Model name? Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000 Stoichiometric species (literal list of strings)? ['O', 'Si'] Prototype label? A2B_hP12_182_cg_f Temperature (K)? No temperature given Cauchy stress (literal list of floats, Voigt order xx,yy,zz,yz,xz,xy, eV/A^3)? No stress given Query result (literal list of dicts)? [{'instance-id': 2, 'a.si-value': 5.0636e-10, 'parameter-names.source-value': ['c/a', 'z2', 'x3'], 'parameter-values.source-value': [1.6905166, 0.4382205, 0.41715431], 'meta.uuid': 'TE_941881542453_002-and-SM_503555646986_000-1711749333-tr'}] Runtime arguments (literal dictonary)? {} ==== Building ASE atoms object with: ==== representative atom symbols = ['O', 'O', 'Si'] representative atom coordinates = [[0.33333333 0.66666667 0.25 ] [0.41715431 0. 0. ] [0.33333333 0.66666667 0.4382205 ]] spacegroup = 182 cell = [[5.0636, 0, 0], [-2.5318, 4.3852062346029, 0], [0, 0, 8.5601]] ========================================= E L A S T I C C O N S T A N T C A L C U L A T I O N S Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-3.60694807e-10 9.47448735e-02 -4.09644074e-09] [ 4.93130155e-10 -9.47448734e-02 -8.51494445e-09] [ 4.10752676e-03 -3.25968719e-09 1.32078953e-09] [-6.82746577e-02 1.31606127e-01 -6.91711045e-02] [-6.82746611e-02 -1.31606125e-01 6.91711061e-02] [-4.10752690e-03 1.77326392e-09 8.92795660e-10] [ 6.82746582e-02 -1.31606126e-01 -6.91711046e-02] [ 6.82746660e-02 1.31606122e-01 6.91711083e-02] [ 1.16377595e-02 -7.50800458e-02 -7.95449656e-02] [-1.16377618e-02 7.50800483e-02 -7.95449628e-02] [ 1.16377589e-02 7.50800484e-02 7.95449673e-02] [-1.16377620e-02 -7.50800472e-02 7.95449661e-02]] Final stress: [6.08621507e-03 7.57696599e-03 1.05200731e-02 2.22494197e-12 4.96452520e-12 4.29430788e-12] Minimization converged after 28 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.08884063e-11 1.42838882e-03 5.44333023e-09] [ 4.13357404e-11 -1.42838896e-03 2.48461642e-08] [ 3.95351256e-03 3.97507272e-09 -1.81878038e-09] [-2.51531975e-03 4.30986548e-03 -4.87343657e-04] [-2.51531296e-03 -4.30986949e-03 4.87340056e-04] [-3.95351245e-03 -4.10969106e-09 -1.94611174e-09] [ 2.51532067e-03 -4.30986505e-03 -4.87344114e-04] [ 2.51530735e-03 4.30987255e-03 4.87337539e-04] [ 2.99735835e-04 4.04600124e-04 8.44542529e-03] [-2.99734248e-04 -4.04602228e-04 8.44541454e-03] [ 2.99736921e-04 -4.04603390e-04 -8.44543185e-03] [-2.99734047e-04 4.04602279e-04 -8.44542433e-03]] Final stress: [ 2.73796187e-04 3.48996798e-04 1.44339630e-05 -3.35257236e-12 -3.89190572e-12 -6.93200301e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.42691811e-10 -1.21132065e-03 9.70561764e-09] [-5.85358984e-11 1.21132102e-03 3.44613550e-08] [ 4.06526959e-03 1.00129773e-08 -4.28061495e-09] [-1.69495035e-03 3.08612268e-03 2.97128970e-04] [-1.69492257e-03 -3.08613865e-03 -2.97142108e-04] [-4.06526957e-03 -1.33015583e-08 -5.36899375e-09] [ 1.69494913e-03 -3.08612308e-03 2.97129605e-04] [ 1.69493462e-03 3.08613173e-03 -2.97136650e-04] [-3.04657661e-04 -4.83312050e-04 7.23074872e-03] [ 3.04653780e-04 4.83318401e-04 7.23073974e-03] [-3.04659291e-04 4.83316513e-04 -7.23075853e-03] [ 3.04652625e-04 -4.83312617e-04 -7.23074426e-03]] Final stress: [ 2.64020905e-04 2.37754835e-04 3.78569885e-06 8.41510949e-12 8.96463921e-12 -3.91649651e-12] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.42079270e-10 2.64818099e-03 2.31358397e-08] [ 6.68861633e-10 -2.64818131e-03 -2.25385809e-08] [-6.92224703e-04 1.49451229e-09 -3.56804863e-11] [-3.11434486e-04 7.97867196e-04 -1.74023541e-03] [-3.11433360e-04 -7.97867869e-04 1.74023599e-03] [ 6.92224905e-04 -1.27818669e-08 -4.99008942e-09] [ 3.11435993e-04 -7.97866816e-04 -1.74023664e-03] [ 3.11398601e-04 7.97888213e-04 1.74022001e-03] [ 6.96174869e-04 1.90396867e-04 2.11431253e-04] [-6.96160094e-04 -1.90405385e-04 2.11441152e-04] [ 6.96176907e-04 -1.90405221e-04 -2.11409393e-04] [-6.96159843e-04 1.90404623e-04 -2.11442532e-04]] Final stress: [ 4.14214193e-05 1.64225761e-04 2.78571406e-04 -2.67861959e-11 -8.20620373e-12 -1.58653846e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-8.91281493e-10 4.42110773e-02 -3.48182312e-08] [-4.15829319e-09 -4.42110770e-02 1.36837399e-07] [-4.81281988e-03 8.96361585e-09 -3.86148430e-09] [-2.26195188e-02 4.25339291e-02 -3.87676351e-02] [-2.26194873e-02 -4.25339476e-02 3.87676202e-02] [ 4.81282090e-03 -3.95774552e-08 -1.64202210e-08] [ 2.26195399e-02 -4.25339164e-02 -3.87676449e-02] [ 2.26194720e-02 4.25339558e-02 3.87676122e-02] [ 7.80641642e-03 -4.35735237e-02 -2.00572169e-02] [-7.80641613e-03 4.35735288e-02 -2.00573135e-02] [ 7.80641671e-03 4.35735244e-02 2.00572156e-02] [-7.80641884e-03 -4.35735201e-02 2.00572806e-02]] Final stress: [ 1.23718081e-03 2.72929595e-03 2.42563825e-03 1.65516535e-11 -9.10907841e-13 -1.89710102e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.95677971e-10 -1.16370525e-02 2.09157700e-08] [-2.37444009e-10 1.16370514e-02 -3.81866828e-08] [ 4.08233729e-04 1.29795228e-08 -4.92903693e-09] [ 2.67346258e-03 -4.56422864e-03 7.84517398e-03] [ 2.67347469e-03 4.56422151e-03 -7.84517928e-03] [-4.08233954e-04 2.44798972e-08 9.88211466e-09] [-2.67346070e-03 4.56422913e-03 7.84517387e-03] [-2.67346729e-03 -4.56422596e-03 -7.84517550e-03] [-2.81100666e-03 2.85457664e-04 6.92478691e-04] [ 2.81099849e-03 -2.85472838e-04 6.92516217e-04] [-2.81100004e-03 -2.85484442e-04 -6.92478753e-04] [ 2.81099989e-03 2.85467255e-04 -6.92496912e-04]] Final stress: [ 1.93465786e-04 -5.91409713e-04 1.85586277e-04 8.44452762e-12 -2.74195916e-11 -4.37706606e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.08209941e-10 -2.73200656e-02 2.68555711e-09] [ 1.12136977e-09 2.73200658e-02 6.98683801e-08] [ 8.43268546e-03 -1.34864186e-09 2.38265574e-10] [ 2.41943547e-03 -5.78245890e-03 1.73004742e-02] [ 2.41943233e-03 5.78246080e-03 -1.73004733e-02] [-8.43268521e-03 -3.01023395e-08 -1.27790997e-08] [-2.41941783e-03 5.78246941e-03 1.73004652e-02] [-2.41946047e-03 -5.78244475e-03 -1.73004866e-02] [-4.66244719e-03 3.45073015e-03 -1.68980109e-02] [ 4.66245217e-03 -3.45072891e-03 -1.68980610e-02] [-4.66244855e-03 -3.45072504e-03 1.68980096e-02] [ 4.66245260e-03 3.45072848e-03 1.68980228e-02]] Final stress: [ 6.42609602e-04 -9.93287773e-04 2.79930892e-04 -1.06192852e-11 8.09361839e-12 1.20093707e-11] Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.0568144 -0.02707541 0.00017186] [-0.0568144 0.02707541 0.00017183] [ 0.02687746 0.00384868 -0.0485619 ] [-0.00603072 0.02574426 0.04540096] [ 0.01577981 0.01964889 0.00235649] [-0.02687746 -0.00384869 -0.04856191] [ 0.00603073 -0.02574426 0.04540095] [-0.0157798 -0.0196489 0.00235649] [-0.00381446 -0.01106065 -0.00165623] [ 0.00381446 0.01106065 -0.00165622] [-0.0003513 -0.01863601 0.00228885] [ 0.00035129 0.01863602 0.00228883]] Final stress: [ 1.20011214e-03 3.69390491e-04 2.21110989e-03 1.38297234e-11 6.56978802e-12 -1.15920214e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.05684384 -0.02708776 -0.0001719 ] [ 0.05684384 0.02708776 -0.0001719 ] [ 0.02693372 -0.00379906 0.04856728] [ 0.01584006 -0.01974625 -0.00235798] [-0.00610002 -0.02577277 -0.04540351] [-0.02693372 0.00379907 0.04856729] [-0.01584008 0.01974624 -0.00235797] [ 0.00610003 0.02577277 -0.04540351] [-0.00030063 0.01866546 -0.00238678] [ 0.00030063 -0.01866546 -0.00238677] [-0.00385967 0.01103046 0.00175286] [ 0.00385968 -0.01103046 0.00175287]] Final stress: [ 1.20033015e-03 3.69827612e-04 2.21595804e-03 -9.28901828e-12 4.08003888e-12 1.15943295e-03] Minimization converged after 27 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.68302647e-10 -2.78544909e-03 4.17887154e-08] [ 3.41591755e-11 2.78544936e-03 -9.53147741e-09] [ 1.33922388e-03 8.23597346e-09 -3.32643341e-09] [-4.28408095e-05 -2.10674978e-04 1.75876351e-03] [-4.27974545e-05 2.10650338e-04 -1.75878283e-03] [-1.33922416e-03 -9.31502564e-09 -3.57590965e-09] [ 4.28394854e-05 2.10674166e-04 1.75876428e-03] [ 4.28088887e-05 -2.10656728e-04 -1.75877769e-03] [-7.31145591e-04 -2.72145009e-04 1.72047616e-04] [ 7.31141883e-04 2.72150221e-04 1.72074743e-04] [-7.31143673e-04 2.72137051e-04 -1.72046883e-04] [ 7.31137989e-04 -2.72134259e-04 -1.72068100e-04]] Final stress: [ 1.69984992e-04 3.60413773e-05 2.79485536e-04 8.46365369e-12 6.51610313e-12 -4.95724141e-11] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.35553824e-11 1.06005885e-02 3.58181840e-08] [ 4.60229840e-10 -1.06005878e-02 -3.54188667e-08] [-8.30628776e-03 4.83862019e-08 -2.01672516e-08] [ 6.24349157e-04 -5.62046375e-04 -7.34761143e-03] [ 6.24479594e-04 5.61971686e-04 7.34755077e-03] [ 8.30628746e-03 4.65575700e-08 1.99680294e-08] [-6.24447154e-04 5.61989818e-04 -7.34756443e-03] [-6.24378191e-04 -5.62029742e-04 7.34759931e-03] [ 1.78648486e-03 -1.69562003e-03 6.72569803e-04] [-1.78648448e-03 1.69562990e-03 6.72674405e-04] [ 1.78648653e-03 1.69561346e-03 -6.72628101e-04] [-1.78649042e-03 -1.69560440e-03 -6.72590540e-04]] Final stress: [-5.22404649e-04 1.34743474e-04 1.84340679e-04 1.18260726e-12 2.57044550e-11 -6.74335632e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.07776241e-10 2.43681279e-02 -1.68812559e-08] [-1.74883088e-09 -2.43681281e-02 1.09007992e-07] [-1.63549216e-02 1.12324394e-09 -6.70180494e-10] [-1.40863863e-03 6.11995305e-03 -1.61696317e-02] [-1.40864706e-03 -6.11994843e-03 1.61696348e-02] [ 1.63549221e-02 -3.84583948e-08 -1.63364518e-08] [ 1.40867692e-03 -6.11993051e-03 -1.61696498e-02] [ 1.40861657e-03 6.11996555e-03 1.61696198e-02] [ 8.47655096e-04 -9.25260166e-03 -1.68656013e-02] [-8.47658320e-04 9.25260141e-03 -1.68656862e-02] [ 8.47654261e-04 9.25260521e-03 1.68656028e-02] [-8.47657366e-04 -9.25260716e-03 1.68656365e-02]] Final stress: [-7.92570627e-04 4.32779092e-04 2.71099104e-04 9.71612981e-12 -7.93784419e-12 1.86116850e-11] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.08538049 -0.06006692 0.00188631] [ 0.03482033 -0.06012439 -0.0018865 ] [-0.08434749 -0.00424909 -0.04103331] [-0.02309417 0.03400055 -0.00446493] [ 0.00982018 0.008456 0.05482928] [-0.04555506 0.00474759 0.0213101 ] [-0.06931139 0.12307336 0.01436974] [ 0.01683995 0.02958735 -0.04501041] [ 0.1647659 0.05097969 -0.02616652] [ 0.06301552 0.10136679 -0.0345037 ] [-0.12678786 -0.13990648 0.03401566] [-0.0255464 -0.08786445 0.02665427]] Final stress: [-0.00122713 -0.00122226 0.00426812 -0.00500844 -0.00500867 -0.00161219] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.03481992 0.06012397 0.0018865 ] [ 0.08538006 0.0600665 -0.00188631] [-0.08434674 0.00424876 0.04103297] [ 0.00981962 -0.00845594 -0.05482879] [-0.02309407 -0.03400014 0.00446479] [-0.04555476 -0.00474792 -0.02130972] [ 0.01683953 -0.02958752 0.04500989] [-0.06931098 -0.1230724 -0.01436962] [-0.12678882 0.13990759 -0.03401569] [-0.02554756 0.08786571 -0.0266543 ] [ 0.16476699 -0.05098082 0.02616655] [ 0.0630168 -0.10136778 0.03450372]] Final stress: [-0.00122711 -0.00122224 0.00426813 -0.00500843 0.00500867 0.00161219] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.08538002 -0.06006646 -0.00188631] [-0.03481987 -0.06012393 0.0018865 ] [ 0.04555474 0.00474795 -0.02130968] [-0.01683949 0.02958755 0.04500984] [ 0.06931095 0.12307232 -0.01436961] [ 0.08434667 -0.00424872 0.04103294] [-0.00981956 0.00845593 -0.05482874] [ 0.02309407 0.03400011 0.00446477] [ 0.0255477 -0.08786588 -0.02665431] [ 0.12678895 -0.13990775 -0.0340157 ] [-0.06301697 0.10136791 0.03450373] [-0.16476715 0.05098096 0.02616656]] Final stress: [-0.00122711 -0.00122224 0.00426813 0.00500843 -0.00500866 0.00161219] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.03481983 0.06012388 -0.0018865 ] [-0.08537997 0.06006641 0.0018863 ] [ 0.04555469 -0.00474799 0.02130963] [ 0.06931089 -0.12307218 0.01436959] [-0.01683943 -0.02958756 -0.04500978] [ 0.08434657 0.00424869 -0.04103289] [ 0.02309405 -0.03400005 -0.00446476] [-0.0098195 -0.00845593 0.05482868] [-0.06301709 -0.101368 -0.03450372] [-0.16476722 -0.05098107 -0.02616656] [ 0.02554781 0.08786598 0.02665431] [ 0.12678903 0.13990783 0.03401569]] Final stress: [-0.00122711 -0.00122224 0.00426813 0.00500843 0.00500866 -0.00161219] Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 66 steps. Minimization converged after 63 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 6.76154638e-05 -1.77103209e-05 7.55391671e-05] [-6.76154635e-05 1.77103212e-05 7.55389851e-05] [ 3.02887101e-04 2.04597960e-04 5.44002630e-04] [ 1.25993938e-04 6.67371272e-04 -1.42381944e-04] [ 1.97616358e-04 -5.54387762e-04 -4.83176577e-04] [-3.02887100e-04 -2.04598046e-04 5.44002594e-04] [-1.25993865e-04 -6.67371231e-04 -1.42381980e-04] [-1.97616422e-04 5.54387801e-04 -4.83176609e-04] [ 3.29920583e-04 -1.08123867e-04 9.09505538e-04] [-3.29920586e-04 1.08123870e-04 9.09505571e-04] [ 2.57879464e-04 2.41263336e-04 -9.03488617e-04] [-2.57879471e-04 -2.41263335e-04 -9.03488759e-04]] Final stress: [3.09164667e-05 3.51132172e-05 8.45276240e-06 5.92039587e-15 8.17948554e-15 1.67926524e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-6.70207447e-05 -1.78137780e-05 -7.55377096e-05] [ 6.70207466e-05 1.78137775e-05 -7.55379063e-05] [ 3.03017315e-04 -2.04099575e-04 -5.45541539e-04] [ 2.01122982e-04 5.56371248e-04 4.85375289e-04] [ 1.28697439e-04 -6.69653644e-04 1.41737857e-04] [-3.03017316e-04 2.04099541e-04 -5.45541552e-04] [-2.01122987e-04 -5.56371255e-04 4.85375291e-04] [-1.28697490e-04 6.69653671e-04 1.41737834e-04] [ 2.61152217e-04 -2.42900892e-04 9.03901210e-04] [-2.61152194e-04 2.42900892e-04 9.03901285e-04] [ 3.32821239e-04 1.08125213e-04 -9.09934975e-04] [-3.32821207e-04 -1.08125197e-04 -9.09935085e-04]] Final stress: [ 3.09068425e-05 3.51542096e-05 8.45272954e-06 -5.03195193e-14 -1.81697422e-14 -1.67922025e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 7.38800132e-11 1.44565930e-02 1.29500835e-08] [ 1.93831409e-10 -1.44565931e-02 -3.08429313e-08] [-5.61758617e-03 -4.97608110e-09 2.22071483e-09] [-3.59957548e-03 6.41386413e-03 -1.08903728e-02] [-3.59958739e-03 -6.41385724e-03 1.08903787e-02] [ 5.61758595e-03 -8.98959629e-10 -2.56414490e-10] [ 3.59958255e-03 -6.41386014e-03 -1.08903762e-02] [ 3.59958271e-03 6.41386012e-03 1.08903764e-02] [ 1.00666671e-03 -1.06162593e-02 -9.80983814e-03] [-1.00666793e-03 1.06162592e-02 -9.80982181e-03] [ 1.00666635e-03 1.06162602e-02 9.80984734e-03] [-1.00666757e-03 -1.06162610e-02 9.80982246e-03]] Final stress: [-5.24251154e-05 4.94524262e-04 3.89497540e-04 1.08193636e-12 -1.00591509e-12 5.89230708e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 9.45377110e-11 -1.61973994e-02 -5.07676512e-09] [ 1.03810405e-10 1.61973996e-02 1.87273324e-08] [ 6.40192156e-03 1.02612231e-08 -4.26761546e-09] [ 2.28257271e-03 -3.58182942e-03 1.18866541e-02] [ 2.28258794e-03 3.58182063e-03 -1.18866616e-02] [-6.40192150e-03 -3.51574769e-10 -2.38750894e-11] [-2.28258534e-03 3.58182233e-03 1.18866601e-02] [-2.28257550e-03 -3.58182784e-03 -1.18866556e-02] [-2.93894723e-03 8.24328023e-03 8.80967616e-03] [ 2.93894784e-03 -8.24327809e-03 8.80967343e-03] [-2.93894877e-03 -8.24327455e-03 -8.80968782e-03] [ 2.93894811e-03 8.24327665e-03 -8.80966814e-03]] Final stress: [ 3.23960313e-04 -4.24467155e-04 -7.91952819e-05 -4.41734604e-13 2.50163491e-12 1.46378598e-11] Minimization converged after 2 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.10338413e-10 9.56792693e-04 -3.39364941e-08] [ 1.90522320e-10 -9.56791820e-04 -9.04540862e-08] [-3.27872890e-04 -4.82078100e-08 1.94781654e-08] [-2.47202243e-05 2.74041404e-04 -5.28678276e-04] [-2.47658600e-05 -2.74014615e-04 5.28700702e-04] [ 3.27872651e-04 2.93010077e-08 1.22136024e-08] [ 2.47147151e-05 -2.74044513e-04 -5.28675931e-04] [ 2.47731846e-05 2.74010839e-04 5.28703779e-04] [ 2.61539585e-04 1.00105781e-04 2.54013192e-05] [-2.61537281e-04 -1.00093061e-04 2.54269333e-05] [ 2.61538421e-04 -1.00101642e-04 -2.53791319e-05] [-2.61542282e-04 1.00113840e-04 -2.54066943e-05]] Final stress: [ 4.60850738e-05 6.78021530e-05 1.73290596e-04 1.48053820e-12 2.09507576e-11 -3.48538227e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.65447697e-11 4.02792075e-03 -1.71258738e-08] [ 4.64967079e-10 -4.02792110e-03 -1.90355503e-07] [-7.37916017e-04 -4.98838189e-08 2.14081138e-08] [-9.97622602e-04 1.38741224e-03 -2.89768034e-03] [-9.97719251e-04 -1.38735655e-03 2.89772767e-03] [ 7.37915465e-04 3.80832942e-08 1.62306660e-08] [ 9.97638541e-04 -1.38740386e-03 -2.89768793e-03] [ 9.97697362e-04 1.38736975e-03 2.89771728e-03] [ 4.57963986e-04 -1.28803396e-04 -3.98150982e-04] [-4.57962184e-04 1.28797961e-04 -3.98081615e-04] [ 4.57964919e-04 1.28799517e-04 3.98209702e-04] [-4.57960750e-04 -1.28803518e-04 3.98116061e-04]] Final stress: [-1.19408492e-05 1.47705069e-04 -7.43811801e-05 -5.72199389e-12 -8.53527447e-12 3.89438395e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.23035900e-09 -1.09524200e-02 -3.49156393e-08] [ 2.53285981e-09 1.09524204e-02 2.28087599e-07] [-1.52752947e-03 1.74786444e-08 -8.15735932e-09] [ 2.63396341e-03 -5.99955316e-03 6.81470640e-03] [ 2.63399182e-03 5.99953695e-03 -6.81472186e-03] [ 1.52753077e-03 -5.75749146e-08 -2.46334681e-08] [-2.63396662e-03 5.99955226e-03 6.81470618e-03] [-2.63404657e-03 -5.99950596e-03 -6.81474677e-03] [-3.16815899e-03 -1.84232553e-03 4.66335947e-04] [ 3.16818666e-03 1.84232375e-03 4.66190195e-04] [-3.16816184e-03 1.84233624e-03 -4.66366308e-04] [ 3.16818707e-03 -1.84232485e-03 -4.66264164e-04]] Final stress: [ 1.43659693e-04 -7.06041287e-04 6.94333257e-05 -5.19625533e-11 1.09528930e-11 2.55380509e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.76408257e-10 -4.49608735e-03 -4.66229199e-08] [ 3.72476827e-10 4.49608710e-03 2.46999362e-07] [ 1.23236226e-03 -1.10350523e-08 3.15539736e-09] [ 5.12653659e-04 -1.30397192e-03 2.86859271e-03] [ 5.12602583e-04 1.30400110e-03 -2.86857245e-03] [-1.23236140e-03 -6.60240012e-08 -2.92309150e-08] [-5.12577908e-04 1.30401679e-03 2.86855604e-03] [-5.12674952e-04 -1.30396059e-03 -2.86860698e-03] [-9.30695765e-04 1.31057927e-04 -1.03850551e-03] [ 9.30692251e-04 -1.31061332e-04 -1.03869790e-03] [-9.30698049e-04 -1.31048398e-04 1.03848795e-03] [ 9.30696670e-04 1.31043748e-04 1.03857183e-03]] Final stress: [ 5.79060794e-05 -2.05276199e-04 -1.34308947e-04 1.88454271e-12 -4.08197203e-12 5.68462198e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.05785917e-02 2.20724155e-02 4.25069031e-05] [-1.05785917e-02 -2.20724155e-02 -4.25052519e-05] [ 3.69823443e-02 7.00056122e-10 -2.93022374e-10] [-5.21960405e-04 -2.45105964e-02 2.54605275e-02] [-5.21958593e-04 2.45105954e-02 -2.54605284e-02] [-1.73367428e-03 3.72033210e-14 5.15475743e-12] [ 1.92634432e-03 5.31016433e-03 -1.05981200e-02] [ 1.92634412e-03 -5.31016422e-03 1.05981199e-02] [-2.95561443e-03 -3.59926517e-03 -1.59657744e-02] [-5.49451362e-03 1.76397838e-02 -1.61877756e-02] [-2.95561443e-03 3.59926506e-03 1.59657736e-02] [-5.49451368e-03 -1.76397835e-02 1.61877760e-02]] Final stress: [-1.27719772e-04 -1.14658674e-04 3.52569197e-04 -1.20732881e-03 1.51518291e-13 -9.68779090e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.05785917e-02 2.20724155e-02 -4.25059759e-05] [ 1.05785917e-02 -2.20724155e-02 4.25076862e-05] [ 1.73367429e-03 1.22450829e-09 -5.09600761e-10] [-1.92634557e-03 -5.31016504e-03 -1.05981206e-02] [-1.92634285e-03 5.31016348e-03 1.05981193e-02] [-3.69823443e-02 2.77284151e-10 1.27189408e-10] [ 5.21959189e-04 2.45105957e-02 2.54605281e-02] [ 5.21959925e-04 -2.45105961e-02 -2.54605277e-02] [ 5.49451361e-03 -1.76397836e-02 -1.61877761e-02] [ 2.95561445e-03 3.59926526e-03 -1.59657739e-02] [ 5.49451357e-03 1.76397837e-02 1.61877747e-02] [ 2.95561437e-03 -3.59926494e-03 1.59657749e-02]] Final stress: [-1.27719771e-04 -1.14658674e-04 3.52569197e-04 1.20732881e-03 4.41156895e-13 -4.20986025e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.67365352e-03 -1.12528290e-02 -3.62349708e-04] [-5.67365353e-03 1.12528290e-02 3.62350813e-04] [ 2.49100673e-03 3.26258546e-10 -1.45169719e-10] [-2.70965449e-03 1.48904960e-03 4.55072945e-03] [-2.70965406e-03 -1.48904984e-03 -4.55072968e-03] [ 9.85714503e-03 -4.51723751e-11 -2.73844186e-11] [ 4.39761370e-03 -7.71558787e-03 -1.55966573e-02] [ 4.39761394e-03 7.71558772e-03 1.55966573e-02] [-1.44051207e-03 7.54231750e-03 7.96676449e-03] [-7.47869824e-04 -1.34855096e-04 7.75151793e-03] [-1.44051210e-03 -7.54231732e-03 -7.96676511e-03] [-7.47869810e-04 1.34855021e-04 -7.75151810e-03]] Final stress: [ 2.36898162e-04 8.41018248e-05 -2.14290135e-05 -7.00604474e-04 -1.26746857e-14 5.79187654e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.67345036e-03 -1.12524380e-02 3.62344980e-04] [ 5.67345036e-03 1.12524381e-02 -3.62346908e-04] [-9.85696188e-03 -9.22440168e-11 4.04352029e-11] [-4.39747337e-03 7.71534621e-03 -1.55961866e-02] [-4.39747301e-03 -7.71534641e-03 1.55961864e-02] [-2.49092740e-03 6.61276254e-10 2.85934233e-10] [ 2.70953883e-03 -1.48895043e-03 4.55059343e-03] [ 2.70954033e-03 1.48894956e-03 -4.55059270e-03] [ 7.47879846e-04 1.34910916e-04 7.75134286e-03] [ 1.44054811e-03 -7.54190026e-03 7.96659396e-03] [ 7.47879800e-04 -1.34910722e-04 -7.75134295e-03] [ 1.44054803e-03 7.54190054e-03 -7.96659285e-03]] Final stress: [ 2.36886896e-04 8.40970912e-05 -2.14321888e-05 7.00581422e-04 3.36639915e-13 -1.61829979e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.05539072e-13 3.31251169e-02 -2.64771218e-10] [-7.34855217e-12 -1.26026709e-02 -1.74429528e-10] [ 1.99871512e-02 8.05789783e-03 1.85943080e-02] [ 5.43931112e-03 -2.80497682e-02 -5.22630560e-03] [-6.93262455e-03 1.91778820e-03 -1.77782917e-02] [-1.99871512e-02 8.05789804e-03 -1.85943079e-02] [ 6.93262423e-03 1.91778802e-03 1.77782919e-02] [-5.43931059e-03 -2.80497685e-02 5.22630584e-03] [ 9.17523184e-03 -4.41282838e-03 -1.91096411e-02] [ 4.89395376e-03 1.22256877e-02 -1.27253548e-02] [-4.89395388e-03 1.22256878e-02 1.27253547e-02] [-9.17523192e-03 -4.41282855e-03 1.91096411e-02]] Final stress: [-2.05175436e-04 -3.56279771e-05 3.47449576e-04 1.97310552e-13 -1.19907035e-03 6.09546770e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.05708858e-12 1.26025470e-02 1.45307194e-10] [-7.96622156e-12 -3.31247320e-02 2.30328422e-10] [ 1.99868298e-02 -8.05790131e-03 -1.85941458e-02] [-6.93247434e-03 -1.91760675e-03 1.77782293e-02] [ 5.43948601e-03 2.80497684e-02 5.22623787e-03] [-1.99868298e-02 -8.05790126e-03 1.85941458e-02] [-5.43948585e-03 2.80497684e-02 -5.22623795e-03] [ 6.93247457e-03 -1.91760689e-03 -1.77782293e-02] [-4.89325542e-03 -1.22253922e-02 -1.27257412e-02] [-9.17457841e-03 4.41222447e-03 -1.91100344e-02] [ 9.17457823e-03 4.41222442e-03 1.91100341e-02] [ 4.89325521e-03 -1.22253922e-02 1.27257411e-02]] Final stress: [-2.05187108e-04 -3.56320793e-05 3.47451579e-04 2.85681328e-13 1.19906844e-03 5.24100436e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.57053251e-11 -5.17866950e-03 1.07226912e-10] [-1.46299412e-11 1.67095999e-02 3.45560097e-10] [-3.37671910e-03 -3.01849252e-03 1.34965586e-02] [ 3.26289309e-03 1.98030278e-03 -1.01779848e-02] [-1.00139921e-02 -7.18724435e-03 1.59445286e-03] [ 3.37671910e-03 -3.01849272e-03 -1.34965587e-02] [ 1.00139929e-02 -7.18724390e-03 -1.59445321e-03] [-3.26289294e-03 1.98030268e-03 1.01779848e-02] [ 3.71726173e-03 5.92612497e-03 1.07791867e-02] [ 3.74413176e-03 -3.46615604e-03 5.04114150e-03] [-3.74413217e-03 -3.46615622e-03 -5.04114166e-03] [-3.71726220e-03 5.92612494e-03 -1.07791867e-02]] Final stress: [ 2.10113493e-04 1.15113251e-04 -2.10631945e-05 7.31670882e-13 -7.01563104e-04 -3.05969129e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.00729407e-11 -1.67095999e-02 -3.73298805e-11] [ 3.48797532e-12 5.17866948e-03 -6.55632518e-10] [-3.37671906e-03 3.01849210e-03 -1.34965584e-02] [-1.00139919e-02 7.18724442e-03 -1.59445275e-03] [ 3.26289204e-03 -1.98030216e-03 1.01779853e-02] [ 3.37671907e-03 3.01849211e-03 1.34965585e-02] [-3.26289258e-03 -1.98030247e-03 -1.01779850e-02] [ 1.00139920e-02 7.18724435e-03 1.59445282e-03] [-3.74413193e-03 3.46615612e-03 5.04114194e-03] [-3.71726185e-03 -5.92612515e-03 1.07791865e-02] [ 3.71726200e-03 -5.92612492e-03 -1.07791860e-02] [ 3.74413215e-03 3.46615600e-03 -5.04114206e-03]] Final stress: [ 2.10113494e-04 1.15113250e-04 -2.10631946e-05 -3.15402606e-13 7.01563104e-04 7.49644415e-13] Minimization converged after 46 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 0.06716373 -0.02525964 0.00042042] [-0.06716373 0.02525964 0.00042042] [ 0.18326407 -0.01978758 -0.11677832] [-0.10210872 0.13776326 0.09784851] [ 0.02298155 0.04583997 0.01117179] [-0.18326407 0.01978759 -0.11677832] [ 0.10210871 -0.13776327 0.09784851] [-0.02298154 -0.04583997 0.0111718 ] [-0.06651448 0.04125427 -0.09572271] [ 0.06651448 -0.04125427 -0.0957227 ] [ 0.07023466 -0.06602002 0.1030603 ] [-0.07023466 0.06602002 0.1030603 ]] Final stress: [ 7.34054135e-03 8.57356532e-03 1.60711540e-02 -6.99239014e-12 -1.74679890e-12 -2.17670937e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-0.06711867 -0.02524746 -0.00041938] [ 0.06711867 0.02524746 -0.00041937] [ 0.18308797 0.01969057 0.11668141] [ 0.022967 -0.04581892 -0.01116619] [-0.10195176 -0.13767288 -0.09777015] [-0.18308797 -0.01969054 0.11668142] [-0.02296702 0.04581891 -0.01116618] [ 0.10195177 0.13767287 -0.09777014] [ 0.07006959 0.06599156 -0.10286492] [-0.07006959 -0.06599156 -0.10286491] [-0.06643355 -0.0411145 0.0955392 ] [ 0.06643355 0.0411145 0.09553922]] Final stress: [ 7.33238139e-03 8.56088954e-03 1.60486553e-02 1.32582903e-11 -1.54718416e-11 2.20164412e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-3.55719995e-10 -1.54244782e-02 2.08038842e-08] [ 2.69861411e-10 1.54244784e-02 3.48441152e-08] [ 1.01042761e-02 7.51819484e-09 -3.05561235e-09] [ 4.30393875e-04 -2.14484746e-04 1.12422683e-02] [ 4.30416396e-04 2.14471953e-04 -1.12422785e-02] [-1.01042761e-02 -2.34204716e-08 -9.59168297e-09] [-4.30381169e-04 2.14492254e-04 1.12422622e-02] [-4.30423697e-04 -2.14467766e-04 -1.12422822e-02] [-2.24430405e-03 8.69561155e-03 -9.76522018e-03] [ 2.24430195e-03 -8.69560885e-03 -9.76523534e-03] [-2.24430383e-03 -8.69561269e-03 9.76522237e-03] [ 2.24430064e-03 8.69561404e-03 9.76522038e-03]] Final stress: [ 5.67094254e-04 -1.17106082e-04 3.91958567e-04 4.41857631e-12 4.74197055e-12 -1.25760970e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.66540115e-10 1.49569999e-02 -5.99860739e-09] [-3.09863177e-11 -1.49570000e-02 -3.11257315e-08] [-9.54376685e-03 -6.15750784e-10 3.57287977e-10] [-1.71622028e-03 3.35592332e-03 -1.13537285e-02] [-1.71623632e-03 -3.35591420e-03 1.13537357e-02] [ 9.54376661e-03 1.25899753e-08 5.27874211e-09] [ 1.71621876e-03 -3.35592421e-03 -1.13537275e-02] [ 1.71624938e-03 3.35590663e-03 1.13537418e-02] [ 1.50098802e-03 -1.04444560e-02 8.92570130e-03] [-1.50099398e-03 1.04444557e-02 8.92571943e-03] [ 1.50098681e-03 1.04444609e-02 -8.92570272e-03] [-1.50099195e-03 -1.04444640e-02 -8.92570817e-03]] Final stress: [-3.41583383e-04 2.45200101e-04 -8.34622479e-05 8.49407277e-12 -1.92866258e-12 2.76856573e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-4.04804398e-10 -9.88857182e-04 2.26426774e-08] [-7.48158757e-11 9.88857602e-04 -4.79323802e-08] [ 4.24181292e-04 -4.52328200e-08 1.96992092e-08] [ 7.85634208e-05 -7.01531896e-05 5.79098173e-04] [ 7.85127840e-05 7.01827531e-05 -5.79070863e-04] [-4.24181651e-04 -6.05857271e-08 -2.41629087e-08] [-7.84758076e-05 7.02037218e-05 5.79056102e-04] [-7.85872938e-05 -7.01393862e-05 -5.79107257e-04] [-1.61247833e-04 -1.34255021e-04 5.50777415e-05] [ 1.61243128e-04 1.34262280e-04 5.50469274e-05] [-1.61247049e-04 1.34251304e-04 -5.49869152e-05] [ 1.61239488e-04 -1.34247065e-04 -5.50841552e-05]] Final stress: [ 6.86646433e-05 4.75019621e-05 1.73309794e-04 1.04218068e-11 1.04929620e-11 -3.95912910e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.66951627e-10 -4.43786257e-03 3.70638727e-08] [-4.73639461e-10 4.43786206e-03 -2.11151389e-07] [ 2.64489664e-03 -1.28999104e-08 5.74745890e-09] [ 1.17977007e-04 2.27777639e-04 3.19041552e-03] [ 1.17951281e-04 -2.27762869e-04 -3.19040255e-03] [-2.64489752e-03 7.02958527e-08 2.93696504e-08] [-1.18009563e-04 -2.27797541e-04 3.19043188e-03] [-1.17910144e-04 2.27739887e-04 -3.19038290e-03] [-5.56285301e-04 3.13314465e-05 -4.40750057e-04] [ 5.56280111e-04 -3.13375640e-05 -4.40602031e-04] [-5.56282288e-04 -3.13436504e-05 4.40757321e-04] [ 5.56280517e-04 3.13357582e-05 4.40671782e-04]] Final stress: [ 1.64641892e-04 -1.88207212e-05 -7.05292280e-05 7.34783648e-12 -1.27408188e-11 -2.19366573e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 4.93897812e-10 1.00205835e-02 -5.45076473e-09] [-8.19763160e-10 -1.00205832e-02 1.46555873e-07] [-9.25782635e-03 7.05328327e-08 -2.99027567e-08] [ 2.04808511e-03 -1.65707592e-03 -6.40949285e-03] [ 2.04820175e-03 1.65700843e-03 6.40943540e-03] [ 9.25782718e-03 1.02479903e-08 3.96076951e-09] [-2.04817182e-03 1.65702633e-03 -6.40945157e-03] [-2.04813709e-03 -1.65704604e-03 6.40946685e-03] [ 2.15541968e-03 3.63065142e-04 4.62373170e-04] [-2.15540831e-03 -3.63064743e-04 4.62357490e-04] [ 2.15541778e-03 -3.63055830e-04 -4.62465464e-04] [-2.15540761e-03 3.63061571e-04 -4.62338187e-04]] Final stress: [-6.37370997e-04 8.99118019e-05 6.98643853e-05 -1.42287567e-11 1.23257402e-11 2.55267810e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.91480617e-10 4.38517402e-03 -1.92059690e-08] [-1.66849977e-09 -4.38517491e-03 2.49980967e-07] [-2.32982704e-03 1.03191799e-07 -4.23254670e-08] [-2.53906947e-05 4.63350463e-04 -2.84885207e-03] [-2.53010020e-05 -4.63403438e-04 2.84880617e-03] [ 2.32982780e-03 -4.45185971e-08 -1.84670222e-08] [ 2.53723719e-05 -4.63360212e-04 -2.84884257e-03] [ 2.53380395e-05 4.63380644e-04 2.84882415e-03] [ 8.47454445e-04 -1.63958981e-04 -8.74170732e-04] [-8.47466659e-04 1.63948618e-04 -8.74270513e-04] [ 8.47448938e-04 1.63982662e-04 8.74091003e-04] [-8.47454826e-04 -1.63997538e-04 8.74244581e-04]] Final stress: [-1.97279159e-04 5.24778209e-05 -1.36754585e-04 1.71193347e-11 -2.02962137e-11 1.51263555e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.03099728e-02 -2.29696528e-02 -6.70081350e-05] [-1.03099728e-02 2.29696528e-02 6.70086634e-05] [-6.95221639e-03 -1.18666562e-10 3.79552169e-11] [ 3.27443084e-03 2.71118110e-03 1.11705409e-02] [ 3.27443087e-03 -2.71118112e-03 -1.11705410e-02] [ 4.01931650e-02 -1.85650110e-10 -7.89696094e-11] [-1.07559311e-03 -2.09949780e-02 -2.39869563e-02] [-1.07559293e-03 2.09949779e-02 2.39869563e-02] [-6.76260085e-03 1.54945400e-02 -1.60571506e-02] [-1.74673848e-03 -1.27135812e-03 -1.58307787e-02] [-6.76260092e-03 -1.54945397e-02 1.60571504e-02] [-1.74673853e-03 1.27135824e-03 1.58307785e-02]] Final stress: [-3.23069523e-05 -2.08553489e-04 3.48552736e-04 -1.20288342e-03 3.23557812e-13 3.20784011e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.03117673e-02 -2.29742554e-02 6.68400193e-05] [ 1.03117673e-02 2.29742554e-02 -6.68389901e-05] [-4.02000598e-02 2.74303410e-10 -1.09284683e-10] [ 1.07755401e-03 2.10003157e-02 -2.39894440e-02] [ 1.07755380e-03 -2.10003155e-02 2.39894441e-02] [ 6.95528413e-03 -4.98698649e-10 -2.01357413e-10] [-3.27616422e-03 -2.71404470e-03 1.11731209e-02] [-3.27616518e-03 2.71404524e-03 -1.11731214e-02] [ 1.74665038e-03 1.27019119e-03 -1.58297043e-02] [ 6.76258089e-03 -1.55029712e-02 -1.60562842e-02] [ 1.74665042e-03 -1.27019123e-03 1.58297045e-02] [ 6.76258099e-03 1.55029708e-02 1.60562837e-02]] Final stress: [-3.23170045e-05 -2.08524557e-04 3.48567352e-04 1.20301522e-03 -3.38768188e-13 7.36897858e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.72300922e-03 1.08542938e-02 3.60501822e-04] [-5.72300921e-03 -1.08542938e-02 -3.60503669e-04] [ 1.48664449e-02 -3.98539052e-10 1.68119588e-10] [ 9.59659243e-04 -3.45569251e-03 1.58530726e-02] [ 9.59659131e-04 3.45569258e-03 -1.58530725e-02] [-2.13150515e-03 5.42165447e-10 2.30555903e-10] [-4.04344193e-05 -3.30070552e-03 -4.25942016e-03] [-4.04338757e-05 3.30070520e-03 4.25942045e-03] [-1.09947470e-03 -9.50775903e-04 7.78444359e-03] [-4.64210975e-04 8.16853526e-03 8.00571635e-03] [-1.09947466e-03 9.50775684e-04 -7.78444320e-03] [-4.64211045e-04 -8.16853494e-03 -8.00571568e-03]] Final stress: [ 1.15078191e-04 2.07108316e-04 -2.14405645e-05 -7.02442847e-04 1.70507144e-13 -1.15170595e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.72300920e-03 1.08542937e-02 -3.60503107e-04] [ 5.72300920e-03 -1.08542938e-02 3.60502386e-04] [ 2.13150515e-03 2.32761899e-10 -8.38359985e-11] [ 4.04345332e-05 3.30070558e-03 -4.25942013e-03] [ 4.04338303e-05 -3.30070518e-03 4.25942044e-03] [-1.48664449e-02 3.91407694e-10 1.53801647e-10] [-9.59659144e-04 3.45569257e-03 1.58530726e-02] [-9.59658723e-04 -3.45569282e-03 -1.58530724e-02] [ 4.64210746e-04 -8.16853510e-03 8.00571602e-03] [ 1.09947458e-03 9.50775500e-04 7.78444345e-03] [ 4.64210782e-04 8.16853496e-03 -8.00571601e-03] [ 1.09947473e-03 -9.50776108e-04 -7.78444332e-03]] Final stress: [ 1.15078192e-04 2.07108315e-04 -2.14405644e-05 7.02442847e-04 -6.31592901e-13 9.59372954e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.05637703e-12 -1.13509902e-02 -3.08387931e-10] [-6.35491110e-12 3.23428942e-02 -3.50918581e-10] [-2.23956959e-02 7.77399349e-04 2.22011079e-02] [ 1.50091005e-02 1.40015234e-03 -1.63591677e-02] [-9.47504015e-03 -2.16291359e-02 -1.57294027e-03] [ 2.23956959e-02 7.77399705e-04 -2.22011077e-02] [ 9.47503985e-03 -2.16291361e-02 1.57294040e-03] [-1.50091001e-02 1.40015206e-03 1.63591679e-02] [ 5.75307611e-03 1.50493691e-02 -1.28465862e-02] [ 8.42629783e-03 -6.09373672e-03 -1.91119341e-02] [-8.42629794e-03 -6.09373670e-03 1.91119342e-02] [-5.75307618e-03 1.50493690e-02 1.28465863e-02]] Final stress: [-1.12408427e-04 -1.28309544e-04 3.48572535e-04 1.54118609e-13 -1.19102713e-03 1.53364644e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.00937183e-11 -3.23393600e-02 -5.36225474e-10] [-7.76441514e-13 1.13492805e-02 3.95126758e-10] [-2.23916628e-02 -7.76368786e-04 -2.21992880e-02] [-9.47541582e-03 2.16250607e-02 1.57199875e-03] [ 1.50063665e-02 -1.40012776e-03 1.63578812e-02] [ 2.23916628e-02 -7.76368531e-04 2.21992881e-02] [-1.50063672e-02 -1.40012813e-03 -1.63578810e-02] [ 9.47541631e-03 2.16250604e-02 -1.57199854e-03] [-8.42622181e-03 6.09390321e-03 -1.91102398e-02] [-5.75298860e-03 -1.50474275e-02 -1.28448212e-02] [ 5.75298865e-03 -1.50474273e-02 1.28448205e-02] [ 8.42622193e-03 6.09390302e-03 1.91102400e-02]] Final stress: [-1.12355254e-04 -1.28270629e-04 3.48544811e-04 -1.13636246e-13 1.19091217e-03 8.71208259e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.10794882e-11 1.69670455e-02 -4.11355132e-11] [ 8.21238728e-12 -5.65747710e-03 -5.22621463e-11] [ 9.04113347e-03 5.56780946e-03 9.77417492e-03] [ 4.72910037e-04 -6.66099214e-03 -2.00705368e-03] [ 5.85294928e-04 -5.94191496e-03 -1.27247194e-02] [-9.04113346e-03 5.56780952e-03 -9.77417490e-03] [-5.85295486e-04 -5.94191528e-03 1.27247197e-02] [-4.72910121e-04 -6.66099208e-03 2.00705364e-03] [ 3.60859894e-03 -3.10222784e-03 4.97882716e-03] [ 3.60278243e-03 4.48254132e-03 1.07536437e-02] [-3.60278214e-03 4.48254150e-03 -1.07536438e-02] [-3.60859861e-03 -3.10222787e-03 -4.97882723e-03]] Final stress: [ 8.83605264e-05 2.34491253e-04 -2.09100745e-05 -5.00081841e-13 -7.03075816e-04 4.38430534e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.77562861e-12 5.65786354e-03 -2.04349128e-10] [-6.49750639e-12 -1.69682466e-02 2.66747364e-10] [ 9.04174874e-03 -5.56811641e-03 -9.77477777e-03] [ 5.85307762e-04 5.94227094e-03 1.27254786e-02] [ 4.72860419e-04 6.66120043e-03 2.00716123e-03] [-9.04174874e-03 -5.56811633e-03 9.77477780e-03] [-4.72860351e-04 6.66120047e-03 -2.00716126e-03] [-5.85307512e-04 5.94227079e-03 -1.27254785e-02] [-3.60331390e-03 -4.48283890e-03 1.07541565e-02] [-3.60904009e-03 3.10267552e-03 4.97898500e-03] [ 3.60903994e-03 3.10267550e-03 -4.97898530e-03] [ 3.60331375e-03 -4.48283896e-03 -1.07541563e-02]] Final stress: [ 8.83705853e-05 2.34513865e-04 -2.09033287e-05 2.60188080e-13 7.03122020e-04 9.21212024e-14] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 0.07630222 0.04411445 0.00025451] [-0.07630222 -0.04411445 0.00025448] [ 0.07436876 0.01064823 -0.07057109] [-0.02712385 0.04094139 -0.00385277] [-0.04101789 -0.04124586 0.07152045] [-0.07436876 -0.01064815 -0.07057106] [ 0.02712381 -0.04094142 -0.00385274] [ 0.04101796 0.04124583 0.07152048] [ 0.06492683 0.00092754 -0.0108681 ] [-0.06492684 -0.00092755 -0.01086804] [-0.03255207 -0.07280239 0.01351693] [ 0.03255206 0.07280239 0.01351696]] Final stress: [ 1.67240221e-03 7.28931033e-03 8.89188068e-03 -3.99282285e-11 1.38044325e-11 -4.54910136e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-0.07626015 0.04409061 -0.00025447] [ 0.07626016 -0.04409061 -0.00025451] [ 0.07424396 -0.01062829 0.07042911] [-0.0409445 0.04115929 -0.07138907] [-0.02709095 -0.04088237 0.0038597 ] [-0.07424396 0.01062819 0.07042907] [ 0.04094458 -0.04115924 -0.07138911] [ 0.02709085 0.04088243 0.00385965] [-0.03251591 0.07267871 -0.01351038] [ 0.03251592 -0.07267871 -0.01351043] [ 0.06480464 -0.00094873 0.01086525] [-0.06480463 0.00094872 0.01086517]] Final stress: [ 1.66723044e-03 7.28198423e-03 8.88606741e-03 -8.25005903e-11 -3.06246530e-11 4.54747581e-03] Minimization converged after 4 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.44017229e-02 -1.35660612e-03 -2.19151499e-05] [-1.44017229e-02 1.35660612e-03 2.19152950e-05] [ 4.03535926e-02 -2.87316595e-11 1.37988039e-11] [ 1.87665831e-03 -3.25842662e-02 3.04215153e-02] [ 1.87665826e-03 3.25842662e-02 -3.04215153e-02] [ 5.49381735e-02 -1.70566604e-10 -6.50776089e-11] [-3.53218013e-03 -2.34451699e-02 -2.71363718e-02] [-3.53218065e-03 2.34451702e-02 2.71363715e-02] [-1.67838106e-02 1.00944002e-02 -4.24508687e-03] [-1.48048274e-02 1.57646319e-02 -4.20959821e-03] [-1.67838106e-02 -1.00944004e-02 4.24508710e-03] [-1.48048274e-02 -1.57646319e-02 4.20959808e-03]] Final stress: [-2.45375907e-04 -4.44147582e-04 3.35323932e-04 -2.00402989e-03 -1.03972312e-13 -2.41720205e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.44042698e-02 -1.35720375e-03 2.19320832e-05] [ 1.44042698e-02 1.35720375e-03 -2.19318326e-05] [-5.49609190e-02 -1.64204661e-10 6.55270771e-11] [ 3.54041254e-03 2.34592710e-02 -2.71397356e-02] [ 3.54041268e-03 -2.34592711e-02 2.71397355e-02] [-4.03707616e-02 -1.67224953e-10 -6.70318578e-11] [-1.86999630e-03 3.26018493e-02 3.04264264e-02] [-1.86999682e-03 -3.26018490e-02 -3.04264267e-02] [ 1.48054471e-02 -1.57644268e-02 -4.21730476e-03] [ 1.67857073e-02 -1.00915099e-02 -4.25282506e-03] [ 1.48054471e-02 1.57644267e-02 4.21730495e-03] [ 1.67857073e-02 1.00915101e-02 4.25282491e-03]] Final stress: [-2.45488255e-04 -4.44357102e-04 3.35524992e-04 2.00458476e-03 5.28696339e-14 -7.55231214e-13] Minimization converged after 41 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.28171994e-12 1.57547744e-02 -5.58607022e-12] [-7.03972456e-12 1.30435727e-02 -5.68182614e-11] [-4.64747068e-03 1.69533515e-02 3.31672447e-02] [ 3.12768815e-02 -3.72387822e-02 -1.83149692e-02] [-2.47482011e-02 -2.56998596e-02 -1.50294769e-02] [ 4.64747068e-03 1.69533516e-02 -3.31672447e-02] [ 2.47482010e-02 -2.56998596e-02 1.50294769e-02] [-3.12768815e-02 -3.72387822e-02 1.83149693e-02] [ 1.39193491e-02 1.86247211e-02 -4.28680319e-03] [ 1.19428028e-02 1.29613956e-02 -4.15246492e-03] [-1.19428028e-02 1.29613956e-02 4.15246492e-03] [-1.39193490e-02 1.86247211e-02 4.28680314e-03]] Final stress: [-4.43928865e-04 -2.45272879e-04 3.35123281e-04 -1.09788455e-14 -2.00347540e-03 6.30753144e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.33999086e-12 -1.30396886e-02 -6.42263338e-13] [-4.80789431e-12 -1.57485091e-02 3.86958073e-10] [-4.64425858e-03 -1.69203279e-02 -3.31577996e-02] [-2.47194023e-02 2.56824277e-02 1.50261786e-02] [ 3.12424451e-02 3.72131020e-02 1.83085834e-02] [ 4.64425859e-03 -1.69203281e-02 3.31577996e-02] [-3.12424448e-02 3.72131022e-02 -1.83085835e-02] [ 2.47194024e-02 2.56824276e-02 -1.50261785e-02] [-1.19471693e-02 -1.29615606e-02 -4.13718215e-03] [-1.39211723e-02 -1.86195422e-02 -4.27133750e-03] [ 1.39211721e-02 -1.86195422e-02 4.27133721e-03] [ 1.19471691e-02 -1.29615606e-02 4.13718221e-03]] Final stress: [-4.43510527e-04 -2.45048182e-04 3.34723221e-04 3.25018259e-13 2.00236878e-03 -2.46716023e-15] Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 0.01031353 0.00026043 -0.00026024] [-0.01031353 -0.00026043 -0.00026021] [ 0.00603772 -0.00099602 -0.00615933] [-0.00263258 0.00757827 0.00379079] [ 0.00042979 -0.00310148 0.00257468] [-0.00603772 0.00099601 -0.00615933] [ 0.00263258 -0.00757827 0.00379079] [-0.0004298 0.00310148 0.00257468] [ 0.00298298 -0.00178672 -0.00054443] [-0.00298298 0.00178672 -0.00054444] [ 0.00093093 -0.00218626 0.00059852] [-0.00093093 0.00218626 0.00059853]] Final stress: [ 3.19625492e-04 3.89688404e-04 3.83876635e-04 5.36486932e-13 -1.85888042e-14 -3.49351566e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.01031336 0.00026044 0.00026024] [ 0.01031336 -0.00026044 0.00026023] [ 0.00603787 0.00099639 0.00615913] [ 0.00042992 0.00310107 -0.00257468] [-0.00263333 -0.00757866 -0.00379059] [-0.00603787 -0.00099639 0.00615913] [-0.00042993 -0.00310107 -0.00257468] [ 0.00263333 0.00757865 -0.00379059] [ 0.00093098 0.00218597 -0.00059846] [-0.00093098 -0.00218597 -0.00059845] [ 0.00298248 0.00178632 0.00054436] [-0.00298248 -0.00178632 0.00054436]] Final stress: [3.19636450e-04 3.89695678e-04 3.83879777e-04 5.97278887e-13 3.54243659e-13 3.49350660e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.02140853 0.00196653 0.00035355] [-0.02140853 -0.00196653 0.00035357] [-0.01176821 -0.00328034 -0.0234647 ] [ 0.00214906 -0.00479563 0.01171198] [ 0.01895718 0.02613401 0.01102719] [ 0.01176821 0.00328033 -0.0234647 ] [-0.00214906 0.00479563 0.01171198] [-0.01895719 -0.026134 0.01102719] [ 0.0072858 -0.00199487 0.00141379] [-0.0072858 0.00199487 0.00141377] [ 0.00296132 -0.01127009 -0.00104181] [-0.00296132 0.01127009 -0.00104181]] Final stress: [-1.10698478e-03 -7.47585568e-04 -1.37484070e-04 1.30798953e-12 1.18757602e-12 -9.31760392e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.02141715 0.00196932 -0.00035391] [ 0.02141715 -0.00196932 -0.0003539 ] [-0.0117653 0.00328165 0.02348304] [ 0.01895744 -0.02615178 -0.01103969] [ 0.00213814 0.00479765 -0.0117168 ] [ 0.0117653 -0.00328166 0.02348304] [-0.01895743 0.02615178 -0.01103969] [-0.00213815 -0.00479764 -0.0117168 ] [ 0.00295535 0.01128252 0.00104045] [-0.00295535 -0.01128252 0.00104044] [ 0.00728562 0.00199184 -0.00141309] [-0.00728562 -0.00199184 -0.00141309]] Final stress: [-1.10723596e-03 -7.47560441e-04 -1.36982526e-04 -1.86221239e-12 -1.61004582e-13 9.32314931e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.48907835e-02 -2.50529828e-02 -2.55117106e-03] [ 7.48907835e-02 2.50529828e-02 2.55117094e-03] [-2.17165915e-01 -3.55348459e-11 1.36207703e-11] [-2.95943403e-02 4.60046730e-02 -3.09713160e-02] [-2.95943404e-02 -4.60046729e-02 3.09713161e-02] [-7.62600485e-02 -1.68245142e-11 -1.09103080e-11] [-4.57644464e-02 7.31015513e-02 4.21541332e-02] [-4.57644464e-02 -7.31015513e-02 -4.21541332e-02] [ 5.02731409e-02 2.34029839e-01 -2.36788799e-02] [ 9.69078439e-02 3.41415952e-01 -2.52279385e-02] [ 5.02731409e-02 -2.34029839e-01 2.36788800e-02] [ 9.69078440e-02 -3.41415952e-01 2.52279385e-02]] Final stress: [-4.56920240e-04 -3.56871437e-03 3.72970713e-03 -5.75219355e-03 -1.88086625e-14 1.49441554e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.48907831e-02 -2.50529827e-02 2.55117095e-03] [-7.48907831e-02 2.50529827e-02 -2.55117101e-03] [ 7.62600480e-02 -4.40867741e-11 1.56402545e-11] [ 4.57644465e-02 -7.31015508e-02 4.21541328e-02] [ 4.57644464e-02 7.31015509e-02 -4.21541327e-02] [ 2.17165914e-01 8.43962949e-12 -5.99832928e-13] [ 2.95943404e-02 -4.60046725e-02 -3.09713156e-02] [ 2.95943404e-02 4.60046725e-02 3.09713156e-02] [-9.69078438e-02 -3.41415953e-01 -2.52279384e-02] [-5.02731409e-02 -2.34029840e-01 -2.36788798e-02] [-9.69078438e-02 3.41415953e-01 2.52279384e-02] [-5.02731409e-02 2.34029840e-01 2.36788798e-02]] Final stress: [-4.56920241e-04 -3.56871435e-03 3.72970711e-03 5.75219353e-03 -1.01920230e-13 3.20778138e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.01917779 -0.0139092 0.00016989] [ 0.0086445 -0.01391287 -0.0001699 ] [-0.03046005 0.03068659 0.00405843] [ 0.01219975 -0.04454094 0.00436922] [-0.02279509 0.04431959 -0.0075181 ] [ 0.03790492 0.0315424 -0.01027349] [-0.02737402 0.02485261 -0.00126184] [-0.05160951 -0.0047266 0.01062577] [ 0.12656924 0.08341062 0.00453517] [ 0.10420986 0.09305653 0.00386628] [-0.09939969 -0.12024576 -0.00379983] [-0.07706769 -0.11053296 -0.00460161]] Final stress: [-2.00916071e-03 -2.00897308e-03 -2.33298656e-07 -2.03215800e-03 -2.03215994e-03 -3.40358737e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.00864259 0.0139106 0.00016988] [ 0.01917515 0.01390693 -0.00016988] [-0.0304524 -0.03068836 -0.00406008] [-0.02279922 -0.04431727 0.00752041] [ 0.01220094 0.04454422 -0.00436978] [ 0.03790702 -0.03154411 0.01027509] [-0.05161132 0.00472496 -0.01062805] [-0.02736961 -0.02484368 0.00126242] [-0.09939911 0.12024314 0.00379994] [-0.07706859 0.11053105 0.00460164] [ 0.12656623 -0.08341114 -0.00453521] [ 0.10420833 -0.09305634 -0.00386638]] Final stress: [-2.00899403e-03 -2.00880643e-03 -2.10198417e-07 -2.03209629e-03 2.03209823e-03 3.40337663e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.01917515 -0.01390692 -0.00016988] [-0.00864259 -0.0139106 0.00016988] [-0.03790702 0.03154411 0.01027509] [ 0.05161132 -0.00472496 -0.01062805] [ 0.02736961 0.02484368 0.00126242] [ 0.0304524 0.03068836 -0.00406008] [ 0.02279922 0.04431727 0.00752041] [-0.01220094 -0.04454422 -0.00436978] [ 0.07706859 -0.11053105 0.00460164] [ 0.09939911 -0.12024314 0.00379994] [-0.10420833 0.09305634 -0.00386638] [-0.12656623 0.08341114 -0.00453521]] Final stress: [-2.00899400e-03 -2.00880640e-03 -2.10194956e-07 2.03209628e-03 -2.03209822e-03 3.40337658e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.00864578 0.01391439 -0.00016991] [-0.01917955 0.01391072 0.00016991] [-0.03790351 -0.03154125 -0.01027242] [ 0.02737696 -0.02485857 -0.00126144] [ 0.05160831 0.0047277 0.01062425] [ 0.03046515 -0.03068541 0.00405733] [-0.01219896 0.04453874 0.00436884] [ 0.02279234 -0.04432114 -0.00751657] [-0.10421087 -0.09305665 0.00386622] [-0.12657124 -0.08341028 0.00453515] [ 0.07706709 0.11053423 -0.0046016 ] [ 0.09940007 0.12024751 -0.00379976]] Final stress: [-2.00927194e-03 -2.00908429e-03 -2.48758302e-07 2.03219915e-03 2.03220109e-03 -3.40372788e-04] Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 64 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.74502736e-12 -4.98096158e-02 3.97179340e-11] [-2.96241095e-12 -1.00105208e-01 -1.06447764e-10] [ 2.48563932e-03 1.90087538e-03 -4.67722169e-02] [-3.44793429e-02 6.51942812e-02 1.12760888e-02] [ 8.59753091e-02 1.55653106e-01 2.23903800e-02] [-2.48563933e-03 1.90087540e-03 4.67722169e-02] [-8.59753091e-02 1.55653106e-01 -2.23903799e-02] [ 3.44793430e-02 6.51942811e-02 -1.12760888e-02] [ 3.11730298e-01 -2.06711981e-02 -3.02002365e-02] [ 2.65541872e-01 -1.27119652e-01 -1.91771276e-02] [-2.65541872e-01 -1.27119652e-01 1.91771277e-02] [-3.11730298e-01 -2.06711981e-02 3.02002365e-02]] Final stress: [-3.56472818e-03 -4.44822812e-04 3.76364103e-03 6.06033406e-14 -5.76920315e-03 3.42356804e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.07961745e-12 1.00105610e-01 -2.65804499e-11] [ 5.05211091e-12 4.98098540e-02 1.15569145e-10] [ 2.48571280e-03 -1.90063475e-03 4.67725835e-02] [ 8.59757085e-02 -1.55653573e-01 -2.23905425e-02] [-3.44796221e-02 -6.51945358e-02 -1.12762304e-02] [-2.48571279e-03 -1.90063476e-03 -4.67725835e-02] [ 3.44796222e-02 -6.51945357e-02 1.12762304e-02] [-8.59757084e-02 -1.55653573e-01 2.23905425e-02] [-2.65541458e-01 1.27119896e-01 -1.91771840e-02] [-3.11730039e-01 2.06711164e-02 -3.02003471e-02] [ 3.11730039e-01 2.06711164e-02 3.02003470e-02] [ 2.65541458e-01 1.27119896e-01 1.91771840e-02]] Final stress: [-3.56473709e-03 -4.44821496e-04 3.76365326e-03 4.65475764e-14 5.76921687e-03 -3.38006926e-14] Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 1.05956908e-03 -9.73174857e-05 4.20808651e-04] [-1.05956906e-03 9.73175072e-05 4.20807434e-04] [ 3.72495466e-03 5.10503517e-04 -6.64515087e-04] [ 4.67479262e-04 5.87051882e-03 1.50002589e-03] [ 1.54368384e-03 -5.33774882e-03 -1.29311242e-03] [-3.72495465e-03 -5.10503709e-04 -6.64515163e-04] [-4.67479475e-04 -5.87051894e-03 1.50002600e-03] [-1.54368380e-03 5.33774883e-03 -1.29311240e-03] [ 3.11878650e-03 -1.46282398e-03 9.94400192e-03] [-3.11878633e-03 1.46282414e-03 9.94400254e-03] [ 2.37714755e-03 6.18550075e-04 -9.90720842e-03] [-2.37714759e-03 -6.18549963e-04 -9.90720894e-03]] Final stress: [ 2.62526503e-04 3.10680478e-04 -2.40152295e-05 1.09468699e-14 5.39270781e-13 -9.26812048e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.05956904e-03 -9.73174931e-05 -4.20806737e-04] [ 1.05956906e-03 9.73174791e-05 -4.20806928e-04] [ 3.72495454e-03 -5.10504245e-04 6.64515369e-04] [ 1.54368421e-03 5.33774891e-03 1.29311256e-03] [ 4.67478858e-04 -5.87051846e-03 -1.50002569e-03] [-3.72495452e-03 5.10501812e-04 6.64514389e-04] [-1.54368215e-03 -5.33774773e-03 1.29311159e-03] [-4.67480963e-04 5.87051969e-03 -1.50002670e-03] [ 2.37714749e-03 -6.18550118e-04 9.90720900e-03] [-2.37714747e-03 6.18550070e-04 9.90720758e-03] [ 3.11878627e-03 1.46282405e-03 -9.94400141e-03] [-3.11878629e-03 -1.46282396e-03 -9.94400303e-03]] Final stress: [ 2.62526497e-04 3.10680469e-04 -2.40152301e-05 -3.85049153e-13 7.25704462e-14 9.26811593e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 8.09352585e-13 5.15597072e-03 -1.08250939e-08] [ 1.53038179e-10 -5.15597131e-03 -1.12499105e-07] [-1.42936294e-03 -3.35897599e-09 2.60394586e-09] [-7.48211605e-04 1.91290255e-03 -3.30809893e-03] [-7.48248134e-04 -1.91288178e-03 3.30811755e-03] [ 1.42936251e-03 2.11117684e-08 9.57860898e-09] [ 7.48214445e-04 -1.91290142e-03 -3.30809991e-03] [ 7.48250613e-04 1.91288051e-03 3.30811887e-03] [ 8.99399478e-04 -5.72223511e-04 -1.09424501e-03] [-8.99404127e-04 5.72215612e-04 -1.09419334e-03] [ 8.99399531e-04 5.72223329e-04 1.09427797e-03] [-8.99399925e-04 -5.72232458e-04 1.09423395e-03]] Final stress: [-5.20967750e-05 2.36266878e-04 9.34766039e-05 3.18211961e-12 -1.43543214e-11 3.52534936e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.18459459e-10 -5.83566202e-03 4.13048261e-08] [-1.55445540e-09 5.83566257e-03 -1.38185441e-07] [ 1.32765654e-03 -2.70720230e-08 1.20984861e-08] [ 6.20893929e-04 -1.75867576e-03 3.73268884e-03] [ 6.20811912e-04 1.75872262e-03 -3.73264941e-03] [-1.32765744e-03 -2.48298435e-08 -9.18020994e-09] [-6.20845613e-04 1.75870331e-03 3.73266622e-03] [-6.20825635e-04 -1.75871399e-03 -3.73265717e-03] [-1.41736260e-03 -1.40836220e-04 6.82676968e-04] [ 1.41734848e-03 1.40847788e-04 6.82734409e-04] [-1.41737093e-03 1.40870806e-04 -6.82627160e-04] [ 1.41735314e-03 -1.40867194e-04 -6.82738733e-04]] Final stress: [ 1.06942059e-04 -2.49480899e-04 -2.52578687e-05 2.92755357e-11 1.41997645e-11 1.11438064e-10] Minimization converged after 2 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 7.06744219e-10 1.71821576e-03 -4.63927896e-09] [ 7.76192957e-10 -1.71821606e-03 -6.77437488e-08] [-4.70026408e-04 -5.54925772e-09 2.66423703e-09] [-1.59035316e-04 5.05304758e-04 -1.08990299e-03] [-1.59053608e-04 -5.05294297e-04 1.08991212e-03] [ 4.70026629e-04 2.22810571e-08 9.43021164e-09] [ 1.59007635e-04 -5.05321301e-04 -1.08989032e-03] [ 1.59039513e-04 5.05302865e-04 1.08990623e-03] [ 4.06867919e-04 1.30277539e-04 1.55539155e-04] [-4.06848870e-04 -1.30286721e-04 1.55575948e-04] [ 4.06868743e-04 -1.30281268e-04 -1.55528612e-04] [-4.06847720e-04 1.30281986e-04 -1.55551241e-04]] Final stress: [ 3.95419934e-07 9.47877199e-05 1.16125622e-04 -3.35984547e-11 -6.71927660e-12 2.15791779e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-9.76152492e-12 2.99517635e-03 -1.87129734e-09] [ 1.84483623e-10 -2.99517621e-03 -6.23660832e-08] [-1.81022583e-04 -2.11406248e-08 8.74931630e-09] [ 3.78187791e-04 1.89550955e-03 -1.77534742e-03] [ 3.78157557e-04 -1.89549198e-03 1.77536215e-03] [ 1.81022395e-04 1.23270152e-08 5.17210945e-09] [-3.78184216e-04 -1.89550768e-03 -1.77534919e-03] [-3.78162523e-04 1.89549514e-03 1.77535970e-03] [ 1.81149857e-03 1.00524937e-03 -1.50780939e-03] [-1.81149742e-03 -1.00524771e-03 -1.50778500e-03] [ 1.81149854e-03 -1.00524920e-03 1.50782600e-03] [-1.81149829e-03 1.00525120e-03 1.50779347e-03]] Final stress: [-5.36514280e-05 1.77266155e-04 -9.08918858e-06 -1.53918187e-12 2.95236604e-12 -6.71278227e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.74557729e-10 -6.42238568e-03 -9.33144517e-09] [ 4.98631525e-10 6.42238535e-03 5.01105481e-08] [-4.27286878e-03 5.23786647e-09 -2.10586490e-09] [ 4.74576134e-03 -6.00291047e-03 4.53762475e-03] [ 4.74576913e-03 6.00290594e-03 -4.53762836e-03] [ 4.27286898e-03 -1.31411604e-08 -5.60479075e-09] [-4.74575331e-03 6.00291517e-03 4.53762066e-03] [-4.74578986e-03 -6.00289429e-03 -4.53763791e-03] [-6.80998293e-04 9.67872651e-04 -1.16177094e-03] [ 6.81003196e-04 -9.67878225e-04 -1.16180798e-03] [-6.80996455e-04 -9.67880171e-04 1.16177381e-03] [ 6.81003374e-04 9.67877620e-04 1.16179291e-03]] Final stress: [-1.54220999e-04 -6.14333523e-04 -4.03223631e-05 -1.10880194e-11 -6.00347975e-12 -1.41045883e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.25235036e-09 -1.16337716e-03 -2.48812931e-08] [-2.77152290e-09 1.16338145e-03 4.28133464e-07] [ 2.47132782e-04 4.86397165e-08 -2.37111789e-08] [ 5.91694599e-05 -3.82375896e-04 6.67765252e-04] [ 5.94235353e-05 3.82231349e-04 -6.67886817e-04] [-2.47133694e-04 -7.54154066e-08 -3.17740177e-08] [-5.91493178e-05 3.82392061e-04 6.67757623e-04] [-5.92270832e-05 -3.82346499e-04 -6.67797901e-04] [-3.55342227e-04 -5.37640087e-05 -7.63017480e-05] [ 3.55253093e-04 5.38507723e-05 -7.64764771e-05] [-3.55349739e-04 5.37925078e-05 7.61704357e-05] [ 3.55230214e-04 -5.37578035e-05 7.64218649e-05]] Final stress: [-5.33667826e-06 -6.03381862e-05 -9.04699468e-05 1.75818746e-10 1.01686425e-10 -1.33948194e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-9.66019187e-03 2.34945805e-02 -1.23106352e-03] [-9.66019188e-03 -2.34945805e-02 1.23106204e-03] [ 5.01427854e-02 9.54845782e-12 8.96708925e-12] [-5.14577016e-03 -2.82379186e-02 2.95864753e-02] [-5.14577101e-03 2.82379191e-02 -2.95864749e-02] [-1.47314931e-03 5.69949362e-10 2.28891687e-10] [-3.55308013e-03 -4.20425994e-03 -7.10726948e-03] [-3.55307948e-03 4.20425957e-03 7.10726980e-03] [-6.41722849e-04 -8.10030063e-03 -1.64592048e-02] [-5.33405301e-03 -2.72334220e-03 -1.79676200e-02] [-6.41722805e-04 8.10030044e-03 1.64592049e-02] [-5.33405288e-03 2.72334174e-03 1.79676203e-02]] Final stress: [-4.73779119e-05 2.09694863e-04 5.82454976e-04 -1.90398887e-03 -4.97400282e-13 5.51185218e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 9.65652890e-03 2.34778364e-02 1.23076118e-03] [ 9.65652890e-03 -2.34778364e-02 -1.23076136e-03] [ 1.45902384e-03 1.16804063e-10 -3.56232374e-11] [ 3.55200797e-03 4.22017126e-03 -7.10148885e-03] [ 3.55200792e-03 -4.22017123e-03 7.10148889e-03] [-5.01302968e-02 2.35211471e-10 8.98056135e-11] [ 5.14009975e-03 2.82197254e-02 2.95823897e-02] [ 5.14009928e-03 -2.82197252e-02 -2.95823898e-02] [ 5.33502565e-03 2.77965909e-03 -1.79983321e-02] [ 6.51974389e-04 8.10900107e-03 -1.64901966e-02] [ 5.33502576e-03 -2.77965957e-03 1.79983323e-02] [ 6.51974427e-04 -8.10900121e-03 1.64901966e-02]] Final stress: [-4.74153772e-05 2.10064681e-04 5.83012490e-04 1.90396462e-03 -5.67162752e-13 -7.39392634e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.99760144e-11 3.53051396e-02 -2.10874537e-10] [ 1.07626616e-11 -1.65480175e-02 -3.46389543e-11] [ 2.81656886e-02 1.06203038e-02 2.12302709e-02] [ 1.83526531e-02 -2.55097522e-02 -7.72742604e-05] [-1.75857338e-02 -1.50795414e-04 -1.82408449e-02] [-2.81656885e-02 1.06203030e-02 -2.12302712e-02] [ 1.75857340e-02 -1.50795320e-04 1.82408448e-02] [-1.83526543e-02 -2.55097515e-02 7.72737722e-05] [-7.32138607e-04 4.72799880e-03 -1.71226938e-02] [-9.98127550e-03 9.33683828e-04 -1.72541852e-02] [ 9.98127598e-03 9.33683979e-04 1.72541857e-02] [ 7.32139081e-04 4.72799889e-03 1.71226944e-02]] Final stress: [-2.11643600e-04 3.74224002e-04 5.81428117e-04 -9.60928447e-13 -1.91640202e-03 1.86013777e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 8.36101319e-12 1.65421930e-02 2.64665022e-11] [ 9.83605664e-12 -3.52968777e-02 -4.49586586e-10] [ 2.81606359e-02 -1.06192821e-02 -2.12284829e-02] [-1.75847825e-02 1.60257029e-04 1.82410158e-02] [ 1.83537467e-02 2.55039324e-02 7.55747261e-05] [-2.81606359e-02 -1.06192822e-02 2.12284829e-02] [-1.83537470e-02 2.55039321e-02 -7.55745657e-05] [ 1.75847824e-02 1.60257120e-04 -1.82410159e-02] [ 9.99491019e-03 -9.25881535e-04 -1.72698671e-02] [ 7.49857415e-04 -4.74168335e-03 -1.71378788e-02] [-7.49857194e-04 -4.74168320e-03 1.71378792e-02] [-9.99490994e-03 -9.25881563e-04 1.72698670e-02]] Final stress: [-2.11647670e-04 3.74402454e-04 5.81728858e-04 -3.29379810e-13 1.91646536e-03 3.73730119e-13] Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.37322267e-02 -6.31290380e-03 -9.84921251e-05] [-1.37322312e-02 6.31289977e-03 -9.84421140e-05] [-1.04145057e-03 5.04685860e-03 -1.25930931e-02] [-8.02907706e-03 -5.87255948e-03 6.21194685e-03] [-6.48614398e-03 1.92025943e-02 6.49894369e-03] [ 1.04144898e-03 -5.04645321e-03 -1.25929270e-02] [ 8.02891221e-03 5.87246360e-03 6.21203109e-03] [ 6.48645562e-03 -1.92027771e-02 6.49909298e-03] [-1.26202009e-02 6.83566850e-03 7.49028044e-03] [ 1.26201151e-02 -6.83571114e-03 7.49046717e-03] [-8.78805468e-03 -1.57709900e-03 -7.51002003e-03] [ 8.78799971e-03 1.57701891e-03 -7.50978780e-03]] Final stress: [ 1.29135621e-05 -5.61706136e-04 -1.10268154e-04 8.39708342e-11 -1.12943201e-10 -3.89528338e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.37276662e-02 -6.31079779e-03 9.84547072e-05] [ 1.37276735e-02 6.31079841e-03 9.82900831e-05] [-1.07452954e-03 -5.07691321e-03 1.25812818e-02] [-6.51126472e-03 -1.91592373e-02 -6.49748607e-03] [-7.98375015e-03 5.89094453e-03 -6.20164120e-03] [ 1.07453173e-03 5.07687976e-03 1.25812675e-02] [ 6.51119782e-03 1.91591960e-02 -6.49745792e-03] [ 7.98358096e-03 -5.89084518e-03 -6.20171794e-03] [-8.80409144e-03 1.58093004e-03 7.55349273e-03] [ 8.80420146e-03 -1.58097080e-03 7.55353664e-03] [-1.26116638e-02 -6.81818004e-03 -7.53395527e-03] [ 1.26117804e-02 6.81819559e-03 -7.53406504e-03]] Final stress: [ 1.25127423e-05 -5.61894897e-04 -1.11264547e-04 -1.98408472e-10 -4.69268285e-12 3.89330538e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.98750713e-09 -5.38574974e-03 -4.65367529e-08] [ 1.85255589e-10 5.38574790e-03 -2.18018892e-07] [ 2.99166250e-03 -4.92449297e-08 2.18695961e-08] [-1.47173989e-04 -2.60636950e-04 3.43167778e-03] [-1.47399073e-04 2.60765035e-04 -3.43157315e-03] [-2.99166181e-03 3.75503801e-08 1.56311494e-08] [ 1.47177224e-04 2.60636868e-04 3.43167501e-03] [ 1.47285741e-04 -2.60698851e-04 -3.43162499e-03] [-1.10650460e-03 3.13681341e-04 -1.09270358e-03] [ 1.10655111e-03 -3.13720825e-04 -1.09265492e-03] [-1.10651010e-03 -3.13657162e-04 1.09277166e-03] [ 1.10656982e-03 3.13644079e-04 1.09265924e-03]] Final stress: [ 2.50477535e-04 -6.40790539e-05 9.44143259e-05 -8.93585048e-11 -4.16614228e-11 2.08271526e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.42775355e-10 5.51095819e-03 2.42054707e-08] [ 4.13805656e-10 -5.51096172e-03 -1.60447073e-07] [-3.17066150e-03 -3.72574922e-08 1.75792297e-08] [ 7.35193585e-05 5.67689103e-04 -3.53734604e-03] [ 7.33458821e-05 -5.67590269e-04 3.53742883e-03] [ 3.17066081e-03 4.71091888e-10 -3.16105676e-10] [-7.33970939e-05 -5.67620313e-04 -3.53740345e-03] [-7.34686144e-05 5.67660668e-04 3.53737113e-03] [ 1.04365957e-03 -4.79391833e-04 9.15915568e-04] [-1.04367152e-03 4.79342317e-04 9.15932802e-04] [ 1.04366927e-03 4.79352437e-04 -9.15811659e-04] [-1.04365683e-03 -4.79401793e-04 -9.15968205e-04]] Final stress: [-2.26675062e-04 8.87594053e-05 -2.90956229e-05 -2.24698749e-12 -8.91503148e-11 4.24679979e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.87835727e-10 -1.73617801e-03 1.44319622e-08] [ 7.91592902e-11 1.73617879e-03 -3.03173526e-08] [ 8.18470609e-04 -1.05431347e-08 4.20893240e-09] [-3.71237466e-05 -1.67864364e-04 1.09483485e-03] [-3.71316945e-05 1.67869026e-04 -1.09483098e-03] [-8.18470605e-04 -8.37229641e-09 -3.10890983e-09] [ 3.71134634e-05 1.67858380e-04 1.09483927e-03] [ 3.71300358e-05 -1.67867572e-04 -1.09483193e-03] [-4.34612634e-04 -1.62320254e-04 1.56806401e-04] [ 4.34621205e-04 1.62330126e-04 1.56825408e-04] [-4.34616843e-04 1.62337280e-04 -1.56802591e-04] [ 4.34619843e-04 -1.62324493e-04 -1.56825639e-04]] Final stress: [ 9.60766970e-05 -8.63369326e-07 1.16109410e-04 -9.77070293e-12 1.88185091e-11 2.35042318e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.66660297e-11 -2.98544228e-03 1.52241260e-08] [-1.40983447e-10 2.98544239e-03 -9.23680603e-08] [ 1.77743326e-03 -2.64608875e-08 1.09955030e-08] [-7.46698712e-04 -1.50074808e-04 1.84728427e-03] [-7.46741410e-04 1.50099482e-04 -1.84726365e-03] [-1.77743360e-03 1.28238538e-08 5.37287849e-09] [ 7.46706981e-04 1.50079194e-04 1.84728030e-03] [ 7.46731332e-04 -1.50093191e-04 -1.84726863e-03] [-1.29836644e-03 -6.69517056e-04 -8.24001008e-04] [ 1.29836793e-03 6.69518223e-04 -8.23958024e-04] [-1.29836671e-03 6.69518206e-04 8.24022897e-04] [ 1.29836749e-03 -6.69516518e-04 8.23964624e-04]] Final stress: [ 1.58003819e-04 -4.81357161e-05 -2.52240308e-05 -1.26218649e-12 2.66654326e-12 -1.24735497e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.29558603e-12 6.75434498e-03 -1.98236827e-09] [-6.92367969e-11 -6.75434546e-03 4.71362216e-08] [-1.00404492e-02 1.18507266e-08 -4.93923286e-09] [ 2.17506405e-03 -4.91998711e-03 -4.71407583e-03] [ 2.17508518e-03 4.91997485e-03 4.71406581e-03] [ 1.00404495e-02 -2.52998072e-09 -1.33043040e-09] [-2.17506464e-03 4.91998671e-03 -4.71407555e-03] [-2.17509069e-03 -4.91997193e-03 4.71406342e-03] [ 6.02612615e-04 -1.21946425e-03 -6.01516975e-04] [-6.02611035e-04 1.21945781e-03 -6.01539240e-04] [ 6.02615466e-04 1.21945242e-03 6.01507729e-04] [-6.02611121e-04 -1.21945735e-03 6.01531752e-04]] Final stress: [-6.45267665e-04 -1.70275512e-04 -5.58190191e-05 -4.14685562e-12 -9.79250364e-12 -2.60585580e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.01076600e-09 1.12407825e-03 -5.16599952e-08] [-1.87057855e-09 -1.12407884e-03 2.34664841e-07] [-6.26812162e-04 -1.34093050e-07 5.39405300e-08] [ 1.96157648e-04 1.90701321e-04 -6.22641574e-04] [ 1.95925638e-04 -1.90567404e-04 6.22749373e-04] [ 6.26811966e-04 -1.45134898e-07 -6.30921498e-08] [-1.95847070e-04 -1.90520442e-04 -6.22789118e-04] [-1.96128308e-04 1.90682430e-04 6.22649910e-04] [ 4.14189051e-04 1.92157694e-05 -7.69006416e-05] [-4.14242977e-04 -1.92108491e-05 -7.72261043e-05] [ 4.14193108e-04 -1.92320930e-05 7.70201294e-05] [-4.14243013e-04 1.92110847e-05 7.69641728e-05]] Final stress: [-6.06100859e-05 -5.79171766e-06 -9.06396268e-05 8.78758175e-11 -1.64396587e-11 -3.45773928e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-9.37226339e-03 -2.59416862e-02 1.18726867e-03] [-9.37226338e-03 2.59416862e-02 -1.18726900e-03] [-1.29259459e-03 -2.76778112e-10 1.18246981e-10] [-6.25906195e-03 1.21772587e-04 8.54092732e-03] [-6.25906219e-03 -1.21772435e-04 -8.54092719e-03] [ 4.72745307e-02 -2.41639081e-11 -1.95765420e-11] [-1.98515331e-03 -3.21775261e-02 -2.64423179e-02] [-1.98515357e-03 3.21775262e-02 2.64423178e-02] [-7.17168747e-03 -7.36192394e-03 -1.79715253e-02] [ 1.79719831e-03 -3.39198717e-03 -1.63991893e-02] [-7.17168744e-03 7.36192382e-03 1.79715256e-02] [ 1.79719827e-03 3.39198729e-03 1.63991893e-02]] Final stress: [ 3.73574904e-04 -2.10836495e-04 5.81719274e-04 -1.91772863e-03 6.88309205e-14 -4.78460531e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 9.37019821e-03 -2.59318073e-02 -1.18708600e-03] [ 9.37019821e-03 2.59318073e-02 1.18708397e-03] [-4.72621911e-02 -5.51137499e-10 2.29415893e-10] [ 1.97966486e-03 3.21712734e-02 -2.64402119e-02] [ 1.97966403e-03 -3.21712730e-02 2.64402123e-02] [ 1.27894981e-03 3.87488586e-10 1.67405608e-10] [ 6.26098416e-03 -1.17245492e-04 8.53755890e-03] [ 6.26098526e-03 1.17244854e-04 -8.53755839e-03] [-1.79119787e-03 3.39746795e-03 -1.64157147e-02] [ 7.17197117e-03 7.39182967e-03 -1.79878650e-02] [-1.79119794e-03 -3.39746770e-03 1.64157150e-02] [ 7.17197114e-03 -7.39182961e-03 1.79878654e-02]] Final stress: [ 3.73745197e-04 -2.10831667e-04 5.82009115e-04 1.91768484e-03 1.61064265e-13 3.87397927e-13] Minimization converged after 41 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.10080426e-11 -1.39886466e-02 1.46750737e-10] [-1.00195370e-11 3.32911341e-02 4.43125717e-11] [-2.19144340e-02 1.64352811e-02 2.00485584e-02] [ 1.33267690e-02 -4.71162759e-04 -2.27422617e-02] [-1.53411275e-02 -3.13287321e-02 -4.66289866e-04] [ 2.19144340e-02 1.64352811e-02 -2.00485584e-02] [ 1.53411279e-02 -3.13287319e-02 4.66289669e-04] [-1.33267690e-02 -4.71162741e-04 2.27422617e-02] [-7.77745503e-03 5.48657326e-03 -1.74380553e-02] [-3.26240934e-03 2.26796619e-04 -1.71259574e-02] [ 3.26240916e-03 2.26796446e-04 1.71259574e-02] [ 7.77745482e-03 5.48657334e-03 1.74380552e-02]] Final stress: [ 2.09787645e-04 -4.70113422e-05 5.83899030e-04 3.32586016e-13 -1.90514488e-03 -5.78346665e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.67977146e-12 -3.32914666e-02 3.51462911e-11] [ 1.35429085e-11 1.39887241e-02 -1.91228414e-09] [-2.19145743e-02 -1.64354645e-02 -2.00487988e-02] [-1.53414211e-02 3.13291966e-02 4.66257730e-04] [ 1.33269062e-02 4.71217021e-04 2.27425631e-02] [ 2.19145743e-02 -1.64354634e-02 2.00487993e-02] [-1.33269068e-02 4.71216692e-04 -2.27425628e-02] [ 1.53414215e-02 3.13291964e-02 -4.66257521e-04] [ 3.26269766e-03 -2.26987768e-04 -1.71264925e-02] [ 7.77779199e-03 -5.48659041e-03 -1.74385521e-02] [-7.77779186e-03 -5.48659063e-03 1.74385535e-02] [-3.26269763e-03 -2.26987508e-04 1.71264921e-02]] Final stress: [ 2.09793897e-04 -4.70095421e-05 5.83915443e-04 -2.11884183e-14 1.90516986e-03 -1.07639241e-12] Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.49453750e-02 8.06451664e-03 -9.80058426e-05] [-1.49453739e-02 -8.06451872e-03 -9.77801389e-05] [-7.27809903e-03 -8.18683334e-03 -8.11536103e-03] [-1.33867662e-02 -7.53612251e-03 -5.08301750e-03] [-2.03016604e-03 1.13277756e-02 1.33028253e-02] [ 7.27810047e-03 8.18685801e-03 -8.11535339e-03] [ 1.33868176e-02 7.53615096e-03 -5.08304195e-03] [ 2.03004761e-03 -1.13277090e-02 1.33027711e-02] [-9.35055912e-03 -6.55595524e-03 7.82226745e-03] [ 9.35057702e-03 6.55588825e-03 7.82212464e-03] [-5.83940950e-03 -1.14249838e-02 -7.82874856e-03] [ 5.83945609e-03 1.14249332e-02 -7.82868008e-03]] Final stress: [-4.78991795e-04 -8.40051065e-05 -1.11054527e-04 -4.86785874e-11 -1.00271844e-10 -5.73883949e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.49405548e-02 8.06216571e-03 9.77780272e-05] [ 1.49405582e-02 -8.06215556e-03 9.73672408e-05] [-7.28989068e-03 8.21518712e-03 8.12051168e-03] [-1.99902146e-03 -1.13292389e-02 -1.33076184e-02] [-1.34169438e-02 7.48834369e-03 5.08271968e-03] [ 7.28988938e-03 -8.21518423e-03 8.12051811e-03] [ 1.99883170e-03 1.13291291e-02 -1.33075306e-02] [ 1.34170898e-02 -7.48842466e-03 5.08278788e-03] [-5.81881936e-03 1.14070363e-02 7.80814116e-03] [ 5.81886183e-03 -1.14069529e-02 7.80842043e-03] [-9.37768094e-03 6.56169655e-03 -7.80149310e-03] [ 9.37768024e-03 -6.56160223e-03 -7.80160214e-03]] Final stress: [-4.78439453e-04 -8.35762902e-05 -1.10462560e-04 -3.34984347e-11 1.71596586e-10 5.73764310e-04] Minimization converged after 5 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.55683472e-04 -3.92574817e-06 1.55431259e-08] [-5.55683472e-04 3.92574927e-06 -1.55202779e-08] [ 2.09011356e-03 -5.11020805e-12 1.88254434e-12] [-2.37889050e-04 -2.69675020e-03 1.62178272e-03] [-2.37889030e-04 2.69675019e-03 -1.62178273e-03] [ 3.66040585e-03 -2.03802670e-11 -8.16819516e-12] [-1.03816619e-03 -1.36005197e-03 -1.60237606e-03] [-1.03816621e-03 1.36005198e-03 1.60237606e-03] [-5.14911043e-04 8.59490683e-04 -6.39321236e-04] [-5.28609943e-04 8.79720150e-04 -6.39313047e-04] [-5.14911047e-04 -8.59490675e-04 6.39321241e-04] [-5.28609946e-04 -8.79720133e-04 6.39313042e-04]] Final stress: [-3.03847816e-05 -3.08338085e-05 8.94196555e-05 -8.49251458e-05 2.39732855e-14 -1.93892902e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.55604393e-04 -3.92646356e-06 -1.55530177e-08] [ 5.55604394e-04 3.92646225e-06 1.55358078e-08] [-3.66060723e-03 -2.85877098e-12 1.36613008e-12] [ 1.03767920e-03 1.36216256e-03 -1.60233320e-03] [ 1.03767917e-03 -1.36216254e-03 1.60233322e-03] [-2.09294099e-03 -7.76648928e-13 1.95054890e-13] [ 2.38702706e-04 2.69657690e-03 1.62174997e-03] [ 2.38702705e-04 -2.69657690e-03 -1.62174997e-03] [ 5.29249357e-04 -8.76414855e-04 -6.35672108e-04] [ 5.15538464e-04 -8.56177786e-04 -6.35680326e-04] [ 5.29249355e-04 8.76414853e-04 6.35672118e-04] [ 5.15538470e-04 8.56177769e-04 6.35680317e-04]] Final stress: [-3.02945235e-05 -3.07435766e-05 8.93974989e-05 8.49619203e-05 -1.14681138e-14 2.46233634e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.27778362e-03 -1.62880610e-04 -1.70748243e-06] [ 3.27778361e-03 1.62880613e-04 1.70733168e-06] [ 3.12460167e-02 -1.52682100e-10 6.27926911e-11] [-2.14354684e-03 -1.57396149e-03 6.01473390e-03] [-2.14354714e-03 1.57396167e-03 -6.01473377e-03] [ 1.11405783e-02 -8.50468452e-11 -4.01368610e-11] [ 8.45777678e-03 -1.92543875e-02 -5.71079651e-03] [ 8.45777674e-03 1.92543875e-02 5.71079649e-03] [-1.56567822e-02 -5.93916857e-03 4.87273995e-03] [-1.51285287e-02 -5.28769003e-03 4.87587079e-03] [-1.56567822e-02 5.93916865e-03 -4.87273980e-03] [-1.51285286e-02 5.28769001e-03 -4.87587092e-03]] Final stress: [ 6.28698031e-04 6.01185655e-04 1.62669078e-04 -7.96547440e-04 -3.91914948e-14 2.28204150e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.27778362e-03 -1.62880614e-04 1.70734932e-06] [-3.27778362e-03 1.62880613e-04 -1.70737034e-06] [-1.11405783e-02 -1.59733616e-10 6.67570112e-11] [-8.45777648e-03 1.92543877e-02 -5.71079638e-03] [-8.45777700e-03 -1.92543874e-02 5.71079662e-03] [-3.12460167e-02 -1.14215778e-10 -5.40748698e-11] [ 2.14354698e-03 1.57396157e-03 6.01473385e-03] [ 2.14354693e-03 -1.57396154e-03 -6.01473389e-03] [ 1.51285287e-02 5.28769007e-03 4.87587097e-03] [ 1.56567822e-02 5.93916857e-03 4.87273971e-03] [ 1.51285287e-02 -5.28769000e-03 -4.87587085e-03] [ 1.56567822e-02 -5.93916870e-03 -4.87274002e-03]] Final stress: [ 6.28698032e-04 6.01185657e-04 1.62669079e-04 7.96547441e-04 -2.89966980e-14 4.29016316e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.21467375e-13 5.59453664e-04 -1.27309400e-11] [ 1.53817954e-13 5.51602102e-04 -1.09251784e-11] [-7.75334569e-04 1.80970546e-03 1.86127355e-03] [ 2.40936067e-03 -2.38807214e-03 -9.40346917e-04] [-1.64916977e-03 -1.02193110e-03 -9.20932055e-04] [ 7.75334570e-04 1.80970551e-03 -1.86127353e-03] [ 1.64916975e-03 -1.02193111e-03 9.20932065e-04] [-2.40936064e-03 -2.38807216e-03 9.40346930e-04] [ 8.59169392e-04 5.32502028e-04 -6.35396971e-04] [ 8.72880706e-04 5.12267859e-04 -6.35404913e-04] [-8.72880707e-04 5.12267848e-04 6.35404904e-04] [-8.59169397e-04 5.32502036e-04 6.35396961e-04]] Final stress: [-3.07343869e-05 -3.02854308e-05 8.93967438e-05 7.84661796e-15 -8.49537094e-05 -3.94418413e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.83884684e-13 -5.51915267e-04 -2.30624676e-11] [ 6.86574974e-13 -5.59769992e-04 2.02294024e-11] [-7.76894638e-04 -1.80946494e-03 -1.86179597e-03] [-1.64797343e-03 1.02010963e-03 9.21194432e-04] [ 2.40973557e-03 2.38895207e-03 9.40607024e-04] [ 7.76894638e-04 -1.80946491e-03 1.86179599e-03] [-2.40973563e-03 2.38895203e-03 -9.40606998e-04] [ 1.64797346e-03 1.02010962e-03 -9.21194424e-04] [-8.76558189e-04 -5.11758438e-04 -6.39382381e-04] [-8.62858187e-04 -5.31995681e-04 -6.39374468e-04] [ 8.62858205e-04 -5.31995666e-04 6.39374426e-04] [ 8.76558208e-04 -5.11758442e-04 6.39382381e-04]] Final stress: [-3.08406252e-05 -3.03913780e-05 8.94179690e-05 -3.52131714e-14 8.49491244e-05 3.91891479e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.41395748e-12 -3.12247721e-03 -1.01096775e-10] [ 5.09695267e-12 -3.45060165e-03 -1.39318323e-10] [ 1.04289032e-02 2.86616973e-03 6.79155283e-03] [ 5.51735560e-03 -6.34319535e-03 -3.55328801e-03] [-1.53943199e-02 -2.41355040e-02 -3.24681576e-03] [-1.04289032e-02 2.86616993e-03 -6.79155275e-03] [ 1.53943197e-02 -2.41355042e-02 3.24681587e-03] [-5.51735555e-03 -6.34319537e-03 3.55328803e-03] [-5.36802854e-03 1.57777844e-02 4.88825166e-03] [-5.89948735e-03 1.51212846e-02 4.89538870e-03] [ 5.89948744e-03 1.51212846e-02 -4.89538866e-03] [ 5.36802863e-03 1.57777845e-02 -4.88825166e-03]] Final stress: [ 6.03323120e-04 6.31028650e-04 1.63646954e-04 -1.63907368e-13 -7.99507390e-04 -6.38608000e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.28473263e-12 3.45060165e-03 7.34496406e-11] [ 3.36889757e-12 3.12247721e-03 -4.66637768e-11] [ 1.04289032e-02 -2.86616986e-03 -6.79155277e-03] [-1.53943198e-02 2.41355041e-02 3.24681581e-03] [ 5.51735546e-03 6.34319541e-03 3.55328806e-03] [-1.04289032e-02 -2.86616982e-03 6.79155278e-03] [-5.51735565e-03 6.34319529e-03 -3.55328798e-03] [ 1.53943198e-02 2.41355040e-02 -3.24681580e-03] [ 5.89948743e-03 -1.51212846e-02 4.89538861e-03] [ 5.36802862e-03 -1.57777844e-02 4.88825164e-03] [-5.36802856e-03 -1.57777844e-02 -4.88825166e-03] [-5.89948733e-03 -1.51212846e-02 -4.89538872e-03]] Final stress: [ 6.03323119e-04 6.31028649e-04 1.63646953e-04 -1.26097358e-13 7.99507389e-04 1.30073525e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.99035867e-02 8.33284701e-04 7.43004497e-05] [-1.99035866e-02 -8.33284606e-04 7.43027679e-05] [ 1.24478944e-02 -1.11031703e-03 -1.68540255e-02] [-6.14517369e-03 1.63379224e-02 9.55995557e-03] [ 2.59752659e-03 -3.64278845e-03 7.10202750e-03] [-1.24478944e-02 1.11032297e-03 -1.68540231e-02] [ 6.14516624e-03 -1.63379267e-02 9.55995908e-03] [-2.59752062e-03 3.64278497e-03 7.10203038e-03] [-4.11634906e-03 -2.96458952e-03 1.09224650e-02] [ 4.11634993e-03 2.96459032e-03 1.09224686e-02] [ 1.32914517e-02 -5.59551863e-03 -1.08047332e-02] [-1.32914512e-02 5.59551961e-03 -1.08047275e-02]] Final stress: [ 6.03580142e-04 7.99985646e-04 4.29057517e-04 -1.83149187e-12 1.13981876e-12 -5.59931122e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.99033533e-02 8.33249829e-04 -7.42960099e-05] [ 1.99033532e-02 -8.33249838e-04 -7.42872777e-05] [ 1.24475985e-02 1.11036618e-03 1.68533772e-02] [ 2.59733773e-03 3.64271740e-03 -7.10179178e-03] [-6.14516817e-03 -1.63375190e-02 -9.55957441e-03] [-1.24475986e-02 -1.11035077e-03 1.68533837e-02] [-2.59735258e-03 -3.64272590e-03 -7.10178457e-03] [ 6.14518535e-03 1.63375091e-02 -9.55956617e-03] [ 1.32910305e-02 5.59524054e-03 1.08045058e-02] [-1.32910314e-02 -5.59523880e-03 1.08045133e-02] [-4.11642103e-03 2.96442015e-03 -1.09222477e-02] [ 4.11641966e-03 -2.96441881e-03 -1.09222321e-02]] Final stress: [6.03570794e-04 7.99966987e-04 4.29046171e-04 4.11223330e-12 1.66230942e-12 5.59921215e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.16634663e-03 -8.72658388e-05 3.13203275e-05] [-1.16634684e-03 8.72658047e-05 3.13190843e-05] [-3.37866472e-03 1.98971006e-03 -1.66179169e-03] [ 6.48567488e-03 -1.52994723e-04 2.54115534e-03] [ 4.87501389e-03 1.19314614e-03 -9.13432569e-04] [ 3.37866465e-03 -1.98970718e-03 -1.66179049e-03] [-6.48567357e-03 1.52995517e-04 2.54115486e-03] [-4.87500836e-03 -1.19314938e-03 -9.13430054e-04] [ 9.58704332e-03 -2.70787532e-04 7.87141732e-04] [-9.58704665e-03 2.70788180e-04 7.87144034e-04] [-1.77338976e-03 1.28279411e-03 -7.84395826e-04] [ 1.77338654e-03 -1.28279515e-03 -7.84394754e-04]] Final stress: [-2.39756352e-04 -1.66788523e-04 -1.70131672e-04 5.45773630e-12 -2.97828851e-13 -1.58121498e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.16668798e-03 -8.72807186e-05 -3.13075037e-05] [ 1.16668800e-03 8.72807862e-05 -3.13171052e-05] [-3.37857525e-03 -1.98939198e-03 1.66152532e-03] [ 4.87543588e-03 -1.19279219e-03 9.13711374e-04] [ 6.48584056e-03 1.52749338e-04 -2.54118489e-03] [ 3.37857522e-03 1.98940369e-03 1.66153024e-03] [-4.87544745e-03 1.19278547e-03 9.13716928e-04] [-6.48582934e-03 -1.52755756e-04 -2.54117952e-03] [-1.77204964e-03 -1.28280372e-03 7.84202125e-04] [ 1.77205000e-03 1.28280436e-03 7.84214922e-04] [ 9.58636797e-03 2.70958451e-04 -7.86957858e-04] [-9.58636796e-03 -2.70957712e-04 -7.86954035e-04]] Final stress: [-2.39753393e-04 -1.66780500e-04 -1.70126592e-04 1.01177225e-13 1.25340647e-12 1.58112655e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.44233604e-02 -2.75525074e-02 -2.99729566e-03] [ 3.44233604e-02 2.75525074e-02 2.99729566e-03] [-5.08675479e-03 -1.22993847e-10 4.84290332e-11] [-5.26681889e-02 -9.64641792e-02 2.20213872e-02] [-5.26681885e-02 9.64641790e-02 -2.20213873e-02] [ 1.39601450e-01 6.14148403e-11 6.17538987e-12] [-6.36135678e-02 -5.46780630e-02 1.40097637e-02] [-6.36135680e-02 5.46780632e-02 -1.40097638e-02] [-2.03915990e-02 8.11916891e-02 -3.56399390e-02] [ 3.49926479e-02 1.99993092e-01 -3.36139225e-02] [-2.03915989e-02 -8.11916893e-02 3.56399392e-02] [ 3.49926477e-02 -1.99993092e-01 3.36139226e-02]] Final stress: [-5.27953482e-04 -4.38352820e-03 4.85084144e-03 -8.07504459e-03 3.91177460e-13 -7.97127160e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.44233605e-02 -2.75525073e-02 2.99729506e-03] [-3.44233605e-02 2.75525073e-02 -2.99729521e-03] [-1.39601449e-01 -8.12423269e-11 2.44756903e-11] [ 6.36135676e-02 5.46780627e-02 1.40097635e-02] [ 6.36135679e-02 -5.46780628e-02 -1.40097637e-02] [ 5.08675493e-03 1.97411748e-10 7.34634185e-11] [ 5.26681883e-02 9.64641791e-02 2.20213872e-02] [ 5.26681885e-02 -9.64641791e-02 -2.20213872e-02] [-3.49926476e-02 -1.99993091e-01 -3.36139222e-02] [ 2.03915992e-02 -8.11916887e-02 -3.56399389e-02] [-3.49926475e-02 1.99993091e-01 3.36139221e-02] [ 2.03915991e-02 8.11916889e-02 3.56399391e-02]] Final stress: [-5.27953495e-04 -4.38352820e-03 4.85084141e-03 8.07504458e-03 9.05809236e-15 -6.22026595e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.01546893 -0.00618024 0.00040833] [-0.0030949 -0.00619252 -0.00040835] [ 0.05533072 0.0661992 0.01663784] [ 0.06508612 -0.16889886 0.01578617] [-0.08201815 0.04276748 -0.03010968] [ 0.13550162 0.07416267 -0.03785612] [ 0.01945792 -0.08187524 -0.00514167] [-0.11657126 -0.00914631 0.04068361] [ 0.02983196 0.04342146 -0.00580667] [-0.0114004 0.06417432 -0.00820069] [-0.07440026 -0.01971442 0.00767045] [-0.0331923 0.00128247 0.00633677]] Final stress: [-0.00249179 -0.00249137 0.00098741 -0.00384591 -0.00384594 -0.00071811] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.00311607 0.00616819 0.00040811] [ 0.01544143 0.00615591 -0.00040809] [ 0.05537079 -0.06618037 -0.01666444] [-0.08201105 -0.04272681 0.03014467] [ 0.0650801 0.16887095 -0.01579352] [ 0.13547573 -0.07414012 0.03787777] [-0.11653348 0.00913753 -0.04071616] [ 0.01948718 0.08191219 0.00515153] [-0.0744741 0.01977466 -0.00766287] [-0.03328045 -0.00121435 -0.00632951] [ 0.02988899 -0.04350631 0.00579996] [-0.01132905 -0.06425147 0.00819256]] Final stress: [-0.00248969 -0.00248927 0.00098771 -0.00384485 0.00384488 0.0007179 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.015452 -0.00616498 -0.0004082 ] [ 0.00310851 -0.00617726 0.00040822] [-0.13548372 0.07414648 0.0378706 ] [ 0.11654507 -0.00914208 -0.04070508] [-0.0194741 -0.08189322 0.00514812] [-0.05535171 0.0661854 -0.01665522] [ 0.08201032 0.04274228 0.03013258] [-0.06508178 -0.16887889 -0.01579115] [ 0.03325328 0.00123236 -0.00633179] [ 0.07445348 -0.01976008 -0.00766538] [ 0.01134863 0.06422926 0.00819526] [-0.02987597 0.04348073 0.00580205]] Final stress: [-0.00249055 -0.00249012 0.00098761 0.00384524 -0.00384527 0.000718 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.00311609 0.00616827 -0.00040811] [-0.01544162 0.00615599 0.0004081 ] [-0.13547511 -0.07413937 -0.03787796] [-0.01948628 0.08191012 -0.0051516 ] [ 0.1165326 0.00913805 0.04071638] [-0.05536909 -0.06617965 0.0166646 ] [-0.06507987 0.16887 0.01579361] [ 0.08200975 -0.04272704 -0.03014487] [ 0.01132681 -0.06425344 -0.00819243] [-0.02989162 -0.04350812 -0.0057998 ] [ 0.03328216 -0.00121199 0.00632935] [ 0.07447619 0.01977718 0.00766275]] Final stress: [-0.00248972 -0.0024893 0.00098771 0.00384485 0.00384488 -0.00071791] Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 65 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.05289793e-11 -6.96471955e-03 -1.41560385e-10] [-6.16863598e-12 -6.19031759e-02 -2.61201613e-10] [-3.11933627e-03 9.93984449e-02 5.01839648e-04] [ 1.09197946e-01 -6.97170461e-02 -2.55128214e-02] [-4.43935197e-02 2.00364595e-02 1.05740443e-02] [ 3.11933627e-03 9.93984451e-02 -5.01839530e-04] [ 4.43935194e-02 2.00364594e-02 -1.05740442e-02] [-1.09197946e-01 -6.97170460e-02 2.55128213e-02] [ 1.67253896e-01 5.02243782e-02 -4.21124636e-02] [ 1.13052386e-01 -6.55082889e-02 -2.80668342e-02] [-1.13052386e-01 -6.55082890e-02 2.80668344e-02] [-1.67253896e-01 5.02243784e-02 4.21124636e-02]] Final stress: [-4.34926467e-03 -5.16375447e-04 4.88647630e-03 -4.41432984e-13 -8.04042462e-03 -1.37795199e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.25203251e-11 6.19031760e-02 1.85630611e-11] [-1.97028773e-12 6.96471968e-03 1.47758571e-10] [-3.11933636e-03 -9.93984443e-02 -5.01839808e-04] [-4.43935200e-02 -2.00364599e-02 -1.05740445e-02] [ 1.09197946e-01 6.97170458e-02 2.55128211e-02] [ 3.11933638e-03 -9.93984445e-02 5.01839695e-04] [-1.09197946e-01 6.97170458e-02 -2.55128211e-02] [ 4.43935197e-02 -2.00364598e-02 1.05740444e-02] [-1.13052385e-01 6.55082889e-02 -2.80668346e-02] [-1.67253896e-01 -5.02243783e-02 -4.21124632e-02] [ 1.67253896e-01 -5.02243783e-02 4.21124632e-02] [ 1.13052386e-01 6.55082889e-02 2.80668346e-02]] Final stress: [-4.34926468e-03 -5.16375454e-04 4.88647629e-03 -1.45848624e-13 8.04042462e-03 2.11979228e-13] Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 68 steps. Minimization converged after 68 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.00544181e-09 1.35504953e-03 1.68872496e-08] [ 1.73413202e-09 -1.35504834e-03 4.34378974e-07] [-4.23844099e-04 9.61863857e-08 -4.01513347e-08] [-1.11540915e-04 5.38672114e-04 -8.49945376e-04] [-1.11332506e-04 -5.38791861e-04 8.49846806e-04] [ 4.23846857e-04 -1.40524881e-07 -5.78278622e-08] [ 1.11487111e-04 -5.38701925e-04 -8.49922680e-04] [ 1.11262464e-04 5.38831930e-04 8.49815241e-04] [ 3.48845912e-04 4.32784284e-05 -8.51258167e-05] [-3.48783080e-04 -4.32766110e-05 -8.53361153e-05] [ 3.48843374e-04 -4.32682665e-05 8.50660839e-05] [-3.48788858e-04 4.32993374e-05 8.52485711e-05]] Final stress: [ 8.27214589e-06 7.30254331e-05 3.48001776e-05 -9.72893695e-11 2.79758822e-11 -2.64458948e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.59341806e-10 -3.67049429e-03 8.70354064e-08] [-1.80868270e-09 3.67049270e-03 -2.74152175e-07] [ 8.09758603e-04 -3.29578683e-08 1.49697260e-08] [ 5.06882370e-04 -1.25222279e-03 2.33315760e-03] [ 5.06734349e-04 1.25230703e-03 -2.33308802e-03] [-8.09760167e-04 2.64026880e-08 1.10684099e-08] [-5.06814435e-04 1.25226031e-03 2.33312674e-03] [-5.06760700e-04 -1.25229115e-03 -2.33310125e-03] [-7.73606307e-04 1.76619222e-04 6.53164560e-04] [ 7.73581717e-04 -1.76637135e-04 6.53309394e-04] [-7.73607194e-04 -1.76614630e-04 -6.53106403e-04] [ 7.73593931e-04 1.76587297e-04 -6.53301538e-04]] Final stress: [ 5.97098943e-05 -1.59496157e-04 -2.30493267e-05 3.46603849e-11 -3.66689512e-11 1.12516037e-10] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.22837518e-10 1.65357780e-02 -9.58191371e-09] [ 1.25505074e-09 -1.65357771e-02 -1.08047906e-07] [ 7.77500990e-03 -3.79955269e-08 1.54482302e-08] [-9.47045228e-03 1.58238027e-02 -1.25267606e-02] [-9.47050801e-03 -1.58237702e-02 1.25267871e-02] [-7.77501040e-03 1.94098299e-08 8.37013479e-09] [ 9.47044418e-03 -1.58238074e-02 -1.25267572e-02] [ 9.47051718e-03 1.58237655e-02 1.25267912e-02] [ 1.99803016e-03 7.44501443e-03 2.92633459e-03] [-1.99802769e-03 -7.44500065e-03 2.92638106e-03] [ 1.99802488e-03 -7.44499282e-03 -2.92631809e-03] [-1.99802906e-03 7.44500612e-03 -2.92636425e-03]] Final stress: [ 2.34748095e-04 1.61248141e-03 6.09764443e-04 -2.02793772e-12 2.41574903e-11 3.58697989e-11] Minimization converged after 24 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.74187686e-09 3.16964815e-04 1.02534619e-08] [-2.26092790e-10 -3.16961992e-04 3.89973830e-07] [-1.33676284e-04 1.25814759e-07 -5.42715691e-08] [ 3.38539160e-04 1.55769717e-04 -3.02744414e-05] [ 3.38916482e-04 -1.55985345e-04 3.00964337e-05] [ 1.33676951e-04 -2.65955959e-08 -1.08394325e-08] [-3.38670959e-04 -1.55842965e-04 -3.02113723e-05] [-3.38730199e-04 1.55877002e-04 3.01841323e-05] [ 4.14124706e-04 4.30464986e-05 5.49721122e-05] [-4.14141052e-04 -4.30000722e-05 5.48951040e-05] [ 4.14126171e-04 -4.30540886e-05 -5.51386947e-05] [-4.14163008e-04 4.30872120e-05 -5.48583901e-05]] Final stress: [ 1.48770558e-05 2.67924296e-05 7.13996119e-05 4.51223164e-11 6.90029866e-11 -1.96523392e-10] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.57062183e-10 -8.91045122e-05 -1.59382518e-09] [-3.25817151e-10 8.91044721e-05 -5.03729985e-08] [ 2.78943932e-04 -4.01369082e-09 1.56681548e-09] [-1.29398606e-04 2.05502995e-04 -1.73347395e-05] [-1.29415256e-04 -2.05493452e-04 1.73421015e-05] [-2.78944237e-04 2.21760901e-08 9.26359007e-09] [ 1.29391258e-04 -2.05507358e-04 -1.73306974e-05] [ 1.29436960e-04 2.05481040e-04 1.73524056e-05] [-4.49896094e-05 -6.75321564e-06 -6.85233047e-05] [ 4.49826977e-05 6.75418586e-06 -6.84886572e-05] [-4.49906133e-05 6.75726238e-06 6.85176122e-05] [ 4.49839578e-05 -6.75958030e-06 6.85064159e-05]] Final stress: [ 1.70800867e-05 1.73702740e-05 6.78367514e-05 1.12742126e-11 -1.01258835e-12 1.95221442e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 4.93408980e-10 -2.87800374e-03 8.47525861e-09] [ 8.39535108e-10 2.87800564e-03 2.73310933e-07] [ 7.68813296e-04 8.72855719e-08 -3.71680900e-08] [ 2.67542558e-04 -8.84986338e-04 1.84008063e-03] [ 2.67733677e-04 8.84876571e-04 -1.84017244e-03] [-7.68812170e-04 -5.53879502e-08 -2.24712360e-08] [-2.67633490e-04 8.84935345e-04 1.84012284e-03] [-2.67670669e-04 -8.84913218e-04 -1.84014208e-03] [-6.36586015e-04 1.20813798e-04 -2.73052987e-04] [ 6.36605462e-04 -1.20790078e-04 -2.73131885e-04] [-6.36594045e-04 -1.20781688e-04 2.72951705e-04] [ 6.36600062e-04 1.20811811e-04 2.73122068e-04]] Final stress: [ 5.26337186e-05 -1.18857813e-04 -5.18910673e-05 -2.29122988e-11 4.35948627e-11 2.18329575e-11] Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 8.08675196e-04 3.97615489e-04 -5.38142722e-06] [-8.08675193e-04 -3.97615464e-04 -5.36399615e-06] [ 6.24803339e-05 6.12212419e-05 -5.69645404e-04] [-2.71843605e-05 6.25899307e-04 1.46276182e-04] [ 1.68066427e-04 -1.34802660e-04 4.29290965e-04] [-6.24802605e-05 -6.12336886e-05 -5.69650624e-04] [ 2.71947747e-05 -6.25893194e-04 1.46271098e-04] [-1.68076905e-04 1.34808703e-04 4.29285869e-04] [ 3.92768386e-04 -1.17446446e-04 -3.80264024e-05] [-3.92768244e-04 1.17446569e-04 -3.80427209e-05] [ 1.86358191e-04 -1.04421114e-04 3.74931779e-05] [-1.86358347e-04 1.04421258e-04 3.74932830e-05]] Final stress: [ 2.26558313e-05 3.76884242e-05 2.63241419e-05 3.82453662e-14 6.95500621e-13 -1.11332462e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.98239448e-04 3.91736710e-04 5.34855244e-06] [ 7.98239483e-04 -3.91736682e-04 5.35873072e-06] [ 5.89217845e-05 -6.55701520e-05 5.65022928e-04] [ 1.85578178e-04 1.41954626e-04 -4.16340358e-04] [-3.53883278e-06 -6.30857234e-04 -1.54550600e-04] [-5.89217748e-05 6.55538357e-05 5.65016111e-04] [-1.85565429e-04 -1.41947167e-04 -4.16346582e-04] [ 3.52458661e-06 6.30865461e-04 -1.54557465e-04] [ 2.08332653e-04 9.46783769e-05 -4.51061486e-05] [-2.08331772e-04 -9.46782189e-05 -4.51213925e-05] [ 4.05606372e-04 1.21428677e-04 4.56409359e-05] [-4.05605800e-04 -1.21428233e-04 4.56352889e-05]] Final stress: [ 2.23277923e-05 3.74248854e-05 2.63164315e-05 -1.12577006e-12 8.02386913e-13 1.08849884e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.14442372e-03 -3.19113971e-03 2.22540215e-05] [-6.14442379e-03 3.19113949e-03 2.22208237e-05] [-3.01754969e-03 5.28534696e-04 -5.30682325e-03] [ 6.77276290e-03 6.95856111e-04 7.10196134e-03] [ 7.92315243e-03 2.26342937e-03 -1.82093638e-03] [ 3.01754962e-03 -5.28502958e-04 -5.30681000e-03] [-6.77278933e-03 -6.95871528e-04 7.10197419e-03] [-7.92312602e-03 -2.26344447e-03 -1.82092361e-03] [ 1.15088054e-02 -6.06837799e-03 4.67545031e-03] [-1.15088054e-02 6.06837748e-03 4.67548638e-03] [-3.14780216e-03 3.37731124e-03 -4.67192933e-03] [ 3.14780234e-03 -3.37731173e-03 -4.67192451e-03]] Final stress: [-9.61418951e-05 -3.34867731e-04 -1.29155947e-04 -1.89962555e-12 -2.29285248e-12 -3.25811934e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-6.12509798e-03 -3.18157562e-03 -2.22734812e-05] [ 6.12509846e-03 3.18157582e-03 -2.22486819e-05] [-3.02140111e-03 -5.29807993e-04 5.31138418e-03] [ 7.92865820e-03 -2.26695843e-03 1.82181715e-03] [ 