695287e-01 -3.44231960e-03] [-2.90048895e-02 -8.25118992e-02 5.22135924e-02] [-1.01703627e-01 -6.36804656e-02 -3.85525246e-02] [ 3.51751654e-02 -8.12205083e-02 4.50040900e-02] [-4.37930749e-03 2.70636861e-03 -2.67337164e-03] [ 3.44078880e-03 1.75039419e-03 1.65078200e-03] [ 4.39115415e-03 1.62177203e-03 1.57852328e-03] [-2.79189195e-03 1.88126943e-03 -1.85621887e-03] [ 4.28831301e-04 -2.74436280e-03 -4.95486377e-04] [ 2.71042662e-04 4.52869156e-03 2.15936762e-04] [ 2.19884931e-04 5.76137192e-03 2.99913083e-04] [ 1.74019160e-04 -2.29813161e-03 -3.70698912e-05] [-2.26280167e-03 2.24304858e-03 -3.99032261e-03] [ 1.61267491e-03 1.65046455e-03 4.41357317e-03] [ 2.13421716e-03 2.15561043e-03 2.67384509e-03] [-1.43695159e-03 1.57052352e-03 -3.44593398e-03] [-4.22480064e-04 -5.27518552e-03 -4.12849424e-04] [-4.17821446e-04 1.41916731e-03 4.24508419e-04] [ 5.47654485e-04 1.44085552e-03 -6.22625774e-04] [ 6.11344659e-04 -6.66475196e-03 5.51884916e-04] [-3.45429153e-03 -2.68571324e-03 -2.57623065e-03] [ 4.77929572e-03 -2.48412247e-03 2.32085145e-03] [ 3.11222034e-03 -2.70468174e-03 2.59114797e-03] [-3.68850384e-03 -1.96402182e-03 -1.86727973e-03] [ 2.15118413e-03 -2.19177888e-03 3.92117787e-03] [-1.48413129e-03 -1.53290052e-03 -3.21057024e-03] [-1.84088543e-03 -1.93957377e-03 -5.28698765e-03] [ 2.13759992e-03 -2.17447129e-03 2.69548594e-03] [-4.77835239e-03 -1.30219392e-03 -1.26191211e-03] [ 3.83270642e-03 -2.17519704e-03 2.13834116e-03] [ 8.14421674e-04 -4.92288672e-03 8.95559948e-04] [-5.78058177e-04 3.02457348e-03 5.11785588e-04] [-2.52705001e-03 -2.64008785e-03 -3.45416320e-03] [ 2.61577687e-03 -2.76914390e-03 3.08465019e-03] [ 5.25956000e-04 -1.71919377e-03 -5.17242789e-04] [-1.04556665e-03 5.81989026e-03 -1.03838637e-03] [ 3.08303010e-03 2.64073876e-03 2.53617191e-03] [-3.51338976e-03 2.81196008e-03 -2.63166246e-03] [-2.29297074e-03 2.39522453e-03 -3.15385788e-03] [ 2.00437994e-03 2.17210211e-03 3.88012307e-03] [-3.88482129e-03 2.05792498e-03 -1.87095867e-03] [ 3.62723671e-03 2.67205681e-03 2.63154638e-03] [ 3.85868220e-04 5.29492904e-03 4.44006937e-04] [-3.25467473e-04 -1.45133081e-03 3.28576103e-04] [ 2.69963158e-03 -2.32851039e-03 2.22160316e-03] [-2.70918024e-03 -2.07480236e-03 -2.03258339e-03] [ 1.81519511e-03 -1.90673514e-03 4.37955728e-03] [-2.50388462e-03 -2.61910125e-03 -3.15407851e-03] [ 1.14389226e-04 -4.52011304e-03 5.44003784e-05] [ 1.22805520e-04 2.21528765e-03 -5.32756926e-05] [-2.58638750e-03 2.77408638e-03 -3.46440459e-03] [ 3.02727778e-03 3.12194671e-03 3.97716055e-03] [-7.91296393e-03 -7.39406415e-03 -2.04658949e-03] [ 2.23675501e-02 -2.64643304e-02 -1.64372229e-02] [ 2.82993511e-02 5.44753940e-02 5.55305724e-02] [ 5.36071614e-02 4.09499436e-02 2.96896266e-02] [ 1.03334478e-03 -2.01309685e-02 -5.81478472e-03] [ 3.40895194e-03 -5.95746942e-03 2.23723298e-02] [ 1.60394572e-02 7.35378639e-02 3.36866961e-02] [ 7.25216781e-02 4.00174014e-02 1.75851446e-02] [ 3.68359449e-02 -7.48057665e-02 9.52818107e-03] [ 1.49177545e-02 5.30153683e-02 6.21093132e-02] [ 6.76912501e-02 3.66522289e-02 1.79706583e-02] [ 6.53997380e-02 -4.53017567e-02 -3.09084068e-02] [ 8.04776191e-03 6.88353517e-02 3.76062503e-02] [ 4.98492112e-02 3.26159617e-02 2.53620883e-02] [-3.54384454e-02 -1.78184763e-02 7.29984859e-02] [-6.78657005e-02 1.56130762e-02 -2.88880201e-02] [-1.16944869e-03 -7.52051282e-03 1.59458108e-02] [-5.68475047e-02 4.17710357e-02 -4.02749893e-02] [-4.54059479e-02 -3.51706144e-02 6.54523128e-02] [-1.91073696e-02 -6.66505861e-03 -1.77459353e-03] [ 3.53991282e-02 -5.48490363e-02 -8.13660942e-03] [-4.86132263e-02 -2.28102645e-02 3.75854694e-02] [ 4.18158726e-02 -5.97303746e-02 -3.04295920e-02] [-4.50320897e-02 4.32065433e-03 3.41142799e-02] [ 4.54218086e-02 -5.96085639e-02 -5.57012495e-03] [ 3.31311452e-03 3.94450056e-02 -2.26233402e-02] [ 6.83093279e-02 -5.40956526e-02 9.50111180e-03] [ 1.25362896e-02 3.51226799e-02 -3.10531158e-02] [ 6.99114321e-02 2.21864945e-02 -1.31294542e-03] [ 3.39326647e-02 4.68817051e-02 3.45419211e-02] [ 3.30217460e-03 6.44748591e-02 -6.27703005e-03] [-3.16440226e-02 1.13990791e-02 -3.51267129e-02]] Final stress: [-9.09299801e-05 -3.75468863e-05 -9.00904978e-05 1.39541628e-06 1.59754421e-05 1.53749484e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 158 steps. Final forces: [[ 8.25646218e-02 4.26698526e-02 -1.18102786e-01] [ 1.32890416e-01 -8.31253593e-02 4.86162775e-02] [ 2.24761768e-02 -4.15798969e-02 -7.27786084e-02] [ 1.10192067e-02 -1.09009337e-01 1.22183756e-01] [-1.25050339e-01 1.03380028e-01 -2.45160881e-02] [-1.77921951e-03 -1.14813309e-01 -1.17303043e-01] [-2.28451346e-02 2.88679027e-02 -5.08058198e-02] [ 1.18642144e-01 -1.59870345e-02 -1.12442802e-01] [ 1.33565351e-01 -5.21209498e-02 7.98200430e-02] [ 1.12217137e-01 -1.68926214e-02 -1.18756426e-01] [-1.29806478e-01 4.21583903e-02 -9.10577591e-02] [ 6.71611445e-02 -7.19305881e-02 -1.31463156e-01] [-1.27055205e-01 2.99014411e-02 9.95370811e-02] [-8.47400965e-02 -1.19824073e-01 4.16698443e-02] [-9.49384365e-02 3.81724708e-02 -1.28336377e-01] [ 4.52583809e-02 7.81566989e-02 -1.37261533e-01] [-2.95485546e-03 -2.02785647e-03 1.93492094e-03] [ 2.81751593e-03 -1.00816434e-03 -7.76503966e-04] [ 1.89851718e-03 3.18390343e-04 4.77388575e-04] [-1.67249840e-03 -1.99758233e-03 1.90181790e-03] [ 3.21331017e-04 -4.80033586e-03 -2.60581537e-04] [-2.16745428e-03 1.28350308e-03 -2.16677764e-03] [ 1.72320174e-03 2.16131140e-03 1.81638779e-03] [-2.45925612e-04 -5.35601822e-03 1.27799657e-04] [ 2.13393409e-03 -2.26003078e-03 -2.95661677e-03] [ 1.68699796e-04 -3.43557936e-05 2.14748306e-03] [-3.82741052e-03 -4.12623589e-03 3.55264485e-03] [ 2.76213005e-03 -3.03190729e-03 -4.18940076e-03] [-2.06198133e-03 -3.22736894e-03 -2.11783781e-03] [ 7.82645366e-04 6.38130215e-03 -6.76480529e-04] [ 1.09831153e-03 5.76727264e-03 -1.24053701e-03] [ 1.77863225e-03 -2.45705841e-03 1.74183620e-03] [-3.63959509e-03 1.55009165e-03 1.35872308e-03] [ 3.03657390e-03 2.03806744e-03 -1.94004007e-03] [ 4.15698961e-03 2.73147411e-03 -2.41406818e-03] [-5.05538178e-03 2.99796410e-03 2.73682723e-03] [-3.59654394e-03 3.85580453e-03 5.25585526e-03] [ 3.59360082e-03 3.89272045e-03 -4.64859699e-03] [ 3.41883008e-03 3.60157980e-03 -4.39893166e-03] [-1.91364974e-03 2.16457490e-03 4.97263007e-03] [-3.56647905e-03 4.41815109e-03 4.19911282e-03] [ 5.03980898e-03 3.51044672e-03 -3.25735489e-03] [ 2.68003310e-03 -2.10009248e-03 2.77279302e-03] [-7.27999967e-04 4.90545631e-03 6.25928871e-04] [ 1.19406915e-03 1.34751564e-03 -4.43678532e-03] [-6.04648630e-05 1.64691081e-04 3.65849504e-03] [ 1.60866499e-04 -5.95044251e-03 -2.23433869e-04] [ 3.79849170e-03 1.13038836e-03 3.77313721e-03] [ 3.47629491e-03 -3.56865286e-03 -3.34340211e-03] [-3.73538110e-03 -3.98759041e-03 3.64499205e-03] [ 9.10986671e-04 -1.01701190e-03 -2.46531550e-03] [-8.64903398e-04 -9.84837459e-04 3.58159476e-03] [-4.19483112e-03 -2.74252275e-03 2.51701481e-03] [ 3.72396758e-03 -4.14655735e-03 -3.91980895e-03] [-1.72773550e-03 2.25837869e-03 -1.66817449e-03] [-5.24700313e-04 -4.29898580e-03 6.70272333e-04] [ 2.67963303e-03 1.06318687e-03 -9.17190205e-04] [-3.65640206e-03 5.24673495e-04 3.62037309e-04] [-2.58441420e-03 2.75576269e-03 2.95737471e-03] [ 9.76351831e-04 1.18117205e-03 -3.44491881e-03] [-1.60498258e-03 -2.10877837e-03 -1.52533763e-03] [-4.11436998e-04 6.64143703e-03 4.75836043e-04] [ 3.41593726e-03 -3.71101369e-03 -4.46599551e-03] [-3.83535265e-03 -4.01347661e-03 4.22580384e-03] [-7.77565606e-02 -3.31381731e-02 5.30763138e-02] [-4.43392582e-02 1.23300652e-02 1.09549394e-02] [ 1.04712866e-02 -1.90080219e-02 4.89317681e-02] [-4.41429144e-02 5.87953430e-02 -6.73539913e-02] [-8.39647718e-02 6.59409691e-02 -5.36831171e-02] [-4.42592561e-02 -3.29609091e-02 4.04500190e-02] [-2.57375526e-02 -1.63537341e-02 5.13606096e-02] [ 2.82652644e-02 5.11441304e-02 -3.65333523e-02] [ 4.90137760e-02 -6.80029246e-02 2.00606087e-02] [-2.12369801e-02 2.77930399e-02 6.78315369e-02] [ 6.96958320e-04 -4.97436284e-03 2.67748605e-02] [ 5.51931358e-02 -3.36703421e-02 9.44797390e-03] [ 2.48644507e-02 4.01218236e-02 4.68860424e-02] [ 6.17556799e-03 -3.25398731e-02 1.93427173e-02] [-6.36810430e-02 2.97616802e-02 8.60574300e-02] [-5.64285272e-02 1.12250317e-02 -4.13291857e-02] [-4.07894591e-02 2.70096713e-02 6.09392182e-02] [-7.16924823e-02 2.90974803e-02 -3.35767021e-02] [-2.44024590e-02 1.47909754e-02 6.77155209e-02] [-8.71246376e-02 4.97848602e-02 5.26327713e-02] [ 2.76180555e-02 -2.06380830e-02 6.50619844e-03] [-4.91276314e-02 5.93404761e-02 7.19563238e-02] [ 7.83521216e-02 -2.33799612e-02 7.16549709e-02] [-2.16260222e-02 7.35300175e-02 3.86141860e-02] [ 3.46720561e-02 -2.15758683e-02 -4.86246187e-02] [ 3.27701418e-02 4.98887963e-02 -6.47083008e-02] [ 7.51196377e-02 -2.63506509e-02 -7.69263344e-02] [ 6.85880155e-02 5.82841762e-02 -8.47092079e-03] [ 4.98834596e-02 -3.59854214e-03 6.88944943e-02] [ 6.18663126e-02 -4.03691764e-02 4.53100286e-02] [-2.59917825e-02 -2.64035503e-02 8.30503285e-02] [ 3.60544555e-02 6.41358068e-03 8.97204414e-02]] Final stress: [-2.05747171e-04 -3.85439853e-05 3.33189866e-05 2.18005637e-06 -1.78344542e-05 -8.79355949e-06] The following exception was caught during minimization: Exception('ERROR on proc 0: Non-numeric atom coords - simulation unstable (src/domain.cpp:551)\nLast command: r') Minimization stalled after 26 steps. Final forces: The following exception was caught during Hessian or Jacobian calculation: Exception('ERROR on proc 0: Non-numeric atom coords - simulation unstable (src/domain.cpp:551)\nLast command: c') 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)) The following exception was caught during Hessian or Jacobian calculation: Exception('ERROR on proc 0: Non-numeric atom coords - simulation unstable (src/domain.cpp:551)\nLast command: c') 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)) The following exception was caught during Hessian or Jacobian calculation: Exception('ERROR on proc 0: Non-numeric atom coords - simulation unstable (src/domain.cpp:551)\nLast command: c')