6.77831234e-03 -6.94881559e-04 -7.10741250e-03] [ 3.02140132e-03 5.29801515e-04 5.31138169e-03] [-7.92866675e-03 2.26695364e-03 1.82182088e-03] [-6.77831608e-03 6.94883829e-04 -7.10741415e-03] [-3.15298251e-03 -3.37668947e-03 4.66903628e-03] [ 3.15298936e-03 3.37669246e-03 4.66902442e-03] [ 1.15150427e-02 6.07597831e-03 -4.67256362e-03] [-1.15150379e-02 -6.07597248e-03 -4.67255216e-03]] Final stress: [-9.65198614e-05 -3.35031785e-04 -1.29240086e-04 -1.02334051e-11 7.05079533e-12 3.25639523e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.38861578e-11 -1.45195740e-03 -1.55687230e-08] [ 5.28741717e-10 1.45195226e-03 3.61460989e-07] [ 6.93271810e-04 8.19546253e-08 -3.44148468e-08] [ 4.36547381e-05 5.99084800e-05 9.16052293e-04] [ 4.36744432e-05 -5.99213009e-05 -9.16067590e-04] [-6.93270541e-04 -1.88182587e-08 -1.17841808e-08] [-4.35786733e-05 -5.98647856e-05 9.16017416e-04] [-4.37556876e-05 5.99650849e-05 -9.16104107e-04] [-2.91699950e-04 -7.10870524e-05 -8.55175274e-05] [ 2.91683505e-04 7.10139352e-05 -8.57204526e-05] [-2.91680289e-04 7.10082562e-05 8.54442037e-05] [ 2.91700149e-04 -7.10806131e-05 8.55960704e-05]] Final stress: [ 7.54760690e-05 1.10576588e-05 3.60620560e-05 -3.78554145e-12 -1.21647604e-10 -2.46152280e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.71678499e-10 3.56575815e-03 -9.55204409e-08] [-2.38078515e-11 -3.56575876e-03 -2.22475300e-07] [-2.17649977e-03 -9.89393887e-08 4.13245396e-08] [ 1.15338285e-04 2.66170154e-04 -2.25571785e-03] [ 1.15148008e-04 -2.66060446e-04 2.25580879e-03] [ 2.17649897e-03 6.57383556e-08 2.70188102e-08] [-1.15277998e-04 -2.66135795e-04 -2.25574597e-03] [-1.15176323e-04 2.66076863e-04 2.25579471e-03] [ 6.57929186e-04 -3.99331336e-04 6.59424832e-04] [-6.57946461e-04 3.99326617e-04 6.59454948e-04] [ 6.57930731e-04 3.99324672e-04 -6.59340247e-04] [-6.57943829e-04 -3.99336923e-04 -6.59429559e-04]] Final stress: [-1.51651506e-04 5.32911942e-05 -2.29867647e-05 2.44409319e-11 -1.56738273e-11 8.06232296e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.46509040e-09 -3.68679149e-04 -4.82626189e-08] [ 1.75522424e-09 3.68679378e-04 2.82214322e-07] [ 1.22966578e-04 3.85167200e-08 -1.78660978e-08] [ 3.99169965e-04 1.06530122e-04 3.19893911e-04] [ 3.99201096e-04 -1.06548493e-04 -3.19914188e-04] [-1.22964111e-04 -3.15174329e-08 -1.48021250e-08] [-3.99242454e-04 -1.06571263e-04 3.19926065e-04] [-3.99252082e-04 1.06577657e-04 -3.19936142e-04] [ 3.09171148e-04 6.36364029e-05 -4.10932666e-05] [-3.09111905e-04 -6.36486192e-05 -4.12417993e-05] [ 3.09164830e-04 -6.36119907e-05 4.10008278e-05] [-3.09107284e-04 6.36289565e-05 4.11633086e-05]] Final stress: [ 2.08071411e-05 2.45870009e-05 7.39971210e-05 -9.90086559e-11 5.21944648e-12 9.15590193e-11] Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-5.34416289e-10 7.52003285e-05 -8.65737926e-09] [-5.57615627e-10 -7.52006816e-05 -7.26037232e-08] [ 2.30573771e-04 -3.02091854e-08 1.28035995e-08] [-1.39391879e-04 2.36027008e-04 1.27236485e-05] [-1.39454694e-04 -2.35990773e-04 -1.26934397e-05] [-2.30574287e-04 7.37337333e-09 3.05479325e-09] [ 1.39437842e-04 -2.36000625e-04 1.27024143e-05] [ 1.39442015e-04 2.35998070e-04 -1.27000464e-05] [ 3.24745976e-05 1.28929434e-05 -3.08843947e-05] [-3.24916902e-05 -1.28943055e-05 -3.08739154e-05] [ 3.24758685e-05 -1.28975979e-05 3.09204230e-05] [-3.24904524e-05 1.28884679e-05 3.08707131e-05]] Final stress: [ 1.79911809e-05 1.72872435e-05 6.73618915e-05 2.63051525e-11 -8.67342528e-12 2.94322439e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-6.00372640e-10 2.83304741e-03 -3.24831231e-08] [-1.01360213e-09 -2.83304715e-03 2.36534830e-07] [-1.52007500e-03 3.41794726e-08 -1.52147998e-08] [ 7.08654904e-05 3.25323777e-04 -1.82138594e-03] [ 7.09282770e-05 -3.25359991e-04 1.82135392e-03] [ 1.52007555e-03 -3.95987629e-08 -1.73028134e-08] [-7.08502047e-05 -3.25313620e-04 -1.82139288e-03] [-7.09095092e-05 3.25347997e-04 1.82136233e-03] [ 5.86109411e-04 -1.94770063e-04 -2.72108860e-04] [-5.86125076e-04 1.94777681e-04 -2.72235792e-04] [ 5.86108272e-04 1.94775164e-04 2.72054723e-04] [-5.86125598e-04 -1.94775786e-04 2.72180974e-04]] Final stress: [-1.15924922e-04 4.98767419e-05 -5.18765430e-05 2.88938103e-11 5.80383819e-12 6.46515242e-12] Minimization converged after 44 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.97548301e-04 -4.05406268e-04 -5.34765294e-06] [-7.97548221e-04 4.05406298e-04 -5.34950681e-06] [ 3.54620206e-04 -1.84604904e-04 -4.68516057e-04] [-9.79665011e-05 4.00440464e-04 5.46163441e-04] [ 3.16676590e-04 -2.10926577e-05 -7.17445862e-05] [-3.54620189e-04 1.84595375e-04 -4.68520062e-04] [ 9.79733562e-05 -4.00436423e-04 5.46160036e-04] [-3.16685903e-04 2.10981441e-05 -7.17490752e-05] [ 1.62355469e-04 -3.69096572e-04 -6.74700337e-05] [-1.62354166e-04 3.69096282e-04 -6.74754091e-05] [ 2.52746903e-05 -1.85050650e-04 6.69280286e-05] [-2.52736333e-05 1.85050911e-04 6.69208759e-05]] Final stress: [ 3.35008384e-05 2.50411419e-05 2.64184057e-05 -1.83897989e-12 6.38274943e-13 -1.23365020e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.84933697e-04 -3.99529744e-04 5.32066299e-06] [ 7.84933733e-04 3.99529783e-04 5.33071678e-06] [ 3.48880373e-04 1.87755939e-04 4.64557061e-04] [ 3.30250029e-04 2.77823972e-05 7.76506141e-05] [-8.49134128e-05 -4.01492017e-04 -5.48062259e-04] [-3.48880337e-04 -1.87776889e-04 4.64548346e-04] [-3.30233568e-04 -2.77728243e-05 7.76426235e-05] [ 8.48958160e-05 4.01502176e-04 -5.48070733e-04] [ 3.63404217e-05 1.87721674e-04 -5.90469023e-05] [-3.63396995e-05 -1.87721211e-04 -5.90648268e-05] [ 1.70893092e-04 3.76492081e-04 5.96015738e-05] [-1.70892750e-04 -3.76491366e-04 5.95931229e-05]] Final stress: [ 3.30928141e-05 2.50138280e-05 2.61722561e-05 -1.00616766e-12 1.24114599e-12 1.21604511e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.72505334e-03 3.23634833e-03 2.22895633e-05] [-6.72505262e-03 -3.23634721e-03 2.23397221e-05] [-4.51024989e-03 6.06484433e-03 -7.58307318e-03] [ 6.81776602e-03 6.70794905e-04 2.70456877e-03] [ 2.48441301e-03 3.87196500e-03 4.85427062e-03] [ 4.51025038e-03 -6.06495036e-03 -7.58311677e-03] [-6.81771012e-03 -6.70762373e-04 2.70454091e-03] [-2.48449517e-03 -3.87191735e-03 4.85423117e-03] [ 1.30603752e-02 5.44577433e-03 4.72318374e-03] [-1.30603596e-02 -5.44576528e-03 4.72310202e-03] [-5.17179937e-03 -1.49201851e-03 -4.72115104e-03] [ 5.17180877e-03 1.49203418e-03 -4.72118553e-03]] Final stress: [-4.25606891e-04 -1.36033983e-05 -1.30911789e-04 -1.47921384e-11 1.86219799e-11 -3.25019639e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-6.72824153e-03 3.23818329e-03 -2.22674366e-05] [ 6.72824156e-03 -3.23818322e-03 -2.23117729e-05] [-4.50182075e-03 -6.06791426e-03 7.59264423e-03] [ 2.47075995e-03 -3.86968741e-03 -4.86617132e-03] [ 6.81144840e-03 -6.66298722e-04 -2.70219767e-03] [ 4.50182059e-03 6.06788806e-03 7.59263319e-03] [-2.47073083e-03 3.86970398e-03 -4.86618520e-03] [-6.81147379e-03 6.66313470e-04 -2.70220994e-03] [-5.17835188e-03 1.50396707e-03 4.72379323e-03] [ 5.17834941e-03 -1.50396921e-03 4.72379458e-03] [ 1.30621000e-02 -5.44119794e-03 -4.72574076e-03] [-1.30621011e-02 5.44119490e-03 -4.72578112e-03]] Final stress: [-4.25244886e-04 -1.32959442e-05 -1.30788093e-04 7.50374033e-13 -4.80669772e-12 3.25071533e-04] Minimization converged after 2 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.68587123e-02 -1.42399920e-03 -2.56750773e-05] [-1.68587123e-02 1.42399920e-03 2.56757624e-05] [ 4.36066699e-02 5.44743695e-10 -2.31945875e-10] [ 5.84093087e-03 -2.60751384e-02 3.41005727e-02] [ 5.84093216e-03 2.60751377e-02 -3.41005733e-02] [ 5.12222959e-02 2.01224658e-10 9.73293668e-11] [ 4.34445844e-03 -2.28565211e-02 -3.08283050e-02] [ 4.34445908e-03 2.28565207e-02 3.08283053e-02] [-2.15821652e-02 1.29439934e-02 -2.91516921e-03] [-1.91589956e-02 1.87746695e-02 -2.87739478e-03] [-2.15821653e-02 -1.29439932e-02 2.91516845e-03] [-1.91589957e-02 -1.87746693e-02 2.87739530e-03]] Final stress: [-3.54553795e-05 -2.46515305e-04 3.31846499e-04 -2.04032925e-03 2.92247550e-13 -7.22285826e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.68625442e-02 -1.42400518e-03 2.56753929e-05] [ 1.68625442e-02 1.42400519e-03 -2.56743566e-05] [-5.12104303e-02 3.00741142e-10 -1.34697102e-10] [-4.34648085e-03 2.28450464e-02 -3.08317359e-02] [-4.34648010e-03 -2.28450467e-02 3.08317355e-02] [-4.35907845e-02 -2.31181150e-11 -5.56492811e-12] [-5.84511357e-03 2.60670262e-02 3.41035992e-02] [-5.84511359e-03 -2.60670262e-02 -3.41035992e-02] [ 1.91533060e-02 -1.88066210e-02 -2.90635944e-03] [ 2.15763512e-02 -1.29761556e-02 -2.94410941e-03] [ 1.91533061e-02 1.88066210e-02 2.90635891e-03] [ 2.15763512e-02 1.29761556e-02 2.94410937e-03]] Final stress: [-3.56688213e-05 -2.46721043e-04 3.32256409e-04 2.04004083e-03 1.53484920e-13 -2.19001664e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.14502541e-12 1.82842759e-02 -1.39139228e-10] [ 1.36157009e-12 1.54369230e-02 3.39659390e-10] [-1.08894499e-03 8.99942521e-03 3.74263820e-02] [ 2.61732807e-02 -3.59322768e-02 -2.04457044e-02] [-2.27736120e-02 -3.06704347e-02 -1.71715273e-02] [ 1.08894501e-03 8.99942520e-03 -3.74263820e-02] [ 2.27736118e-02 -3.06704349e-02 1.71715274e-02] [-2.61732804e-02 -3.59322769e-02 2.04457045e-02] [ 1.70815418e-02 2.32844467e-02 -2.98013836e-03] [ 1.46591573e-02 1.74582403e-02 -2.83354252e-03] [-1.46591574e-02 1.74582404e-02 2.83354208e-03] [-1.70815418e-02 2.32844465e-02 2.98013844e-03]] Final stress: [-2.46589574e-04 -3.55358836e-05 3.32013322e-04 6.69736238e-14 -2.04030239e-03 6.88947658e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.43281118e-12 -1.54363030e-02 6.63979110e-10] [ 1.45727768e-11 -1.82838650e-02 2.26940222e-10] [-1.08827512e-03 -9.00230059e-03 -3.74274247e-02] [-2.27789135e-02 3.06768901e-02 1.71718455e-02] [ 2.61782096e-02 3.59377480e-02 2.04464536e-02] [ 1.08827507e-03 -9.00230130e-03 3.74274244e-02] [-2.61782091e-02 3.59377482e-02 -2.04464539e-02] [ 2.27789127e-02 3.06768906e-02 -1.71718459e-02] [-1.46485973e-02 -1.74627363e-02 -2.82534827e-03] [-1.70712934e-02 -2.32895172e-02 -2.97196420e-03] [ 1.70712936e-02 -2.32895172e-02 2.97196431e-03] [ 1.46485974e-02 -1.74627363e-02 2.82534812e-03]] Final stress: [-2.46541816e-04 -3.54662897e-05 3.31921117e-04 -2.84546019e-13 2.04049223e-03 -8.28240364e-14] Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.56708362e-04 -1.84855613e-04 8.71192618e-06] [ 2.56708661e-04 1.84855795e-04 8.72743540e-06] [ 1.27861208e-03 2.55748297e-04 1.33678201e-03] [ 7.20704289e-03 5.43111997e-03 2.66682306e-03] [ 6.87639108e-03 -5.55295421e-03 -4.02673746e-03] [-1.27861202e-03 -2.55753957e-04 1.33677971e-03] [-7.20704433e-03 -5.43112067e-03 2.66682357e-03] [-6.87639840e-03 5.55295845e-03 -4.02674083e-03] [ 8.26309409e-03 -1.59606016e-03 6.11853600e-04] [-8.26308955e-03 1.59606020e-03 6.11843666e-04] [ 6.76625657e-03 1.48090779e-03 -5.97435673e-04] [-6.76625271e-03 -1.48090589e-03 -5.97431004e-04]] Final stress: [ 9.62826398e-06 1.47798401e-04 5.19873833e-06 -6.31589123e-12 2.12466595e-12 -1.63820049e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 2.58601009e-04 -1.84778058e-04 -8.67993028e-06] [-2.58600547e-04 1.84778302e-04 -8.66912157e-06] [ 1.27877857e-03 -2.52517737e-04 -1.32814165e-03] [ 6.88085483e-03 5.54469126e-03 4.02171417e-03] [ 7.19927282e-03 -5.43767839e-03 -2.67046118e-03] [-1.27877837e-03 2.52500832e-04 -1.32814844e-03] [-6.88085708e-03 -5.54469248e-03 4.02171467e-03] [-7.19928562e-03 5.43768597e-03 -2.67046725e-03] [ 6.75660130e-03 -1.48195649e-03 6.02899619e-04] [-6.75659292e-03 1.48195995e-03 6.02887974e-04] [ 8.26968056e-03 1.59427324e-03 -6.17323679e-04] [-8.26967454e-03 -1.59426639e-03 -6.17325193e-04]] Final stress: [ 9.66652935e-06 1.47809364e-04 5.10997954e-06 -1.23106822e-11 8.34296511e-12 1.63873984e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.47620145e-05 -2.89198757e-03 -1.07406189e-04] [ 1.47620083e-05 2.89198757e-03 1.07404705e-04] [ 4.38557180e-02 -4.42454761e-10 1.86862737e-10] [-1.29306031e-02 -8.21024616e-02 2.44080890e-02] [-1.29306047e-02 8.21024625e-02 -2.44080882e-02] [ 1.06920754e-01 -1.83216189e-10 -8.48055673e-11] [-3.64729328e-02 -3.36929910e-02 -1.91136886e-02] [-3.64729330e-02 3.36929911e-02 1.91136885e-02] [-1.69126339e-02 1.50733528e-02 -1.48310297e-04] [-9.08682744e-03 2.72884052e-02 -5.25087024e-06] [-1.69126339e-02 -1.50733528e-02 1.48311248e-04] [-9.08682734e-03 -2.72884056e-02 5.25068190e-06]] Final stress: [-1.48113519e-03 -1.93612977e-03 -1.57192582e-04 -3.07028272e-03 -2.24512051e-13 1.20519693e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.44503644e-05 -2.89197776e-03 1.07405629e-04] [-1.44503514e-05 2.89197777e-03 -1.07407645e-04] [-1.06917617e-01 -9.39558070e-10 3.93917923e-10] [ 3.64657892e-02 3.36859279e-02 -1.91167006e-02] [ 3.64657872e-02 -3.36859267e-02 1.91167015e-02] [-4.38512274e-02 1.52044927e-10 5.55739835e-11] [ 1.29227329e-02 8.20964574e-02 2.44109558e-02] [ 1.29227326e-02 -8.20964572e-02 -2.44109559e-02] [ 9.09228931e-03 -2.72950373e-02 -4.56465399e-06] [ 1.69180623e-02 -1.50799648e-02 -1.47612892e-04] [ 9.09228940e-03 2.72950370e-02 4.56576407e-06] [ 1.69180623e-02 1.50799645e-02 1.47612549e-04]] Final stress: [-1.48116902e-03 -1.93616227e-03 -1.57235926e-04 3.07019716e-03 -7.22335146e-13 -2.36418384e-13] Minimization converged after 65 steps. Minimization converged after 62 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 64 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.59268502e-11 2.87633300e-03 -6.08115870e-10] [-4.19695605e-11 -2.90538310e-03 -2.89743727e-09] [-2.52880365e-02 5.79600310e-02 2.49471737e-02] [ 7.46185742e-02 -6.69750257e-02 -1.53969442e-02] [-4.13378690e-02 -1.69767366e-02 -1.00974985e-02] [ 2.52880365e-02 5.79600329e-02 -2.49471729e-02] [ 4.13378681e-02 -1.69767372e-02 1.00974989e-02] [-7.46185713e-02 -6.69750274e-02 1.53969456e-02] [ 2.50984317e-02 1.90989742e-02 -2.95595472e-04] [ 1.72716562e-02 6.90728252e-03 1.42912033e-04] [-1.72716572e-02 6.90728238e-03 -1.42910478e-04] [-2.50984326e-02 1.90989739e-02 2.95594863e-04]] Final stress: [-1.93611227e-03 -1.48117110e-03 -1.57219737e-04 1.27076823e-12 -3.07021327e-03 3.97334893e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.79551491e-12 2.90552968e-03 -9.37325688e-10] [ 3.24772915e-12 -2.87628464e-03 -3.61195917e-09] [-2.52885126e-02 -5.79579436e-02 -2.49479807e-02] [-4.13364792e-02 1.69764248e-02 1.00978819e-02] [ 7.46177338e-02 6.69756703e-02 1.53973870e-02] [ 2.52885126e-02 -5.79579417e-02 2.49479815e-02] [-7.46177357e-02 6.69756692e-02 -1.53973860e-02] [ 4.13364818e-02 1.69764234e-02 -1.00978807e-02] [-1.72733398e-02 -6.90845257e-03 1.43084298e-04] [-2.51001842e-02 -1.91003211e-02 -2.95434942e-04] [ 2.51001838e-02 -1.91003208e-02 2.95436972e-04] [ 1.72733397e-02 -6.90845296e-03 -1.43084706e-04]] Final stress: [-1.93614608e-03 -1.48119849e-03 -1.57230188e-04 9.89312589e-13 3.07021851e-03 1.29278900e-12] Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 69 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.65986611e-09 8.99333221e-04 1.02370128e-08] [-2.01146223e-09 -8.99333215e-04 3.62552493e-08] [-2.57550217e-04 1.74353529e-08 -7.58377922e-09] [ 1.27107486e-04 3.76238701e-04 -4.44553946e-04] [ 1.27172357e-04 -3.76275669e-04 4.44523702e-04] [ 2.57548820e-04 1.37622174e-08 5.45046622e-09] [-1.27065212e-04 -3.76213308e-04 -4.44571568e-04] [-1.27076532e-04 3.76219398e-04 4.44567182e-04] [ 4.04242889e-04 -3.93661343e-05 -5.95422696e-05] [-4.04308966e-04 3.93824124e-05 -5.95341511e-05] [ 4.04247580e-04 3.93467909e-05 5.95170172e-05] [-4.04313533e-04 -3.93633934e-05 5.95496763e-05]] Final stress: [ 3.37467067e-06 4.71918843e-05 2.47834440e-05 1.10907705e-10 -5.94040749e-14 -8.00592321e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-9.84305068e-10 -5.97490198e-04 2.57164118e-08] [-8.68767003e-10 5.97491372e-04 -9.30000651e-08] [ 9.08462385e-05 -1.71654566e-08 6.46151629e-09] [ 1.24400497e-04 -1.88520547e-04 3.74266506e-04] [ 1.24407204e-04 1.88517071e-04 -3.74269532e-04] [-9.08472179e-05 2.77960495e-08 1.17152231e-08] [-1.24413037e-04 1.88513585e-04 3.74273184e-04] [-1.24341043e-04 -1.88554744e-04 -3.74239326e-04] [-1.20678404e-04 -2.41834777e-04 1.73423344e-04] [ 1.20657117e-04 2.41857557e-04 1.73501255e-04] [-1.20681843e-04 2.41847643e-04 -1.73436247e-04] [ 1.20652341e-04 -2.41837592e-04 -1.73470078e-04]] Final stress: [-4.09724138e-07 -2.80509698e-05 -3.26345684e-06 4.32487557e-11 2.75338496e-11 -1.53396136e-11] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 7.25823623e-10 2.68948385e-03 3.84662067e-08] [ 1.92231542e-09 -2.68948449e-03 5.13934907e-08] [-2.71647331e-04 3.85485492e-08 -1.70439199e-08] [-2.94234074e-03 6.37413879e-04 -2.29423756e-03] [-2.94221828e-03 -6.37483989e-04 2.29417926e-03] [ 2.71648187e-04 5.33162849e-08 2.08709690e-08] [ 2.94223761e-03 -6.37474119e-04 -2.29418916e-03] [ 2.94224086e-03 6.37471155e-04 2.29419208e-03] [-1.85081044e-03 -2.45310042e-03 -8.94628040e-04] [ 1.85084663e-03 2.45308172e-03 -8.94582153e-04] [-1.85079854e-03 2.45305146e-03 8.94556961e-04] [ 1.85083940e-03 -2.45305091e-03 8.94614913e-04]] Final stress: [ 2.87403843e-05 1.28385901e-04 6.77545189e-05 -6.41790861e-11 -1.38168039e-11 -1.66972257e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.30316133e-10 -2.78702249e-03 -2.90287892e-08] [ 5.79978787e-10 2.78702239e-03 9.64048557e-08] [ 2.70742306e-03 1.01521799e-08 -4.59843139e-09] [ 1.71006487e-03 1.62915756e-03 2.34403911e-03] [ 1.71007004e-03 -1.62916072e-03 -2.34404289e-03] [-2.70742234e-03 -1.29061786e-08 -5.80504439e-09] [-1.71007460e-03 -1.62916291e-03 2.34404314e-03] [-1.71008898e-03 1.62917128e-03 -2.34405129e-03] [ 1.80630365e-03 2.37273792e-03 -9.04821897e-04] [-1.80629056e-03 -2.37274247e-03 -9.04883877e-04] [ 1.80630252e-03 -2.37273350e-03 9.04802301e-04] [-1.80628886e-03 2.37273570e-03 9.04858429e-04]] Final stress: [ 1.33343871e-04 2.54670019e-05 6.84134985e-05 -2.37374821e-11 -1.89573818e-12 2.32267623e-11] Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-2.42691489e-09 3.15279065e-04 2.27495129e-08] [-3.07859145e-09 -3.15278540e-04 -4.99866773e-08] [-1.47205954e-04 -5.88217564e-08 2.35139436e-08] [-4.29737680e-04 -6.92185523e-05 -3.03921276e-04] [-4.29863704e-04 6.92907709e-05 3.03978718e-04] [ 1.47203882e-04 -2.68835674e-08 -1.19144529e-08] [ 4.29879525e-04 6.93012967e-05 -3.03986610e-04] [ 4.29885367e-04 -6.93040035e-05 3.03985605e-04] [-3.78026713e-04 -7.93954775e-05 -2.97546572e-06] [ 3.77950442e-04 7.94228198e-05 -2.99044671e-06] [-3.78033876e-04 7.94242490e-05 3.00427788e-06] [ 3.77954217e-04 -7.94359229e-05 2.92083464e-06]] Final stress: [1.95581705e-05 2.23268669e-05 5.23457153e-05 1.31626895e-10 1.18707408e-11 8.57997643e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.43934770e-09 4.49718807e-03 4.47040487e-08] [ 5.52750552e-09 -4.49719226e-03 -2.19903618e-07] [ 3.80891672e-04 -8.08283773e-09 3.73353209e-09] [-1.08685201e-02 -3.39553365e-03 -7.17617674e-03] [-1.08685678e-02 3.39555973e-03 7.17619888e-03] [-3.80889755e-04 1.45929617e-07 5.76996033e-08] [ 1.08683902e-02 3.39545357e-03 -7.17611722e-03] [ 1.08684636e-02 -3.39549908e-03 7.17615453e-03] [-8.22236093e-03 2.64070335e-03 -2.34761527e-03] [ 8.22245570e-03 -2.64078895e-03 -2.34745494e-03] [-8.22233458e-03 -2.64080073e-03 2.34760695e-03] [ 8.22246303e-03 2.64077212e-03 2.34751757e-03]] Final stress: [ 5.03631931e-06 2.12100098e-04 8.91309209e-05 -1.91118425e-10 -1.07076895e-10 -1.68099234e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-3.25041470e-09 -2.75074060e-04 -2.64403777e-08] [-1.95817912e-09 2.75072517e-04 -1.14274432e-07] [ 2.21598870e-04 -1.18603762e-08 9.82838452e-09] [ 7.62431863e-05 9.93943425e-05 1.95804337e-04] [ 7.62482841e-05 -9.93972627e-05 -1.95795796e-04] [-2.21600631e-04 -7.12617871e-08 -2.58155237e-08] [-7.60541069e-05 -9.92853114e-05 1.95717212e-04] [-7.62816505e-05 9.94153901e-05 -1.95814247e-04] [ 5.70148348e-05 -7.83467026e-05 -4.90577318e-06] [-5.70948144e-05 7.83435916e-05 -4.93821672e-06] [ 5.70287041e-05 7.82895823e-05 5.10214802e-06] [-5.70974674e-05 -7.83289643e-05 4.98703703e-06]] Final stress: [ 1.57027135e-05 4.41441955e-06 4.47163360e-05 1.23756462e-10 -3.68731626e-11 -1.50577988e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.40788686e-10 -2.39585834e-04 -9.55921514e-08] [-1.06138498e-09 2.39586797e-04 3.06237766e-08] [ 8.44091617e-05 6.78132026e-08 -2.76620367e-08] [ 1.09360070e-04 -7.95034194e-05 1.78549073e-04] [ 1.09447012e-04 7.94532483e-05 -1.78591131e-04] [-8.44088835e-05 4.74367987e-08 2.15044392e-08] [-1.09461636e-04 7.94463017e-05 1.78598741e-04] [-1.09307074e-04 -7.95336661e-05 -1.78524370e-04] [ 2.38748506e-05 -1.62983780e-04 -9.45911124e-05] [-2.38896783e-05 1.62998648e-04 -9.45631883e-05] [ 2.38635748e-05 1.63022469e-04 9.45232198e-05] [-2.38861953e-05 -1.63016014e-04 9.46698932e-05]] Final stress: [-2.16925050e-06 -1.55223885e-05 -2.72096549e-05 2.93294957e-11 2.33650215e-11 1.14940432e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.72814423e-03 1.07126619e-02 -2.13579764e-04] [-3.72814423e-03 -1.07126619e-02 2.13580778e-04] [ 1.51962962e-02 5.12352877e-10 -2.06995902e-10] [-1.68108426e-04 -1.42420316e-02 1.18352115e-02] [-1.68108195e-04 1.42420314e-02 -1.18352116e-02] [ 2.48126373e-03 -1.74841748e-10 -6.94185888e-11] [-2.93938873e-03 2.36136511e-03 -3.48596161e-03] [-2.93938906e-03 -2.36136491e-03 3.48596145e-03] [-6.07609471e-04 -1.93174412e-03 -5.92441911e-03] [-1.39552909e-03 4.06305192e-04 -6.19509508e-03] [-6.07609480e-04 1.93174410e-03 5.92441884e-03] [-1.39552899e-03 -4.06305547e-04 6.19509491e-03]] Final stress: [-2.64260772e-04 -1.22109697e-04 6.60318585e-05 -7.81717438e-04 -3.40527233e-13 6.50756902e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.72785546e-03 1.07116222e-02 2.13566832e-04] [ 3.72785547e-03 -1.07116223e-02 -2.13565039e-04] [-2.48135244e-03 7.41590165e-10 -3.10083450e-10] [ 2.93917491e-03 -2.36093366e-03 -3.48560283e-03] [ 2.93917668e-03 2.36093265e-03 3.48560201e-03] [-1.51935599e-02 2.27557653e-10 9.37041111e-11] [ 1.68106076e-04 1.42399695e-02 1.18344058e-02] [ 1.68105191e-04 -1.42399690e-02 -1.18344062e-02] [ 1.39444849e-03 -4.06148052e-04 -6.19473047e-03] [ 6.07870733e-04 1.93125320e-03 -5.92407695e-03] [ 1.39444867e-03 4.06147355e-04 6.19472985e-03] [ 6.07870662e-04 -1.93125294e-03 5.92407719e-03]] Final stress: [-2.64240709e-04 -1.22093512e-04 6.60297168e-05 7.81670519e-04 -3.55995744e-13 -2.00422892e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.31607573e-03 -4.96146109e-03 -4.02679643e-06] [-2.31607573e-03 4.96146110e-03 4.02737395e-06] [-9.60808834e-04 1.29198204e-11 -1.01659763e-11] [-2.47038651e-04 9.28104701e-04 2.09887890e-03] [-2.47038366e-04 -9.28104866e-04 -2.09887904e-03] [ 6.45097216e-03 -2.34935037e-10 -9.68354147e-11] [ 9.40477733e-05 -4.20169901e-03 -5.38662669e-03] [ 9.40475375e-05 4.20169915e-03 5.38662657e-03] [-5.93455354e-04 6.22867403e-03 1.52951088e-03] [ 3.17440303e-04 -1.50959434e-04 1.53680543e-03] [-5.93455380e-04 -6.22867393e-03 -1.52951095e-03] [ 3.17440280e-04 1.50959582e-04 -1.53680558e-03]] Final stress: [ 2.70840151e-05 1.79449745e-05 -4.32167159e-06 -2.40198098e-04 1.71471566e-13 -1.36026787e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.31607697e-03 -4.96146380e-03 4.02739093e-06] [ 2.31607697e-03 4.96146380e-03 -4.02683971e-06] [-6.45098444e-03 5.25362060e-11 -2.12759500e-11] [-9.40521060e-05 4.20170274e-03 -5.38663413e-03] [-9.40521871e-05 -4.20170270e-03 5.38663416e-03] [ 9.60811050e-04 -1.94377930e-10 -8.36229527e-11] [ 2.47093582e-04 -9.28073349e-04 2.09885704e-03] [ 2.47093256e-04 9.28073540e-04 -2.09885720e-03] [-3.17495538e-04 1.50973337e-04 1.53680591e-03] [ 5.93463982e-04 -6.22868466e-03 1.52951112e-03] [-3.17495550e-04 -1.50973333e-04 -1.53680593e-03] [ 5.93464012e-04 6.22868457e-03 -1.52951142e-03]] Final stress: [ 2.70841929e-05 1.79447378e-05 -4.32168262e-06 2.40198358e-04 -5.90065703e-14 1.68128819e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.74596574e-11 1.48089198e-02 -5.73188402e-10] [-3.45386919e-11 -7.44727780e-03 -1.91867681e-10] [ 6.76415237e-03 4.49337379e-03 8.84029032e-03] [ 7.78049263e-03 -1.35006099e-02 -3.83945784e-04] [-4.60617455e-03 3.36578412e-03 -7.99176674e-03] [-6.76415240e-03 4.49337449e-03 -8.84029004e-03] [ 4.60617522e-03 3.36578450e-03 7.99176646e-03] [-7.78049126e-03 -1.35006107e-02 3.83946414e-04] [ 2.68578117e-05 6.15620476e-04 -6.08941298e-03] [-1.54588947e-03 1.34501057e-03 -6.03145349e-03] [ 1.54588853e-03 1.34501018e-03 6.03145333e-03] [-2.68588111e-05 6.15620367e-04 6.08941327e-03]] Final stress: [-2.93173344e-04 -9.41783788e-05 6.57143540e-05 1.65408241e-12 -7.83547527e-04 -6.32302750e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.18557526e-12 7.45248316e-03 -4.45931088e-10] [-6.83215120e-12 -1.48178428e-02 -1.57015507e-09] [ 6.77422675e-03 -4.49728844e-03 -8.84456655e-03] [-4.61095377e-03 -3.36809968e-03 7.99520221e-03] [ 7.78678493e-03 1.35142903e-02 3.84881915e-04] [-6.77422678e-03 -4.49728772e-03 8.84456686e-03] [-7.78678593e-03 1.35142897e-02 -3.84881436e-04] [ 4.61095504e-03 -3.36810039e-03 -7.99520162e-03] [ 1.55246763e-03 -1.34894810e-03 -6.03419164e-03] [-2.99196025e-05 -6.17273975e-04 -6.09276644e-03] [ 2.99194136e-05 -6.17273718e-04 6.09276725e-03] [-1.55246769e-03 -1.34894841e-03 6.03419145e-03]] Final stress: [-2.93312699e-04 -9.42400392e-05 6.57510497e-05 2.62659908e-13 7.83874502e-04 1.17512380e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.13958138e-12 -2.58611065e-03 2.02579543e-11] [-3.98654419e-12 7.23269157e-03 -1.10670339e-12] [-3.64667318e-03 9.43634073e-04 4.37119649e-03] [ 1.56140587e-03 7.68127126e-04 -3.82272498e-03] [-1.86767322e-03 -4.31614721e-03 -4.46218366e-04] [ 3.64667318e-03 9.43634003e-04 -4.37119652e-03] [ 1.86767339e-03 -4.31614710e-03 4.46218287e-04] [-1.56140584e-03 7.68127109e-04 3.82272499e-03] [ 2.62727288e-03 3.42369947e-03 1.63054031e-03] [ 3.44354678e-03 -3.14260391e-03 1.44222237e-03] [-3.44354687e-03 -3.14260395e-03 -1.44222233e-03] [-2.62727298e-03 3.42369945e-03 -1.63054028e-03]] Final stress: [ 2.37112644e-05 2.14375813e-05 -4.35587155e-06 1.88450438e-13 -2.39745333e-04 -2.59561706e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.12677315e-12 -7.23499238e-03 -1.25904056e-11] [-2.46012576e-12 2.58532265e-03 1.56948441e-11] [-3.65073172e-03 -9.44584869e-04 -4.37301461e-03] [-1.86730596e-03 4.31916661e-03 4.47024815e-04] [ 1.56386113e-03 -7.69272275e-04 3.82377037e-03] [ 3.65073171e-03 -9.44584887e-04 4.37301460e-03] [-1.56386119e-03 -7.69272308e-04 -3.82377034e-03] [ 1.86730603e-03 4.31916657e-03 -4.47024790e-04] [-3.44782599e-03 3.14649977e-03 1.44194222e-03] [-2.63002847e-03 -3.42697432e-03 1.63023971e-03] [ 2.63002847e-03 -3.42697428e-03 -1.63023974e-03] [ 3.44782598e-03 3.14649972e-03 -1.44194222e-03]] Final stress: [ 2.36225496e-05 2.14508104e-05 -4.36675345e-06 4.13871357e-14 2.39767032e-04 2.42185606e-13] Minimization converged after 47 steps. Minimization converged after 48 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.30620825e-04 -8.56000757e-05 8.31816894e-07] [-1.30620731e-04 8.56001305e-05 8.36623111e-07] [-8.81482360e-04 -6.02466226e-04 1.83301179e-04] [ 5.51256427e-04 -6.94027603e-04 9.12419325e-05] [ 9.71424128e-04 2.11165509e-04 -2.75700760e-04] [ 8.81482410e-04 6.02467389e-04 1.83301709e-04] [-5.51260338e-04 6.94025353e-04 9.12437298e-05] [-9.71422864e-04 -2.11166223e-04 -2.75700130e-04] [ 6.87270029e-04 -1.08459958e-03 1.08508944e-04] [-6.87268575e-04 1.08460015e-03 1.08508218e-04] [-2.47549345e-04 -3.43696195e-04 -1.08188535e-04] [ 2.47550392e-04 3.43697374e-04 -1.08184728e-04]] Final stress: [-4.15660287e-05 -5.50171880e-05 -1.66075044e-05 -2.13703251e-12 1.38745706e-12 -2.31588947e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.28446856e-04 -8.45126353e-05 -8.23271121e-07] [ 1.28446942e-04 8.45126783e-05 -8.19803962e-07] [-8.81257737e-04 6.02185462e-04 -1.83463867e-04] [ 9.72088055e-04 -2.12416275e-04 2.75699497e-04] [ 5.51318481e-04 6.93597645e-04 -9.10938772e-05] [ 8.81257783e-04 -6.02176231e-04 -1.83459971e-04] [-9.72098518e-04 2.12410271e-04 2.75704468e-04] [-5.51310196e-04 -6.93602402e-04 -9.10898741e-05] [-2.46992286e-04 3.42815581e-04 1.08527909e-04] [ 2.46993543e-04 -3.42815084e-04 1.08533045e-04] [ 6.87620540e-04 1.08360875e-03 -1.08861306e-04] [-6.87619751e-04 -1.08360776e-03 -1.08852949e-04]] Final stress: [-4.15935235e-05 -5.50208202e-05 -1.66210063e-05 -1.66233800e-12 1.40195958e-12 2.31347796e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.86394752e-10 -8.72365686e-04 -2.27851353e-08] [ 7.46489981e-10 8.72366748e-04 1.24321198e-07] [ 4.84233155e-04 2.75305276e-08 -1.03217755e-08] [-1.34722256e-04 -2.01831001e-04 4.92177443e-04] [-1.34642285e-04 2.01785244e-04 -4.92212198e-04] [-4.84232294e-04 -7.42787654e-08 -2.90630773e-08] [ 1.34716449e-04 2.01828341e-04 4.92178920e-04] [ 1.34610511e-04 -2.01766913e-04 -4.92227094e-04] [-3.08543871e-04 -9.83983127e-06 -6.05547061e-05] [ 3.08565280e-04 9.85047980e-06 -6.06407741e-05] [-3.08546916e-04 9.85221108e-06 6.05819333e-05] [ 3.08560895e-04 -9.83284425e-06 6.06343241e-05]] Final stress: [ 4.70037076e-05 3.64988005e-06 2.48286593e-05 -2.99621175e-11 2.53100352e-11 -1.07850011e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.69405165e-10 5.91196543e-04 -6.03429209e-08] [-4.69333669e-11 -5.91196427e-04 -7.35779174e-08] [-3.34401139e-04 -7.63742223e-08 3.12640212e-08] [-3.16075732e-06 -1.72043250e-05 -3.69693718e-04] [-3.28218082e-06 1.72745147e-05 3.69751498e-04] [ 3.34400988e-04 1.26474774e-08 4.71077660e-09] [ 3.21777774e-06 1.72372797e-05 -3.69721079e-04] [ 3.23459741e-06 -1.72470317e-05 3.69728298e-04] [ 1.17542994e-04 2.33039637e-04 1.70114891e-04] [-1.17547153e-04 -2.33036934e-04 1.70080700e-04] [ 1.17543698e-04 -2.33042491e-04 -1.70058001e-04] [-1.17548508e-04 2.33042961e-04 -1.70104642e-04]] Final stress: [-2.78137117e-05 -7.07415309e-07 -3.21812575e-06 7.53547042e-12 2.06502321e-12 -1.84505780e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.52191604e-09 -2.01384985e-04 -7.61059487e-08] [ 5.23599497e-10 2.01387661e-04 -1.83964782e-08] [ 1.13518792e-04 -7.05108028e-08 2.84523541e-08] [-4.48248029e-04 -3.06180342e-04 -4.36160382e-05] [-4.48352817e-04 3.06241415e-04 4.36652906e-05] [-1.13517799e-04 -3.54502765e-08 -1.39345692e-08] [ 4.48242409e-04 3.06177908e-04 -4.36157248e-05] [ 4.48299255e-04 -3.06209217e-04 4.36394846e-05] [-5.14555587e-04 -1.39674540e-04 5.41809293e-05] [ 5.14593123e-04 1.39704059e-04 5.41182021e-05] [-5.14571636e-04 1.39739259e-04 -5.41418611e-05] [ 5.14590243e-04 -1.39695258e-04 -5.41502978e-05]] Final stress: [ 3.01313838e-05 6.95654605e-06 5.01884116e-05 -4.86176302e-11 6.35554847e-11 1.16412861e-10] Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-5.20781906e-09 2.88545392e-04 -1.24263013e-07] [-4.27268749e-09 -2.88547107e-04 -3.37406092e-08] [-7.21294370e-06 1.06949916e-08 -1.90889335e-09] [-1.05700407e-04 1.25517639e-04 -1.49291288e-04] [-1.05689262e-04 -1.25524889e-04 1.49290629e-04] [ 7.21022197e-06 3.39670505e-08 1.55342977e-08] [ 1.05844786e-04 -1.25432855e-04 -1.49354649e-04] [ 1.05824609e-04 1.25443942e-04 1.49351120e-04] [ 1.34603270e-05 -4.36576825e-05 -5.24992191e-05] [-1.36000725e-05 4.36675693e-05 -5.25341822e-05] [ 1.34698326e-05 4.36139542e-05 5.25658729e-05] [-1.35976102e-05 -4.36706256e-05 5.26160943e-05]] Final stress: [ 4.61315212e-06 1.51182387e-05 4.54717347e-05 2.25127025e-10 -4.03338432e-11 -8.85788276e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.55185006e-09 2.71155362e-04 2.03716555e-08] [ 1.65551160e-09 -2.71155447e-04 -1.01146468e-07] [-1.91284115e-04 -9.86497795e-09 4.96121624e-09] [-9.39714307e-05 3.30042301e-05 -1.90415958e-04] [-9.40411857e-05 -3.29644540e-05 1.90448822e-04] [ 1.91285109e-04 -8.14527401e-09 -2.67219696e-09] [ 9.39290669e-05 -3.30297526e-05 -1.90397898e-04] [ 9.39603611e-05 3.30126490e-05 1.90412217e-04] [-6.34036217e-05 8.92390526e-05 -8.13172221e-05] [ 6.34626145e-05 -8.92562293e-05 -8.12737846e-05] [-6.34103331e-05 -8.92144787e-05 8.13465917e-05] [ 6.34693272e-05 8.92270782e-05 8.12757173e-05]] Final stress: [-1.24028649e-05 -3.55078458e-07 -2.62832374e-05 -1.00233880e-10 -1.34135652e-12 1.11337127e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.68098130e-03 -1.11451947e-02 2.09991852e-04] [-3.68098132e-03 1.11451947e-02 -2.09995928e-04] [-4.44638996e-03 -3.71153284e-10 1.86103326e-10] [ 7.79438859e-05 -2.90050389e-03 3.73149018e-03] [ 7.79423818e-05 2.90050474e-03 -3.73148942e-03] [ 2.16804301e-02 2.27025426e-10 1.21962570e-10] [-3.08552687e-03 -8.91084912e-03 -1.13020022e-02] [-3.08552498e-03 8.91084803e-03 1.13020032e-02] [-1.73932315e-03 -4.12178962e-04 -6.20203385e-03] [-1.89132785e-04 -1.12177501e-03 -5.92733726e-03] [-1.73932336e-03 4.12179788e-04 6.20203482e-03] [-1.89132668e-04 1.12177455e-03 5.92733837e-03]] Final stress: [-9.44736205e-05 -2.93319313e-04 6.57198656e-05 -7.83939705e-04 4.09273788e-13 2.66501373e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.68181601e-03 -1.11483531e-02 -2.10035863e-04] [ 3.68181603e-03 1.11483531e-02 2.10034869e-04] [-2.16902857e-02 -3.03444678e-10 1.47959306e-10] [ 3.08613329e-03 8.91585097e-03 -1.13042564e-02] [ 3.08613324e-03 -8.91585093e-03 1.13042565e-02] [ 4.44820246e-03 5.29664190e-12 -6.77594420e-13] [-7.79261400e-05 2.90057672e-03 3.73259974e-03] [-7.79275090e-05 -2.90057595e-03 -3.73260031e-03] [ 1.88233867e-04 1.12311637e-03 -5.92878626e-03] [ 1.74278522e-03 4.12633329e-04 -6.20355538e-03] [ 1.88234036e-04 -1.12311713e-03 5.92878736e-03] [ 1.74278516e-03 -4.12633068e-04 6.20355562e-03]] Final stress: [-9.44973987e-05 -2.93379614e-04 6.57400321e-05 7.84088825e-04 -4.79075719e-13 -2.14076173e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.32449422e-03 4.90752946e-03 3.91302225e-06] [-2.32449422e-03 -4.90752947e-03 -3.91309519e-06] [ 7.02580917e-03 -6.26356202e-11 2.55657319e-11] [-2.41903571e-04 -3.66462609e-03 5.44377901e-03] [-2.41903830e-04 3.66462624e-03 -5.44377889e-03] [-1.48543218e-03 7.10570263e-11 2.33235046e-11] [ 6.59415192e-05 3.79482034e-04 -2.06650119e-03] [ 6.59415299e-05 -3.79482038e-04 2.06650118e-03] [ 2.69238672e-04 -2.49466799e-04 1.54004640e-03] [-5.38970776e-04 6.32309840e-03 1.53288241e-03] [ 2.69238677e-04 2.49466734e-04 -1.54004638e-03] [-5.38970763e-04 -6.32309849e-03 -1.53288252e-03]] Final stress: [ 2.14728582e-05 2.35844577e-05 -4.37671517e-06 -2.39788768e-04 -8.54686080e-14 4.31968039e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.32121614e-03 4.90592403e-03 -3.94669985e-06] [ 2.32121614e-03 -4.90592403e-03 3.94705943e-06] [ 1.48273117e-03 -7.40737221e-11 2.34686638e-11] [-6.49330259e-05 -3.75047870e-04 -2.06339734e-03] [-6.49330817e-05 3.75047904e-04 2.06339735e-03] [-7.01656124e-03 -5.33924282e-11 -2.71931754e-11] [ 2.39579177e-04 3.65567065e-03 5.44015850e-03] [ 2.39579138e-04 -3.65567063e-03 -5.44015854e-03] [ 5.38007570e-04 -6.30802307e-03 1.53350887e-03] [-2.66954771e-04 2.49318752e-04 1.54064890e-03] [ 5.38007564e-04 6.30802310e-03 -1.53350899e-03] [-2.66954787e-04 -2.49318712e-04 -1.54064913e-03]] Final stress: [ 2.14448102e-05 2.37727203e-05 -4.35358863e-06 2.39742689e-04 7.76231004e-14 -4.55393303e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.73014008e-12 -7.01003987e-03 -2.34405358e-10] [-1.49587224e-11 1.44651932e-02 -1.96037603e-09] [-1.26333425e-02 5.39949679e-03 8.67510353e-03] [ 7.42424280e-03 -2.66535986e-03 -8.73628529e-03] [-3.87911019e-03 -8.42828955e-03 -4.22499186e-04] [ 1.26333425e-02 5.39949735e-03 -8.67510326e-03] [ 3.87910940e-03 -8.42829000e-03 4.22499570e-04] [-7.42424164e-03 -2.66536052e-03 8.73628584e-03] [-1.15259472e-03 2.14762337e-03 -6.04010394e-03] [-3.87087786e-04 -1.81047102e-04 -6.08457593e-03] [ 3.87087546e-04 -1.81046880e-04 6.08457726e-03] [ 1.15259461e-03 2.14762306e-03 6.04010361e-03]] Final stress: [-1.22368161e-04 -2.64340056e-04 6.60120216e-05 2.09545308e-13 -7.81890944e-04 1.06547795e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 8.90023970e-12 -1.44704964e-02 -5.65833738e-10] [ 9.62614119e-12 7.01301089e-03 -1.91123582e-09] [-1.26411509e-02 -5.40192900e-03 -8.67785593e-03] [-3.88201140e-03 8.43506595e-03 4.22895983e-04] [ 7.42824646e-03 2.66566878e-03 8.73859896e-03] [ 1.26411509e-02 -5.40192817e-03 8.67785630e-03] [-7.42824767e-03 2.66566809e-03 -8.73859838e-03] [ 3.88201205e-03 8.43506558e-03 -4.22895657e-04] [ 3.85429669e-04 1.80368287e-04 -6.08664842e-03] [ 1.15645904e-03 -2.15043121e-03 -6.04181012e-03] [-1.15645880e-03 -2.15043102e-03 6.04181138e-03] [-3.85429381e-04 1.80368238e-04 6.08664836e-03]] Final stress: [-1.22418914e-04 -2.64411757e-04 6.60350717e-05 -3.84676320e-13 7.82089279e-04 5.11754524e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.04921876e-12 7.27294103e-03 -6.70070454e-12] [-1.17787755e-12 -2.64411331e-03 -5.28395831e-10] [ 4.30770380e-03 1.11182390e-03 4.28293936e-03] [ 1.42790506e-03 -3.88669944e-03 -5.49261842e-04] [-1.69727542e-03 1.94129256e-04 -3.83672953e-03] [-4.30770381e-03 1.11182396e-03 -4.28293932e-03] [ 1.69727522e-03 1.94129142e-04 3.83672963e-03] [-1.42790494e-03 -3.88669952e-03 5.49261909e-04] [ 3.48305771e-03 -3.05322863e-03 1.43932720e-03] [ 2.58409268e-03 3.31956112e-03 1.62828497e-03] [-2.58409265e-03 3.31956118e-03 -1.62828456e-03] [-3.48305766e-03 -3.05322869e-03 -1.43932728e-03]] Final stress: [ 1.79591301e-05 2.71172017e-05 -4.32356822e-06 -2.91699187e-14 -2.40189077e-04 2.95828213e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.15591710e-12 2.64345108e-03 7.87739397e-11] [-4.81781370e-12 -7.27495216e-03 -5.27565113e-10] [ 4.31017718e-03 -1.11270592e-03 -4.28450872e-03] [-1.69886304e-03 -1.96064759e-04 3.83763240e-03] [ 1.42830630e-03 3.89018057e-03 5.49900104e-04] [-4.31017719e-03 -1.11270561e-03 4.28450884e-03] [-1.42830644e-03 3.89018049e-03 -5.49900038e-04] [ 1.69886348e-03 -1.96065012e-04 -3.83763221e-03] [-2.58637265e-03 -3.32234487e-03 1.62802660e-03] [-3.48687036e-03 3.05668558e-03 1.43908602e-03] [ 3.48687021e-03 3.05668555e-03 -1.43908570e-03] [ 2.58637251e-03 -3.32234492e-03 -1.62802685e-03]] Final stress: [ 1.79689165e-05 2.70416236e-05 -4.33308919e-06 2.53720011e-13 2.40208779e-04 6.08754607e-14] Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.53069510e-04 5.60847744e-05 8.49441502e-07] [-1.53069780e-04 -5.60847188e-05 8.70158775e-07] [-7.54434450e-04 4.33713313e-05 -6.19702768e-05] [ 1.08618920e-03 -4.81644057e-04 2.68121938e-04] [ 9.30731410e-04 2.93367825e-04 -2.07325162e-04] [ 7.54434424e-04 -4.33780851e-05 -6.19730744e-05] [-1.08618082e-03 4.81649020e-04 2.68118000e-04] [-9.30732704e-04 -2.93367202e-04 -2.07325918e-04] [ 1.29484110e-03 -1.02285324e-04 1.08317694e-04] [-1.29484437e-03 1.02286692e-04 1.08304017e-04] [ 1.22852940e-04 -4.13308529e-04 -1.07996334e-04] [-1.22856459e-04 4.13308273e-04 -1.07990483e-04]] Final stress: [-6.31698839e-05 -3.37039489e-05 -1.66682743e-05 5.71331748e-12 9.17425457e-13 -1.97258028e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.51635066e-04 5.54348018e-05 -8.34135346e-07] [ 1.51635322e-04 -5.54350611e-05 -8.16830897e-07] [-7.53488244e-04 -3.92812079e-05 5.99602078e-05] [ 9.31316368e-04 -2.91500097e-04 2.08298831e-04] [ 1.08664844e-03 4.87594662e-04 -2.67114862e-04] [ 7.53488370e-04 3.92956024e-05 5.99660577e-05] [-9.31326654e-04 2.91494087e-04 2.08303729e-04] [-1.08664586e-03 -4.87596254e-04 -2.67113360e-04] [ 1.18238578e-04 4.22929543e-04 1.07353146e-04] [-1.18235746e-04 -4.22933756e-04 1.07351402e-04] [ 1.30185329e-03 1.05150953e-04 -1.07684382e-04] [-1.30184880e-03 -1.05153273e-04 -1.07669804e-04]] Final stress: [-6.32708191e-05 -3.37301144e-05 -1.66859335e-05 -6.16483895e-12 -5.60080932e-12 1.98324390e-05] Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.81087096e-03 -1.89128583e-04 -1.23418003e-06] [-5.81087096e-03 1.89128610e-04 1.23450517e-06] [ 1.48780663e-02 4.56289613e-10 -1.85311160e-10] [-1.14642814e-03 -1.28443970e-02 1.04307884e-02] [-1.14642707e-03 1.28443963e-02 -1.04307889e-02] [ 1.93889723e-02 3.97030816e-10 1.62440319e-10] [-3.09289620e-03 -9.39027184e-03 -1.00001779e-02] [-3.09289534e-03 9.39027133e-03 1.00001784e-02] [-3.70228911e-03 4.65052464e-03 2.28278735e-04] [-3.38103583e-03 5.42159099e-03 2.30149966e-04] [-3.70228914e-03 -4.65052454e-03 -2.28279526e-04] [-3.38103587e-03 -5.42159082e-03 -2.30149400e-04]] Final stress: [-9.77566991e-05 -1.25363039e-04 2.37840485e-05 -7.52358676e-04 2.50018358e-13 -1.16770703e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.81079053e-03 -1.89124387e-04 1.23410227e-06] [ 5.81079056e-03 1.89124392e-04 -1.23196242e-06] [-1.93884276e-02 7.12807141e-10 -3.20540757e-10] [ 3.09293867e-03 9.38974748e-03 -1.00000006e-02] [ 3.09294097e-03 -9.38974876e-03 9.99999954e-03] [-1.48772585e-02 1.55917183e-10 6.64638770e-11] [ 1.14633116e-03 1.28441088e-02 1.04305967e-02] [ 1.14633105e-03 -1.28441088e-02 -1.04305968e-02] [ 3.38076916e-03 -5.42166717e-03 2.30370923e-04] [ 3.70201243e-03 -4.65062069e-03 2.28499986e-04] [ 3.38076921e-03 5.42166698e-03 -2.30372044e-04] [ 3.70201230e-03 4.65062124e-03 -2.28499635e-04]] Final stress: [-9.77643274e-05 -1.25369888e-04 2.37756331e-05 7.52346268e-04 3.35747845e-13 -1.61583596e-12] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.36995863e-12 6.00009493e-03 4.13746609e-10] [ 1.94704198e-11 5.62184186e-03 2.53195678e-10] [-1.89146724e-03 8.53671517e-03 1.17930432e-02] [ 1.22186727e-02 -1.25797612e-02 -6.11627725e-03] [-1.00182235e-02 -8.85121921e-03 -5.68562334e-03] [ 1.89146726e-03 8.53671527e-03 -1.17930432e-02] [ 1.00182233e-02 -8.85121934e-03 5.68562340e-03] [-1.22186733e-02 -1.25797608e-02 6.11627695e-03] [ 5.19709310e-03 3.92715120e-03 2.25349352e-04] [ 4.87584495e-03 3.15614538e-03 2.32077321e-04] [-4.87584453e-03 3.15614532e-03 -2.32077450e-04] [-5.19709276e-03 3.92715145e-03 -2.25349643e-04]] Final stress: [-1.25377979e-04 -9.77711496e-05 2.37872239e-05 -5.92536176e-13 -7.52367708e-04 -6.44051078e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.37935424e-12 -5.62182245e-03 2.20343144e-10] [-6.56342587e-12 -6.00007359e-03 1.53998581e-10] [-1.89059422e-03 -8.53669826e-03 -1.17931974e-02] [-1.00190716e-02 8.85270681e-03 5.68569557e-03] [ 1.22186479e-02 1.25797302e-02 6.11635853e-03] [ 1.89059419e-03 -8.53669859e-03 1.17931972e-02] [-1.22186474e-02 1.25797305e-02 -6.11635878e-03] [ 1.00190715e-02 8.85270693e-03 -5.68569567e-03] [-4.87464229e-03 -3.15689164e-03 2.32685396e-04] [-5.19589115e-03 -3.92789909e-03 2.25957868e-04] [ 5.19589101e-03 -3.92789917e-03 -2.25957808e-04] [ 4.87464212e-03 -3.15689163e-03 -2.32685348e-04]] Final stress: [-1.25324166e-04 -9.77171837e-05 2.38017828e-05 2.56626467e-13 7.52378825e-04 -1.26633673e-13] Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.61039127e-02 1.95547304e-02 7.15615523e-05] [-2.30029854e-02 1.95522823e-02 -7.15625025e-05] [ 7.50261442e-02 2.54835346e-02 3.57429367e-02] [ 3.89429224e-02 -8.79582079e-02 1.75589887e-02] [-4.70876432e-02 -1.07721646e-02 -5.27689486e-02] [ 6.69659604e-02 2.74524171e-02 -4.58130593e-02] [ 4.10016004e-02 -8.95529217e-02 -1.25181292e-02] [-4.10880618e-02 1.58616876e-03 5.77982208e-02] [ 2.70999602e-03 3.91838280e-02 -7.28762453e-03] [-1.21946236e-02 4.59858190e-02 -7.82225118e-03] [-5.00354176e-02 1.32572880e-03 7.69896803e-03] [-3.51339792e-02 8.15878534e-03 7.41089952e-03]] Final stress: [ 0.00021079 0.00021083 0.0010025 -0.00238347 -0.00238347 -0.00027646] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.30029855e-02 -1.95522823e-02 7.15624781e-05] [-1.61039127e-02 -1.95547304e-02 -7.15613202e-05] [ 7.50261442e-02 -2.54835352e-02 -3.57429367e-02] [-4.70876437e-02 1.07721642e-02 5.27689487e-02] [ 3.89429227e-02 8.79582089e-02 -1.75589888e-02] [ 6.69659611e-02 -2.74524177e-02 4.58130593e-02] [-4.10880625e-02 -1.58616854e-03 -5.77982211e-02] [ 4.10016002e-02 8.95529220e-02 1.25181291e-02] [-5.00354181e-02 -1.32572819e-03 -7.69896758e-03] [-3.51339795e-02 -8.15878484e-03 -7.41089948e-03] [ 2.70999675e-03 -3.91838284e-02 7.28762434e-03] [-1.21946231e-02 -4.59858194e-02 7.82225097e-03]] Final stress: [ 0.00021079 0.00021083 0.0010025 -0.00238347 0.00238347 0.00027646] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.61055642e-02 1.95555845e-02 -7.15333769e-05] [ 2.30030433e-02 1.95531374e-02 7.15349314e-05] [-6.69496120e-02 2.74411699e-02 4.58120470e-02] [ 4.10684120e-02 1.59008474e-03 -5.77977260e-02] [-4.10090613e-02 -8.95579227e-02 1.25184743e-02] [-7.50348300e-02 2.54727198e-02 -3.57436592e-02] [ 4.70799793e-02 -1.07885762e-02 5.27693189e-02] [-3.89373335e-02 -8.79401721e-02 -1.75584647e-02] [ 3.51289432e-02 8.17461553e-03 -7.41757045e-03] [ 5.00270233e-02 1.34314268e-03 -7.70553060e-03] [ 1.22095654e-02 4.59783188e-02 7.82878865e-03] [-2.69169387e-03 3.91778977e-02 7.29432057e-03]] Final stress: [ 0.00021151 0.00021156 0.00100278 0.00238326 -0.00238327 0.0002764 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.30029297e-02 -1.95519688e-02 -7.15708969e-05] [ 1.61033419e-02 -1.95544173e-02 7.15702294e-05] [-6.69713321e-02 -2.74561273e-02 -4.58133342e-02] [-4.09990483e-02 8.95511175e-02 -1.25180015e-02] [ 4.10945640e-02 -1.58484508e-03 5.77983129e-02] [-7.50231270e-02 -2.54871060e-02 3.57426580e-02] [-3.89447378e-02 8.79641082e-02 1.75591384e-02] [ 4.70901236e-02 1.07666616e-02 -5.27687646e-02] [ 1.21896192e-02 -4.59882498e-02 -7.82005071e-03] [-2.71608488e-03 -3.91857520e-02 -7.28537330e-03] [ 3.51356148e-02 -8.15349443e-03 7.40865644e-03] [ 5.00381368e-02 -1.31992654e-03 7.69675916e-03]] Final stress: [ 0.00021055 0.00021059 0.00100241 0.00238353 0.00238353 -0.00027648] Minimization converged after 72 steps. Minimization converged after 70 steps. Minimization converged after 69 steps. Minimization converged after 70 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[-0.01260172 0.01490423 0.01071655] [ 0.01321399 -0.0040227 0.00160518] [ 0.01616254 -0.02219693 0.02216564] [-0.00013904 -0.00687938 0.01258365] [-0.00769323 0.00578471 0.0178666 ] [ 0.00705301 0.01259464 -0.02082361] [ 0.00161664 -0.02140412 -0.0210663 ] [ 0.01188042 -0.0049638 -0.00862089] [-0.00512882 -0.01024582 -0.01018444] [ 0.00150041 -0.02856556 -0.01643393] [-0.01372827 0.03042692 0.03616794] [-0.01213592 0.03456781 -0.02397639]] Final stress: [ 0.00556999 0.00312409 0.03286052 -0.00013005 -0.00892957 0.00320358] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 0.01212915 0.01428275 -0.01017735] [-0.0130636 -0.00457981 -0.00201343] [-0.00757528 0.01270459 0.02039454] [-0.01175837 -0.00544416 0.00844539] [-0.00176167 -0.02113839 0.02179543] [-0.0157275 -0.02281469 -0.02266831] [ 0.00860704 0.00555563 -0.01858271] [-0.00094258 -0.00611498 -0.01285937] [ 0.01175189 0.03499394 0.02441177] [ 0.0133127 0.03056179 -0.03562422] [-0.00116111 -0.02864917 0.01820471] [ 0.00618933 -0.00935751 0.00867355]] Final stress: [ 0.00554804 0.00312009 0.03282951 0.00011562 -0.00893473 -0.00320568] Minimization converged after 73 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 59 steps. Final forces: [[ 0.01315635 0.0042372 -0.00177695] [-0.01241306 -0.01464599 -0.0104777 ] [ 0.01598502 0.0224284 -0.0223592 ] [-0.00803582 -0.00569113 -0.01813499] [ 0.00028761 0.0065761 -0.01268523] [ 0.00726315 -0.01263101 0.02063437] [ 0.01181427 0.00515611 0.00853923] [ 0.00165933 0.02128103 0.02132828] [-0.01355413 -0.03047253 -0.03592834] [-0.01198581 -0.03471821 0.02413163] [-0.0055314 0.0098997 0.00959287] [ 0.00135449 0.02858032 0.01713602]] Final stress: [ 0.00556103 0.00312199 0.03284773 -0.00012436 0.00893112 -0.00320495] Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.78757906e-10 9.10455344e-03 -9.09510933e-09] [-6.49311924e-11 -9.10455304e-03 -4.87866837e-09] [-2.73679633e-03 1.26514084e-08 -4.49138401e-09] [-2.26320410e-04 3.70660830e-03 -5.96183864e-03] [-2.26308857e-04 -3.70661512e-03 5.96183416e-03] [ 2.73679647e-03 -1.80511392e-08 -6.41483506e-09] [ 2.26310537e-04 -3.70661392e-03 -5.96183422e-03] [ 2.26310707e-04 3.70661422e-03 5.96183510e-03] [ 2.53606746e-03 -1.22384079e-03 -1.36975975e-03] [-2.53606216e-03 1.22384564e-03 -1.36975981e-03] [ 2.53606311e-03 1.22385802e-03 1.36977208e-03] [-2.53606073e-03 -1.22385135e-03 1.36977596e-03]] Final stress: [-1.69025224e-04 3.50834275e-04 1.07077812e-04 -6.05146269e-12 1.00880276e-11 4.78534334e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-3.18532341e-08 -2.35243947e-03 -2.40570130e-07] [-2.93973229e-08 2.35242382e-03 -1.66828938e-06] [-6.42686321e-05 -1.17552429e-06 4.84722664e-07] [-9.51705269e-03 -6.90163273e-03 -2.40849817e-03] [-9.51894363e-03 6.90272939e-03 2.40940659e-03] [ 6.42432702e-05 2.89148592e-07 1.05009718e-07] [ 9.51905936e-03 6.90279186e-03 -2.40942248e-03] [ 9.51861346e-03 -6.90255158e-03 2.40922070e-03] [-1.09204197e-02 -2.19784920e-03 3.19521945e-03] [ 1.09195670e-02 2.19783757e-03 3.19511571e-03] [-1.09202799e-02 2.19733679e-03 -3.19413442e-03] [ 1.09195426e-02 -2.19776007e-03 -3.19558827e-03]] Final stress: [ 2.56108018e-04 -3.33690181e-04 -5.41593309e-05 1.41402097e-09 -3.25530849e-10 -1.19632613e-09] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.97629646e-09 2.00052971e-04 7.92526553e-08] [ 1.99845367e-09 -2.00054301e-04 2.04384913e-07] [ 8.73134920e-05 8.02309095e-08 -3.21198855e-08] [ 2.68689187e-05 1.58370344e-04 -1.08749198e-04] [ 2.69814563e-05 -1.58435582e-04 1.08696577e-04] [-8.73118303e-05 -9.13233691e-08 -3.76093618e-08] [-2.68853229e-05 -1.58380425e-04 -1.08743155e-04] [-2.70844421e-05 1.58494877e-04 1.08650016e-04] [ 2.14812995e-04 2.27152469e-04 -7.90236466e-05] [-2.14760478e-04 -2.27184868e-04 -7.91064981e-05] [ 2.14818512e-04 -2.27174817e-04 7.90135898e-05] [-2.14757276e-04 2.27170425e-04 7.90484067e-05]] Final stress: [ 5.76903187e-06 1.93619672e-05 1.61806213e-05 -9.49560269e-11 -3.03472618e-11 -1.57866034e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-9.73757713e-10 -3.17642313e-04 7.45792708e-08] [-1.22562166e-09 3.17639785e-04 2.34681357e-07] [ 1.27568820e-05 1.47284418e-07 -5.91241485e-08] [-3.28268732e-05 -8.67665137e-05 1.38615776e-04] [-3.26508197e-05 8.66641154e-05 -1.38699417e-04] [-1.27572605e-05 -5.98952705e-08 -2.44826328e-08] [ 3.28490512e-05 8.67796687e-05 1.38607301e-04] [ 3.26929899e-05 -8.66904064e-05 -1.38679136e-04] [-1.62202112e-04 -1.85687309e-04 -5.14113941e-05] [ 1.62162337e-04 1.85659567e-04 -5.14623882e-05] [-1.62194554e-04 1.85659016e-04 5.13519845e-05] [ 1.62172559e-04 -1.85702998e-04 5.14516202e-05]] Final stress: [ 1.11248528e-05 -3.18418929e-06 1.16359658e-05 5.39446296e-11 -6.02893377e-11 3.30155029e-11] Minimization converged after 2 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.48843751e-04 1.36123605e-03 1.79083828e-05] [-7.48843752e-04 -1.36123606e-03 -1.79083580e-05] [ 1.15356334e-03 -2.10823278e-10 8.46723125e-11] [ 4.31206601e-04 -7.21460052e-04 2.01355788e-03] [ 4.31205854e-04 7.21460477e-04 -2.01355755e-03] [ 3.18768569e-05 -1.57862338e-12 -1.19289937e-11] [-3.20388921e-04 1.01845661e-04 -5.56531432e-04] [-3.20389122e-04 -1.01845544e-04 5.56531319e-04] [ 6.63210826e-05 9.74588283e-05 -1.27547050e-03] [-2.10146733e-05 1.67922033e-03 -1.26062102e-03] [ 6.63211085e-05 -9.74589395e-05 1.27547063e-03] [-2.10146226e-05 -1.67922054e-03 1.26062057e-03]] Final stress: [-8.18657090e-06 -1.11609878e-07 3.08012707e-05 -8.11573911e-05 -2.62758392e-13 2.07040445e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.47994247e-04 1.35589512e-03 -1.79413064e-05] [ 7.47994239e-04 -1.35589514e-03 1.79403946e-05] [-3.07096805e-05 -3.54236024e-10 1.57720135e-10] [ 3.22876897e-04 -9.54930269e-05 -5.52876075e-04] [ 3.22875267e-04 9.54939519e-05 5.52876833e-04] [-1.13711820e-03 -1.24448285e-10 -5.53418003e-11] [-4.31768487e-04 7.06064417e-04 2.01139200e-03] [-4.31768749e-04 -7.06064262e-04 -2.01139214e-03] [ 1.38360012e-05 -1.68301134e-03 -1.25718071e-03] [-6.90238404e-05 -1.00488667e-04 -1.27206497e-03] [ 1.38360042e-05 1.68301132e-03 1.25718138e-03] [-6.90236998e-05 1.00488113e-04 1.27206448e-03]] Final stress: [-7.98718228e-06 9.46525411e-08 3.08338628e-05 8.09499672e-05 -4.88973389e-13 1.08404328e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.77377293e-02 -2.61879276e-02 1.50120973e-03] [-1.77377291e-02 2.61879267e-02 -1.50123510e-03] [ 2.12955178e-02 -1.42794729e-08 6.16172906e-09] [-9.82184622e-03 -8.21600859e-03 9.44825623e-03] [-9.82188470e-03 8.21603044e-03 -9.44823790e-03] [ 1.28972616e-02 2.80611298e-10 -9.17024674e-11] [-2.46373890e-02 -3.14039658e-02 -2.38727373e-02] [-2.46374157e-02 3.14039807e-02 2.38727253e-02] [ 4.09085115e-02 8.57118301e-03 3.41211865e-02] [-5.80790731e-03 -1.80959034e-02 3.60978748e-02] [ 4.09085159e-02 -8.57119762e-03 -3.41211609e-02] [-5.80790539e-03 1.80958962e-02 -3.60978874e-02]] Final stress: [ 5.35303414e-04 3.77468595e-04 -2.10221168e-04 -1.73560579e-03 -1.79939086e-11 -1.33401809e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.77790646e-02 -2.63405003e-02 -1.50868963e-03] [ 1.77790646e-02 2.63405003e-02 1.50864882e-03] [-1.30288541e-02 -2.09965923e-08 9.12249535e-09] [ 2.47169658e-02 3.15046829e-02 -2.39373689e-02] [ 2.47169259e-02 -3.15046600e-02 2.39373883e-02] [-2.12873959e-02 -7.98285979e-09 -3.21021683e-09] [ 9.85114123e-03 8.25129446e-03 9.47791414e-03] [ 9.85112378e-03 -8.25128450e-03 -9.47792205e-03] [ 5.79783004e-03 1.81388205e-02 3.61818330e-02] [-4.09868487e-02 -8.63013400e-03 3.41932814e-02] [ 5.79783056e-03 -1.81388225e-02 -3.61818005e-02] [-4.09868478e-02 8.63013211e-03 -3.41932906e-02]] Final stress: [ 5.35776512e-04 3.76042322e-04 -2.10496157e-04 1.74158294e-03 -7.71940110e-12 -5.69539418e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.11662331e-11 2.11311343e-03 1.28212547e-10] [ 2.00945948e-12 -6.17818270e-04 8.30463661e-10] [ 5.64201610e-04 1.72571812e-04 1.46008056e-03] [ 6.42416909e-04 -8.43916133e-04 -3.72983625e-05] [ 1.12829921e-04 -2.38040983e-05 -1.48353376e-03] [-5.64201605e-04 1.72571149e-04 -1.46008083e-03] [-1.12829949e-04 -2.38041095e-05 1.48353375e-03] [-6.42417206e-04 -8.43915957e-04 3.72982079e-05] [ 9.36696983e-04 -8.04846652e-04 -1.30303125e-03] [ 8.42562441e-04 7.52347705e-04 -1.23052513e-03] [-8.42562345e-04 7.52347986e-04 1.23052453e-03] [-9.36696772e-04 -8.04846858e-04 1.30303132e-03]] Final stress: [-8.52569954e-06 4.05969118e-07 3.08201512e-05 -2.58619288e-13 -8.11156952e-05 1.00918801e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.80544029e-12 6.18440355e-04 -1.95083894e-10] [-6.01698111e-12 -2.11399168e-03 6.23089099e-11] [ 5.65332569e-04 -1.72897403e-04 -1.46048907e-03] [ 1.12074704e-04 2.31914909e-05 1.48367526e-03] [ 6.42893935e-04 8.45959751e-04 3.75555918e-05] [-5.65332574e-04 -1.72897136e-04 1.46048917e-03] [-6.42894022e-04 8.45959701e-04 -3.75555561e-05] [-1.12074266e-04 2.31912351e-05 -1.48367507e-03] [-8.41941015e-04 -7.52976035e-04 -1.23056186e-03] [-9.36930134e-04 8.04497924e-04 -1.30306396e-03] [ 9.36929963e-04 8.04497900e-04 1.30306374e-03] [ 8.41940852e-04 -7.52976099e-04 1.23056189e-03]] Final stress: [-8.54519403e-06 3.84482571e-07 3.08113815e-05 2.85694919e-13 8.11408964e-05 7.70999192e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.20136059e-10 -1.32262905e-02 -1.33168658e-08] [-5.82768647e-11 6.86422356e-02 1.30611739e-08] [ 9.33723263e-03 5.00105086e-02 2.75412683e-02] [ 4.02455065e-02 4.81050098e-03 -3.27718550e-02] [-1.43475960e-02 -2.85583691e-02 -3.32053478e-03] [-9.33723256e-03 5.00105017e-02 -2.75412710e-02] [ 1.43475907e-02 -2.85583720e-02 3.32053710e-03] [-4.02455041e-02 4.81049965e-03 3.27718562e-02] [ 3.14102512e-02 -1.38254624e-03 5.44333051e-02] [-4.80014470e-02 -5.25880616e-02 5.62831147e-02] [ 4.80014473e-02 -5.25880556e-02 -5.62831273e-02] [-3.14102486e-02 -1.38255156e-03 -5.44332930e-02]] Final stress: [ 6.23997127e-04 7.67580083e-04 -1.57102925e-04 -2.50930995e-12 -2.76527937e-03 2.36975038e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-4.40521569e-10 -6.86252337e-02 -3.90574035e-10] [-2.85457624e-10 1.32231361e-02 2.92904657e-08] [ 9.32210998e-03 -4.99989007e-02 -2.75363386e-02] [-1.43444766e-02 2.85655599e-02 3.32268135e-03] [ 4.02425771e-02 -4.81378449e-03 3.27615244e-02] [-9.32211038e-03 -4.99989084e-02 2.75363351e-02] [-4.02425559e-02 -4.81377192e-03 -3.27615345e-02] [ 1.43444717e-02 2.85655623e-02 -3.32268393e-03] [ 4.79856463e-02 5.25677683e-02 5.62686803e-02] [-3.13960839e-02 1.38040476e-03 5.44173315e-02] [ 3.13960769e-02 1.38039827e-03 -5.44173518e-02] [-4.79856543e-02 5.25677696e-02 -5.62686728e-02]] Final stress: [ 6.23819278e-04 7.67399982e-04 -1.57182207e-04 1.26780514e-11 2.76456283e-03 -1.57628850e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 3.37314927e-03 1.70881774e-03 -5.93792013e-07] [-3.37315093e-03 -1.70881816e-03 -4.51858175e-07] [ 6.85637028e-06 -6.29140043e-04 -2.43892094e-03] [-1.52798576e-03 1.46028135e-03 -4.61359470e-05] [ 1.17956230e-04 1.35513154e-04 2.48571410e-03] [-6.85638496e-06 6.29136018e-04 -2.43892308e-03] [ 1.52802935e-03 -1.46025559e-03 -4.61558831e-05] [-1.17955501e-04 -1.35514625e-04 2.48571395e-03] [-6.37752117e-05 -9.97625806e-04 -6.95704561e-04] [ 6.37514652e-05 9.97621171e-04 -6.95783013e-04] [ 2.20731733e-04 -1.10262726e-03 6.95592953e-04] [-2.20750624e-04 1.10261205e-03 6.95648076e-04]] Final stress: [-4.40342239e-06 9.58003131e-05 4.99001327e-05 3.63523851e-11 -1.57046739e-11 -1.06841806e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.37288813e-03 1.70869305e-03 5.78514500e-07] [ 3.37288665e-03 -1.70869395e-03 5.13132594e-07] [ 1.08969641e-05 6.29574656e-04 2.44064606e-03] [ 1.16370165e-04 -1.31719768e-04 -2.48727660e-03] [-1.52965677e-03 -1.46298256e-03 4.60501973e-05] [-1.08976561e-05 -6.29676368e-04 2.44060285e-03] [-1.16232300e-04 1.31799065e-04 -2.48734166e-03] [ 1.52956608e-03 1.46303457e-03 4.60058971e-05] [ 2.16863980e-04 1.10722528e-03 -6.95696900e-04] [-2.16889930e-04 -1.10723404e-03 -6.95746127e-04] [-5.77502101e-05 9.97251261e-04 6.95887644e-04] [ 5.77311721e-05 -9.97271204e-04 6.95776995e-04]] Final stress: [-4.23027721e-06 9.60747489e-05 5.00146418e-05 3.47371852e-11 -2.53693276e-11 1.06941905e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 6.19835318e-04 -3.06244975e-04 1.18190353e-06] [-6.19835143e-04 3.06245054e-04 1.23324433e-06] [ 6.99709244e-04 6.53708530e-04 -5.60706637e-04] [ 1.03066568e-04 9.10222672e-04 4.98232806e-04] [-1.91563088e-04 -1.20464570e-04 6.10524971e-05] [-6.99708964e-04 -6.53684254e-04 -5.60696426e-04] [-1.03091733e-04 -9.10237141e-04 4.98244817e-04] [ 1.91583356e-04 1.20452684e-04 6.10624127e-05] [-2.72423695e-04 6.96690789e-04 -1.81488066e-04] [ 2.72425949e-04 -6.96690541e-04 -1.81495401e-04] [ 6.30217459e-04 2.34572921e-04 1.81668903e-04] [-6.30215272e-04 -2.34571170e-04 1.81709947e-04]] Final stress: [ 3.82857864e-05 2.89964768e-05 2.75193356e-05 -4.76145075e-12 7.50228813e-13 -8.32660435e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-6.87702535e-04 -3.40709262e-04 -1.17329648e-06] [ 6.87702564e-04 3.40709177e-04 -1.09134968e-06] [ 7.31125019e-04 -5.20599466e-04 5.34148299e-04] [-8.24305326e-05 -1.39358099e-05 -5.22977725e-05] [-1.17344874e-05 -8.97621875e-04 -4.80457593e-04] [-7.31124651e-04 5.20526915e-04 5.34118011e-04] [ 8.24920426e-05 1.39711647e-05 -5.23274544e-05] [ 1.16726644e-05 8.97656876e-04 -4.80487297e-04] [ 7.50743568e-04 -2.02017953e-04 -1.98677664e-04] [-7.50744201e-04 2.02018820e-04 -1.98763209e-04] [-3.49235235e-04 -7.55477024e-04 1.98508892e-04] [ 3.49235784e-04 7.55478438e-04 1.98500434e-04]] Final stress: [ 3.65994690e-05 2.68896136e-05 2.69284428e-05 -1.59668663e-12 -1.98443487e-12 9.00311768e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 8.23683122e-10 -9.28514282e-03 3.33905126e-10] [ 7.00195291e-10 9.28514360e-03 -4.98397290e-09] [ 4.61966580e-03 -1.66678584e-08 6.44971929e-09] [-1.02565275e-03 -1.08272798e-03 6.00960520e-03] [-1.02566747e-03 1.08273663e-03 -6.00959853e-03] [-4.61966542e-03 -8.00615574e-09 -3.24484607e-09] [ 1.02563084e-03 1.08271538e-03 6.00961454e-03] [ 1.02564277e-03 -1.08272187e-03 -6.00960979e-03] [-2.86250478e-03 5.01211419e-04 -1.37723623e-03] [ 2.86252985e-03 -5.01206036e-04 -1.37723979e-03] [-2.86250835e-03 -5.01197387e-04 1.37723723e-03] [ 2.86252798e-03 5.01213735e-04 1.37722883e-03]] Final stress: [ 3.66273834e-04 -1.90395326e-04 1.05171398e-04 -3.80812425e-11 1.84079078e-11 1.29644830e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.22209132e-10 1.75105051e-03 -2.17745282e-07] [-1.29681230e-09 -1.75105138e-03 2.51474757e-07] [-1.80358151e-03 -9.61152213e-08 4.03252995e-08] [-2.32231440e-03 -1.66526791e-03 -1.85440720e-03] [-2.32253557e-03 1.66539710e-03 1.85451227e-03] [ 1.80358081e-03 -1.27807258e-07 -5.32071114e-08] [ 2.32252930e-03 1.66539515e-03 -1.85451049e-03] [ 2.32232314e-03 -1.66527751e-03 1.85441096e-03] [-2.51809922e-03 -9.26076708e-04 -1.02540895e-03] [ 2.51809758e-03 9.26071029e-04 -1.02578530e-03] [-2.51809845e-03 9.26086951e-04 1.02555135e-03] [ 2.51809949e-03 -9.26103311e-04 1.02561651e-03]] Final stress: [-8.65548765e-05 -1.81665581e-05 3.96106875e-06 2.55889610e-11 -1.75583556e-11 1.01693632e-10] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.48287901e-04 -1.36751766e-03 -1.79231597e-05] [-7.48287907e-04 1.36751766e-03 1.79231295e-05] [-3.28785662e-04 1.26229748e-10 -5.22997098e-11] [-1.46349657e-04 -1.99211921e-04 5.60637414e-04] [-1.46349389e-04 1.99211767e-04 -5.60637537e-04] [ 1.50742250e-03 -4.16354763e-11 -1.12761682e-11] [ 2.63619866e-04 -4.14400535e-04 -2.00906494e-03] [ 2.63620187e-04 4.14400348e-04 2.00906509e-03] [-3.05976526e-05 1.66938839e-03 -1.25997256e-03] [ 7.22966635e-05 1.10451395e-04 -1.27482329e-03] [-3.05976961e-05 -1.66938817e-03 1.25997243e-03] [ 7.22966524e-05 -1.10451368e-04 1.27482349e-03]] Final stress: [ 3.68537688e-07 -8.61503442e-06 3.08019412e-05 -8.11743768e-05 1.92232387e-13 4.28047697e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.48232870e-04 -1.36720084e-03 1.79253573e-05] [ 7.48232868e-04 1.36720084e-03 -1.79247097e-05] [-1.50625220e-03 2.48549324e-10 -1.01451803e-10] [-2.63828732e-04 4.13895371e-04 -2.00894568e-03] [-2.63828281e-04 -4.13895628e-04 2.00894546e-03] [ 3.28437880e-04 -1.46503854e-10 -5.99701930e-11] [ 1.46558595e-04 1.99241484e-04 5.60473089e-04] [ 1.46558551e-04 -1.99241454e-04 -5.60473119e-04] [-7.23053303e-05 -1.10569165e-04 -1.27486110e-03] [ 3.02495773e-05 -1.66933670e-03 -1.26000808e-03] [-7.23053582e-05 1.10569278e-04 1.27486086e-03] [ 3.02495637e-05 1.66933671e-03 1.26000808e-03]] Final stress: [ 3.78950695e-07 -8.60573116e-06 3.08071292e-05 8.11644131e-05 1.30496225e-13 2.47116240e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-2.54145056e-02 3.74702697e-02 -7.23058844e-04] [-2.54145057e-02 -3.74702703e-02 7.23068708e-04] [ 3.19283117e-02 -3.36969532e-09 1.41067206e-09] [-4.36528328e-02 -3.13758105e-02 3.79205652e-02] [-4.36528644e-02 3.13758281e-02 -3.79205512e-02] [ 1.89148296e-02 -7.17652786e-09 -3.23153846e-09] [-5.47377701e-03 -2.63384425e-02 -1.08651200e-02] [-5.47379469e-03 2.63384527e-02 1.08651112e-02] [-1.16376116e-02 -3.10266782e-02 5.27667692e-02] [ 6.07571788e-02 1.58057169e-02 5.12194929e-02] [-1.16376108e-02 3.10266753e-02 -5.27667616e-02] [ 6.07571826e-02 -1.58057307e-02 -5.12195137e-02]] Final stress: [ 6.57306244e-04 5.49061852e-04 -2.20407002e-04 -2.53344940e-03 -1.82910867e-11 2.30196634e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.53365240e-02 3.73542125e-02 6.93842444e-04] [ 2.53365237e-02 -3.73542125e-02 -6.93833419e-04] [-1.88916710e-02 8.35567318e-09 -3.22174826e-09] [ 5.47467893e-03 2.62425821e-02 -1.08408000e-02] [ 5.47467559e-03 -2.62425805e-02 1.08408013e-02] [-3.17549319e-02 -9.49039057e-09 -3.68896449e-09] [ 4.35119593e-02 3.12769710e-02 3.77981572e-02] [ 4.35119642e-02 -3.12769734e-02 -3.77981554e-02] [-6.06065626e-02 -1.56980958e-02 5.11619080e-02] [ 1.16067014e-02 3.09068745e-02 5.26737445e-02] [-6.06065656e-02 1.56981074e-02 -5.11619105e-02] [ 1.16067041e-02 -3.09068841e-02 -5.26737472e-02]] Final stress: [ 6.53295713e-04 5.46822350e-04 -2.23041074e-04 2.52587410e-03 3.98751661e-12 4.32511610e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.05342488e-13 -6.12012769e-04 1.88776549e-10] [ 7.78674623e-12 2.11025181e-03 6.02160188e-10] [-9.12211040e-04 6.85970781e-05 1.50609156e-03] [ 1.46707895e-04 -2.85336632e-04 -1.45251392e-03] [-5.53300348e-04 -4.94616784e-04 7.07568500e-06] [ 9.12211045e-04 6.85969241e-05 -1.50609163e-03] [ 5.53300729e-04 -4.94616567e-04 -7.07586503e-06] [-1.46708461e-04 -2.85336305e-04 1.45251365e-03] [ 8.42556584e-04 7.72707614e-04 -1.23181667e-03] [ 9.36421238e-04 -8.10471020e-04 -1.30424559e-03] [-9.36421112e-04 -8.10471183e-04 1.30424526e-03] [-8.42556537e-04 7.72707833e-04 1.23181673e-03]] Final stress: [-7.83084668e-08 -8.20842900e-06 3.08035188e-05 -1.70586318e-13 -8.11379311e-05 -8.07657761e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.66527273e-12 -2.11056152e-03 2.39311253e-10] [-3.64248171e-12 6.12253161e-04 5.23187028e-10] [-9.13107011e-04 -6.85366792e-05 -1.50631897e-03] [-5.52997473e-04 4.95154231e-04 -6.86457596e-06] [ 1.47390193e-04 2.85607057e-04 1.45253595e-03] [ 9.13107013e-04 -6.85371133e-05 1.50631879e-03] [-1.47389836e-04 2.85607266e-04 -1.45253612e-03] [ 5.52997239e-04 4.95154364e-04 6.86446072e-06] [-9.35990070e-04 8.09870520e-04 -1.30480954e-03] [-8.42254035e-04 -7.72940888e-04 -1.23238517e-03] [ 8.42253965e-04 -7.72940858e-04 1.23238488e-03] [ 9.35990021e-04 8.09870459e-04 1.30480952e-03]] Final stress: [-1.02827187e-07 -8.23351430e-06 3.08020305e-05 1.01084465e-13 8.11512000e-05 1.82126994e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.55055530e-10 4.27205511e-02 -1.70620697e-08] [-3.20818082e-10 -8.22848786e-03 4.60805898e-09] [ 6.78859999e-03 2.44090815e-02 2.02740468e-02] [ 9.49437765e-03 -5.84031612e-03 -7.86013839e-04] [-3.41741509e-02 -2.25582417e-03 -1.51937623e-02] [-6.78860035e-03 2.44090989e-02 -2.02740402e-02] [ 3.41741525e-02 -2.25582276e-03 1.51937615e-02] [-9.49435642e-03 -5.84032862e-03 7.86023336e-04] [-2.70029026e-02 -2.99159934e-02 3.49995153e-02] [ 1.78741548e-02 -3.64297959e-03 3.34993794e-02] [-1.78741653e-02 -3.64298563e-03 -3.34993911e-02] [ 2.70028916e-02 -2.99159934e-02 -3.49995065e-02]] Final stress: [ 3.59778559e-04 5.13464428e-04 -2.15250574e-04 2.00885395e-11 -1.68451954e-03 -1.49873705e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.01095523e-12 8.19925863e-03 -5.74473793e-09] [ 8.33693669e-11 -4.26713514e-02 -1.04803006e-08] [ 6.77217163e-03 -2.43885725e-02 -2.02587077e-02] [-3.41501215e-02 2.26678500e-03 1.51840853e-02] [ 9.47734145e-03 5.81623684e-03 7.84210117e-04] [-6.77217177e-03 -2.43885516e-02 2.02587157e-02] [-9.47735609e-03 5.81622834e-03 -7.84203522e-04] [ 3.41501354e-02 2.26677689e-03 -1.51840791e-02] [-1.78663863e-02 3.64720300e-03 3.34809239e-02] [ 2.69996703e-02 2.98943920e-02 3.49837337e-02] [-2.69996695e-02 2.98943898e-02 -3.49837338e-02] [ 1.78663862e-02 3.64720494e-03 -3.34809284e-02]] Final stress: [ 3.60146706e-04 5.13384962e-04 -2.15198705e-04 -7.01781637e-14 1.68303465e-03 -8.76596865e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 3.34696343e-03 -1.65139981e-03 -6.53964532e-07] [-3.34696441e-03 1.65140066e-03 -4.25172327e-07] [ 1.33313094e-03 -1.49888147e-04 -2.61926082e-03] [-1.32623375e-03 9.15960221e-04 2.23442973e-03] [-1.38799035e-05 1.06088886e-03 3.85557888e-04] [-1.33313059e-03 1.49785564e-04 -2.61930329e-03] [ 1.32632847e-03 -9.15904286e-04 2.23438429e-03] [ 1.38182202e-05 -1.06085428e-03 3.85527491e-04] [-9.13666895e-04 -4.20672214e-04 -7.03178870e-04] [ 9.13652065e-04 4.20681739e-04 -7.03348510e-04] [-6.02201799e-04 -8.23657539e-04 7.03112775e-04] [ 6.02184218e-04 8.23659231e-04 7.03158447e-04]] Final stress: [ 9.97124724e-05 -7.60136536e-06 5.02548777e-05 2.87726618e-11 1.20103286e-11 -1.00629003e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.34493528e-03 -1.65039704e-03 6.35548016e-07] [ 3.34493482e-03 1.65039774e-03 6.07351856e-07] [ 1.33205564e-03 1.50403569e-04 2.61969658e-03] [-9.41349183e-06 -1.06809795e-03 -3.85497714e-04] [-1.32615609e-03 -9.15403011e-04 -2.23494092e-03] [-1.33205585e-03 -1.50395676e-04 2.61970035e-03] [ 9.39628774e-06 1.06808818e-03 -3.85489420e-04] [ 1.32618599e-03 9.15385997e-04 -2.23492705e-03] [-5.98817564e-04 8.21120577e-04 -7.01878617e-04] [ 5.98813807e-04 -8.21110044e-04 -7.01851787e-04] [-9.13380861e-04 4.16713964e-04 7.01972719e-04] [ 9.13372601e-04 -4.16706306e-04 7.01972969e-04]] Final stress: [ 9.94809956e-05 -7.76041204e-06 5.01346186e-05 1.04022449e-11 1.50415015e-11 1.00559290e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 3.95326739e-04 2.01951559e-04 1.19097974e-06] [-3.95326703e-04 -2.01951637e-04 1.20266416e-06] [ 4.58270899e-04 -6.55293994e-04 -8.81003327e-05] [-4.52172785e-04 5.26100633e-04 -2.63057714e-05] [ 2.38209684e-04 -6.48800357e-04 1.12893953e-04] [-4.58270896e-04 6.55255815e-04 -8.81160247e-05] [ 4.52206741e-04 -5.26081120e-04 -2.63218329e-05] [-2.38245262e-04 6.48820654e-04 1.12877207e-04] [ 8.19956301e-04 -3.12525303e-04 7.92344480e-05] [-8.19956039e-04 3.12524453e-04 7.92039142e-05] [-3.47331988e-04 -9.15000246e-04 -7.88698128e-05] [ 3.47333310e-04 9.14999541e-04 -7.88893919e-05]] Final stress: [ 1.99214762e-05 4.70037010e-05 2.27688369e-05 -5.25573739e-13 -2.88021919e-12 -2.83170539e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-4.25857537e-04 2.17033780e-04 -1.17772838e-06] [ 4.25857623e-04 -2.17033686e-04 -1.20158079e-06] [ 4.78175092e-04 8.47044505e-04 2.36781667e-06] [ 3.87880156e-04 7.59698189e-04 -3.05551601e-05] [-4.60241244e-04 -5.26739106e-04 2.96984213e-05] [-4.78175251e-04 -8.47063833e-04 2.35964371e-06] [-3.87866304e-04 -7.59690095e-04 -3.05620826e-05] [ 4.60224385e-04 5.26749038e-04 2.96901593e-05] [ 6.51753530e-05 9.07214837e-04 5.93371823e-06] [-6.51734168e-05 -9.07214385e-04 5.93254000e-06] [ 5.75408566e-04 6.35762467e-04 -6.23106449e-06] [-5.75407422e-04 -6.35761710e-04 -6.25468294e-06]] Final stress: [ 2.13999594e-05 4.68412518e-05 2.43733579e-05 -1.69681004e-12 2.14519493e-12 2.65908016e-05] Minimization converged after 5 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.07262456e-03 -2.83348986e-06 -1.91998228e-09] [-1.07262456e-03 2.83349680e-06 1.59214303e-09] [ 1.99109441e-03 3.82367457e-13 -7.01074438e-13] [-2.56417123e-04 -1.28126441e-03 1.63650002e-03] [-2.56417031e-04 1.28126435e-03 -1.63650007e-03] [ 1.97926956e-03 1.41094784e-10 6.01709397e-11] [-2.46226698e-04 -1.30123594e-03 -1.62897540e-03] [-2.46226271e-04 1.30123569e-03 1.62897561e-03] [-2.07397304e-04 1.50230765e-03 1.66992469e-03] [-2.02516542e-04 1.51748836e-03 1.66992709e-03] [-2.07397328e-04 -1.50230755e-03 -1.66992480e-03] [-2.02516557e-04 -1.51748830e-03 -1.66992687e-03]] Final stress: [ 1.55186633e-05 1.50460583e-05 7.08521110e-06 -8.38095639e-05 1.27155879e-13 1.10017918e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.07289499e-03 -2.83552937e-06 1.68285531e-09] [ 1.07289499e-03 2.83552100e-06 -1.92763524e-09] [-1.98270898e-03 -2.96829048e-10 1.23675653e-10] [ 2.46653825e-04 1.30145985e-03 -1.62982353e-03] [ 2.46652942e-04 -1.30145935e-03 1.62982394e-03] [-1.99221163e-03 -1.66377436e-10 -7.23711877e-11] [ 2.55687011e-04 1.28349634e-03 1.63735393e-03] [ 2.55686695e-04 -1.28349616e-03 -1.63735409e-03] [ 2.03669817e-04 -1.51892834e-03 1.66763326e-03] [ 2.08555224e-04 -1.50373992e-03 1.66763066e-03] [ 2.03669826e-04 1.51892833e-03 -1.66763289e-03] [ 2.08555283e-04 1.50373972e-03 -1.66763109e-03]] Final stress: [ 1.54422948e-05 1.49693313e-05 7.09051236e-06 8.38426799e-05 -2.06612389e-13 3.92562190e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.19985851e-03 -3.03164529e-05 -8.12876248e-08] [-2.19985850e-03 3.03164521e-05 8.12586092e-08] [ 5.97814384e-03 -3.84338401e-11 1.46552158e-11] [-6.44912336e-04 -5.91083665e-03 4.00990141e-03] [-6.44912376e-04 5.91083667e-03 -4.00990140e-03] [ 8.44636243e-03 -8.73355796e-11 -3.52550899e-11] [-1.82763238e-03 -3.84488228e-03 -3.94081845e-03] [-1.82763248e-03 3.84488232e-03 3.94081841e-03] [-1.29658206e-03 2.29012096e-03 1.25665827e-03] [-1.24326778e-03 2.41330702e-03 1.25677971e-03] [-1.29658207e-03 -2.29012091e-03 -1.25665818e-03] [-1.24326778e-03 -2.41330700e-03 -1.25677974e-03]] Final stress: [-6.16431276e-05 -6.61231221e-05 -5.74450006e-05 -3.00694485e-04 3.24640364e-14 3.19915266e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.19986201e-03 -3.03165738e-05 8.12101999e-08] [ 2.19986201e-03 3.03165764e-05 -8.13691865e-08] [-8.44639595e-03 -1.36361259e-11 8.16260074e-12] [ 1.82763388e-03 3.84489442e-03 -3.94082866e-03] [ 1.82763390e-03 -3.84489442e-03 3.94082867e-03] [-5.97816781e-03 -1.03505432e-11 1.14054756e-12] [ 6.44909278e-04 5.91085680e-03 4.00991197e-03] [ 6.44909417e-04 -5.91085687e-03 -4.00991191e-03] [ 1.24328104e-03 -2.41330463e-03 1.25678859e-03] [ 1.29659562e-03 -2.29011806e-03 1.25666714e-03] [ 1.24328100e-03 2.41330472e-03 -1.25678858e-03] [ 1.29659562e-03 2.29011807e-03 -1.25666707e-03]] Final stress: [-6.16433642e-05 -6.61233798e-05 -5.74452473e-05 3.00695243e-04 1.00707601e-13 1.11134238e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.98570623e-12 1.07572483e-03 -1.32703099e-10] [-1.53813548e-13 1.07005416e-03 -1.53618494e-10] [ 1.18144403e-05 9.97179206e-04 1.88623367e-03] [ 1.28846076e-03 -1.23563930e-03 -9.46890089e-04] [-1.29599345e-03 -1.24636873e-03 -9.39360512e-04] [-1.18144420e-05 9.97179437e-04 -1.88623358e-03] [ 1.29599345e-03 -1.24636873e-03 9.39360518e-04] [-1.28846061e-03 -1.23563938e-03 9.46890158e-04] [ 1.51381848e-03 2.13563571e-04 1.66791847e-03] [ 1.50893360e-03 1.98375704e-04 1.66792894e-03] [-1.50893366e-03 1.98375613e-04 -1.66792888e-03] [-1.51381857e-03 2.13563624e-04 -1.66791841e-03]] Final stress: [ 1.49712890e-05 1.54442164e-05 7.08617421e-06 1.20565441e-13 -8.38374775e-05 -3.04253260e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.94092397e-12 -1.07040813e-03 -1.73245582e-11] [-1.73016045e-12 -1.07608437e-03 -5.92553184e-10] [ 1.02920279e-05 -9.98043341e-04 -1.88756240e-03] [-1.29700846e-03 1.24726610e-03 9.40021059e-04] [ 1.29100360e-03 1.23917756e-03 9.47558648e-04] [-1.02920354e-05 -9.98043081e-04 1.88756252e-03] [-1.29100370e-03 1.23917750e-03 -9.47558591e-04] [ 1.29700868e-03 1.24726599e-03 -9.40020952e-04] [-1.51077558e-03 -1.99977819e-04 1.66473258e-03] [-1.51566685e-03 -2.15176283e-04 1.66472224e-03] [ 1.51566680e-03 -2.15176334e-04 -1.66472180e-03] [ 1.51077553e-03 -1.99977794e-04 -1.66473268e-03]] Final stress: [ 1.48697933e-05 1.53432131e-05 7.09610619e-06 9.22674977e-14 8.38843081e-05 -1.76619544e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.35412216e-12 2.23015393e-03 -2.79436395e-10] [-3.01135198e-12 2.16952240e-03 2.18683758e-10] [-1.17563602e-03 4.05241017e-03 4.59009112e-03] [ 5.49141034e-03 -5.44989734e-03 -2.32987386e-03] [-4.26438641e-03 -3.34205199e-03 -2.26079126e-03] [ 1.17563603e-03 4.05241026e-03 -4.59009108e-03] [ 4.26438626e-03 -3.34205208e-03 2.26079132e-03] [-5.49141024e-03 -5.44989739e-03 2.32987391e-03] [ 2.37833876e-03 1.33144143e-03 1.25645216e-03] [ 2.32502591e-03 1.20825959e-03 1.25688879e-03] [-2.32502589e-03 1.20825962e-03 -1.25688907e-03] [-2.37833873e-03 1.33144140e-03 -1.25645199e-03]] Final stress: [-6.61223979e-05 -6.16424911e-05 -5.74439195e-05 -1.50721278e-14 -3.00691996e-04 1.29712564e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.22232288e-12 -2.16952213e-03 -1.50234026e-10] [ 6.70912315e-13 -2.23015373e-03 3.08976754e-10] [-1.17563825e-03 -4.05242592e-03 -4.59009070e-03] [-4.26439861e-03 3.34205764e-03 2.26079101e-03] [ 5.49142496e-03 5.44990683e-03 2.32987370e-03] [ 1.17563825e-03 -4.05242592e-03 4.59009070e-03] [-5.49142487e-03 5.44990689e-03 -2.32987375e-03] [ 4.26439860e-03 3.34205765e-03 -2.26079103e-03] [-2.32501666e-03 -1.20825935e-03 1.25688901e-03] [-2.37832963e-03 -1.33144129e-03 1.25645194e-03] [ 2.37832960e-03 -1.33144133e-03 -1.25645220e-03] [ 2.32501662e-03 -1.20825932e-03 -1.25688883e-03]] Final stress: [-6.61225359e-05 -6.16426225e-05 -5.74439730e-05 5.12694792e-14 3.00692329e-04 -1.02681100e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.36134162e-03 5.64452465e-04 -6.97092552e-06] [-6.36134707e-03 -5.64454285e-04 -7.26644196e-06] [ 2.42243281e-03 2.30102305e-06 -4.52324523e-03] [-1.29918535e-02 -2.94263568e-03 -2.57829014e-03] [-1.05389055e-02 7.24401022e-03 7.11164612e-03] [-2.42243471e-03 -2.12464387e-06 -4.52317187e-03] [ 1.29917978e-02 2.94260337e-03 -2.57825906e-03] [ 1.05391334e-02 -7.24414092e-03 7.11175274e-03] [-1.15107622e-02 2.12198034e-03 -6.70434411e-04] [ 1.15106792e-02 -2.12196684e-03 -6.70184433e-04] [-8.95180626e-03 -3.67775845e-03 6.67226005e-04] [ 8.95172440e-03 3.67773341e-03 6.67197633e-04]] Final stress: [ 1.92009793e-04 4.39962999e-05 1.35249045e-04 1.21651856e-10 -6.84220280e-12 -2.62050883e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-6.48096124e-03 5.65161307e-04 6.89866144e-06] [ 6.48095649e-03 -5.65158936e-04 7.11770158e-06] [ 2.41813387e-03 6.45555640e-05 4.46822153e-03] [-1.04730780e-02 -7.27591408e-03 -7.08159821e-03] [-1.30387674e-02 2.91297240e-03 2.60337294e-03] [-2.41813444e-03 -6.44229643e-05 4.46827918e-03] [ 1.04729377e-02 7.27583548e-03 -7.08152962e-03] [ 1.30390441e-02 -2.91313290e-03 2.60350217e-03] [-9.00971132e-03 3.61653269e-03 -8.12791240e-04] [ 9.00965802e-03 -3.61646546e-03 -8.12760608e-04] [-1.14382505e-02 -2.18302394e-03 8.15525573e-04] [ 1.14381727e-02 2.18306084e-03 8.15761925e-04]] Final stress: [1.91094004e-04 4.33208335e-05 1.37616145e-04 1.16969542e-10 7.73430099e-11 2.65106750e-04] Minimization converged after 40 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.94724976e-02 -4.35544003e-03 -1.48542284e-04] [-2.94724976e-02 4.35543999e-03 1.48542181e-04] [ 8.83172998e-02 -2.14120088e-10 4.83441303e-11] [-1.16414332e-02 -6.72174028e-02 5.54966887e-02] [-1.16414332e-02 6.72174028e-02 -5.54966888e-02] [ 1.07496589e-01 -9.06107964e-11 -1.45356232e-11] [-1.29829959e-02 -6.04562408e-02 -4.54187827e-02] [-1.29829967e-02 6.04562413e-02 4.54187823e-02] [-2.62436238e-02 3.13457742e-02 -6.64640774e-03] [-1.75663937e-02 4.98664245e-02 -6.43639691e-03] [-2.62436238e-02 -3.13457745e-02 6.64640824e-03] [-1.75663937e-02 -4.98664243e-02 6.43639687e-03]] Final stress: [-4.42570519e-06 -6.80937759e-04 9.15838579e-04 -3.64827034e-03 -3.25498983e-14 -1.40344568e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.94724975e-02 -4.35543999e-03 1.48542384e-04] [ 2.94724975e-02 4.35544000e-03 -1.48542183e-04] [-1.07496589e-01 1.95592388e-10 -1.01207304e-10] [ 1.29829958e-02 6.04562406e-02 -4.54187826e-02] [ 1.29829964e-02 -6.04562410e-02 4.54187822e-02] [-8.83172994e-02 3.36758646e-11 2.75141259e-11] [ 1.16414327e-02 6.72174025e-02 5.54966887e-02] [ 1.16414337e-02 -6.72174029e-02 -5.54966883e-02] [ 1.75663936e-02 -4.98664239e-02 -6.43639727e-03] [ 2.62436239e-02 -3.13457742e-02 -6.64640762e-03] [ 1.75663935e-02 4.98664244e-02 6.43639677e-03] [ 2.62436238e-02 3.13457744e-02 6.64640791e-03]] Final stress: [-4.42570692e-06 -6.80937758e-04 9.15838572e-04 3.64827032e-03 7.52382321e-13 7.93314607e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.31995824e-03 1.33098095e-03 2.14598103e-08] [-1.34200363e-03 1.33098092e-03 -2.22249858e-08] [ 3.86203743e-03 1.48659851e-03 2.81369994e-03] [ 2.76440098e-03 -5.90295931e-03 1.04189573e-03] [-2.32038503e-03 6.88576777e-05 -3.85548745e-03] [ 4.88320852e-03 1.51727993e-03 -2.84138289e-03] [ 2.25645464e-03 -4.99248991e-03 -1.02805400e-03] [-2.83360983e-03 -7.89393180e-04 3.86932903e-03] [-3.11236728e-04 2.61571831e-03 -8.68265858e-04] [-3.63930518e-04 2.65925911e-03 -8.68378810e-04] [-2.66383564e-03 3.15812905e-04 8.68347769e-04] [-2.61114194e-03 3.59354094e-04 8.68297294e-04]] Final stress: [-2.70318051e-05 -2.70318042e-05 1.42723169e-05 -1.35459597e-04 -1.35459598e-04 -1.09150868e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.34201014e-03 -1.33098742e-03 2.13370457e-08] [-1.31996470e-03 -1.33098745e-03 -2.17829760e-08] [ 3.86202398e-03 -1.48651676e-03 -2.81373153e-03] [-2.32028542e-03 -6.88067000e-05 3.85553062e-03] [ 2.76441884e-03 5.90293090e-03 -1.04190720e-03] [ 4.88319736e-03 -1.51719712e-03 2.84141488e-03] [-2.83351161e-03 7.89445990e-04 -3.86937208e-03] [ 2.25647161e-03 4.99245935e-03 1.02806560e-03] [-2.66392157e-03 -3.15825158e-04 -8.68340975e-04] [-2.61122775e-03 -3.59365999e-04 -8.68290550e-04] [-3.11248358e-04 -2.61580459e-03 8.68259126e-04] [-3.63942246e-04 -2.65934505e-03 8.68372548e-04]] Final stress: [-2.70318486e-05 -2.70318478e-05 1.42721734e-05 -1.35459236e-04 1.35459236e-04 1.09150875e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.31990848e-03 1.33093109e-03 -2.15193788e-08] [ 1.34195363e-03 1.33093105e-03 2.11301059e-08] [-4.88335542e-03 1.51725415e-03 2.84132224e-03] [ 2.83366510e-03 -7.89556981e-04 -3.86924585e-03] [-2.25634749e-03 -4.99228485e-03 1.02803208e-03] [-3.86181931e-03 1.48657296e-03 -2.81363954e-03] [ 2.32025748e-03 6.90098757e-05 3.85540458e-03] [-2.76447547e-03 -5.90307084e-03 -1.04187324e-03] [ 2.61091548e-03 3.59614994e-04 -8.68395806e-04] [ 2.66360916e-03 3.16073718e-04 -8.68446100e-04] [ 3.64190782e-04 2.65903281e-03 8.68477888e-04] [ 3.11497570e-04 2.61549203e-03 8.68364143e-04]] Final stress: [-2.70429694e-05 -2.70429710e-05 1.42687664e-05 1.35460319e-04 -1.35460319e-04 1.09149874e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.34154021e-03 -1.33051866e-03 -2.13912150e-08] [ 1.31949711e-03 -1.33051870e-03 2.09473921e-08] [-4.88456390e-03 -1.51709063e-03 -2.84080552e-03] [-2.25545622e-03 4.99061941e-03 -1.02784454e-03] [ 2.83416370e-03 7.90874996e-04 3.86854281e-03] [-3.86003633e-03 -1.48640523e-03 2.81312731e-03] [-2.76507801e-03 5.90399681e-03 1.04168352e-03] [ 2.31925839e-03 -7.02817483e-05 -3.85470375e-03] [ 3.66320667e-04 -2.65713348e-03 -8.69288808e-04] [ 3.13630278e-04 -2.61359107e-03 -8.69176139e-04] [ 2.60901664e-03 -3.61747296e-04 8.69208322e-04] [ 2.66170746e-03 -3.18204403e-04 8.69257240e-04]] Final stress: [-2.71344855e-05 -2.71344869e-05 1.42397351e-05 1.35466386e-04 1.35466385e-04 -1.09142128e-06] Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 66 steps. Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.77251804e-11 3.38241051e-02 1.22383966e-10] [ 1.78335391e-11 2.51206152e-02 3.14378017e-10] [-1.15861341e-03 4.89308898e-02 5.79227194e-02] [ 6.86437347e-02 -6.70276301e-02 -3.45200031e-02] [-5.92407153e-02 -5.51854388e-02 -2.44264829e-02] [ 1.15861345e-03 4.89308900e-02 -5.79227193e-02] [ 5.92407145e-02 -5.51854392e-02 2.44264833e-02] [-6.86437349e-02 -6.70276301e-02 3.45200031e-02] [ 4.49419747e-02 3.11413636e-02 -6.93493972e-03] [ 3.62705754e-02 1.26684553e-02 -6.14784329e-03] [-3.62705750e-02 1.26684555e-02 6.14784295e-03] [-4.49419742e-02 3.11413636e-02 6.93493915e-03]] Final stress: [-6.80871013e-04 -4.49183959e-06 9.15838476e-04 -4.36584408e-13 -3.64826505e-03 1.52785122e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.84936584e-12 -2.51206156e-02 4.63127682e-12] [-2.39120325e-12 -3.38241057e-02 -6.28300844e-11] [-1.15861320e-03 -4.89308903e-02 -5.79227202e-02] [-5.92407164e-02 5.51854396e-02 2.44264832e-02] [ 6.86437361e-02 6.70276308e-02 3.45200035e-02] [ 1.15861336e-03 -4.89308904e-02 5.79227202e-02] [-6.86437364e-02 6.70276307e-02 -3.45200034e-02] [ 5.92407164e-02 5.51854395e-02 -2.44264831e-02] [-3.62705758e-02 -1.26684552e-02 -6.14784379e-03] [-4.49419752e-02 -3.11413641e-02 -6.93493935e-03] [ 4.49419752e-02 -3.11413640e-02 6.93493954e-03] [ 3.62705759e-02 -1.26684554e-02 6.14784353e-03]] Final stress: [-6.80871020e-04 -4.49182911e-06 9.15838508e-04 1.26848592e-15 3.64826510e-03 4.81133628e-13] Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 0.00282115 0.01210138 0.01169732] [-0.00823112 -0.02177378 0.00317381] [ 0.00742206 0.00493109 0.00435891] [-0.00665625 -0.00303013 0.00544713] [-0.01216961 -0.0046391 0.01846324] [-0.00012727 0.0120036 -0.00726352] [-0.00076018 -0.01270405 -0.0210082 ] [ 0.00529914 -0.01176438 -0.00989936] [ 0.00346103 -0.00059749 -0.00356326] [ 0.00616449 0.00691494 -0.00665584] [-0.00310117 0.00944454 -0.00321174] [ 0.00587772 0.00911338 0.00846153]] Final stress: [ 5.51995453e-03 3.08785304e-03 3.28555666e-02 -4.34995983e-05 -9.04023044e-03 -3.23292810e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-0.00745668 0.0206948 -0.00159084] [ 0.00311178 -0.0095802 -0.01379006] [ 0.00801502 -0.00354914 -0.00194414] [-0.01097557 0.00504264 -0.01449426] [-0.00089492 0.0007253 -0.00551964] [ 0.00051532 -0.01470365 0.00454431] [ 0.00895695 0.0127487 0.00757426] [-0.0022279 0.01142697 0.018882 ] [-0.00495296 -0.00884329 0.00427759] [ 0.0031541 -0.00785465 -0.0050808 ] [ 0.00187728 0.00151814 0.00567379] [ 0.00087758 -0.00762563 0.0014678 ]] Final stress: [5.56384098e-03 3.05312399e-03 3.28436822e-02 5.64045648e-08 8.97558479e-03 3.28688395e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 0.01122724 0.02886107 0.00720012] [-0.00327776 -0.01617293 0.01264191] [ 0.00186985 -0.01366252 -0.01085854] [-0.00064029 0.01760845 -0.02844924] [-0.0034273 0.01490029 -0.01492424] [-0.00901857 -0.00565128 0.00704293] [ 0.00812438 0.00279197 0.01049772] [ 0.01761894 0.00729672 0.02511624] [-0.01216795 -0.00982398 -0.01569079] [-0.00815931 -0.00443761 -0.00180561] [-0.00546801 -0.01194176 0.01373974] [ 0.0033188 -0.00976842 -0.00451024]] Final stress: [ 5.66305925e-03 3.17729100e-03 3.30519175e-02 -2.58416638e-05 9.09249416e-03 -3.11704524e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.52000497e-03 2.02482159e-05 9.70526996e-06] [-1.52000495e-03 -2.02481995e-05 9.70650094e-06] [ 6.93694473e-04 -9.57527972e-05 -1.06260031e-03] [-9.29503242e-04 8.00833490e-04 3.95233409e-04] [-3.26477243e-04 8.85049777e-06 6.58689247e-04] [-6.93694455e-04 9.57383911e-05 -1.06260631e-03] [ 9.29514836e-04 -8.00826823e-04 3.95227797e-04] [ 3.26465405e-04 -8.84368443e-06 6.58683519e-04] [-1.38753454e-04 -2.78782240e-04 -5.01366905e-04] [ 1.38753656e-04 2.78782672e-04 -5.01376588e-04] [-4.03200677e-04 -4.34054553e-04 5.00356443e-04] [ 4.03200682e-04 4.34055031e-04 5.00347932e-04]] Final stress: [ 4.62315891e-05 4.26125775e-05 4.04692685e-05 -1.39983474e-14 6.36671297e-13 -4.75426214e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.51603713e-03 2.12108931e-05 -9.65662562e-06] [ 1.51603713e-03 -2.12109021e-05 -9.65296902e-06] [ 6.90327407e-04 9.21929155e-05 1.04573625e-03] [-3.62131485e-04 -1.97421296e-05 -6.63347786e-04] [-9.49352080e-04 -7.70018402e-04 -3.73780740e-04] [-6.90327372e-04 -9.21899206e-05 1.04573749e-03] [ 3.62129186e-04 1.97407911e-05 -6.63346671e-04] [ 9.49354681e-04 7.70016897e-04 -3.73779495e-04] [-4.26811445e-04 4.39339291e-04 -5.06314491e-04] [ 4.26811247e-04 -4.39339360e-04 -5.06314340e-04] [-1.72530024e-04 2.70557345e-04 5.07357891e-04] [ 1.72529885e-04 -2.70557418e-04 5.07361495e-04]] Final stress: [ 4.62206708e-05 4.21168441e-05 4.04459752e-05 1.01626919e-13 -1.76338818e-13 4.73300901e-05] Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.08755089e-03 6.56679471e-03 -3.80915237e-05] [-4.08755090e-03 -6.56679473e-03 3.80925195e-05] [ 5.47121815e-03 2.68015404e-10 -1.14597955e-10] [-2.53890147e-04 -3.13576278e-03 8.60220143e-03] [-2.53890144e-04 3.13576279e-03 -8.60220144e-03] [-1.23204407e-03 -3.39874424e-10 -1.36691665e-10] [-1.27494305e-03 -1.70760714e-04 -2.41018078e-03] [-1.27494344e-03 1.70760939e-04 2.41018058e-03] [ 1.14556492e-03 5.67260357e-04 -8.03718975e-03] [ 2.35123232e-03 1.16771595e-02 -8.10472514e-03] [ 1.14556489e-03 -5.67260242e-04 8.03718957e-03] [ 2.35123237e-03 -1.16771597e-02 8.10472477e-03]] Final stress: [-2.09706098e-05 -4.20370914e-06 1.59021748e-04 -3.75919339e-04 -1.36045577e-13 7.78260248e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.08747040e-03 6.56659330e-03 3.80895771e-05] [ 4.08747040e-03 -6.56659330e-03 -3.80888878e-05] [ 1.23173607e-03 4.08736264e-10 -1.68228258e-10] [ 1.27470274e-03 1.70527747e-04 -2.41023155e-03] [ 1.27470358e-03 -1.70528215e-04 2.41023116e-03] [-5.47057628e-03 -1.61134744e-10 -5.58753154e-11] [ 2.53687270e-04 3.13554924e-03 8.60207545e-03] [ 2.53687399e-04 -3.13554930e-03 -8.60207540e-03] [-2.35129068e-03 -1.16767354e-02 -8.10482338e-03] [-1.14515007e-03 -5.67348632e-04 -8.03729178e-03] [-2.35129073e-03 1.16767356e-02 8.10482300e-03] [-1.14515010e-03 5.67348688e-04 8.03729202e-03]] Final stress: [-2.09808116e-05 -4.21290147e-06 1.59018537e-04 3.75912953e-04 2.62384661e-13 3.53821294e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.08008245e-03 -6.12896857e-03 8.27302066e-05] [-5.08008244e-03 6.12896857e-03 -8.27320494e-05] [ 7.50238243e-03 -1.10218552e-09 4.57784097e-10] [-8.90608717e-04 -4.55600355e-03 2.68911760e-03] [-8.90610807e-04 4.55600467e-03 -2.68911662e-03] [ 3.61387526e-03 1.01242179e-10 2.83760270e-11] [-7.91759195e-04 -2.82778592e-03 -9.49596838e-03] [-7.91758993e-04 2.82778581e-03 9.49596845e-03] [ 5.36950417e-03 2.64828706e-03 1.69976404e-03] [-4.16518182e-03 -9.44012391e-03 1.81985834e-03] [ 5.36950417e-03 -2.64828705e-03 -1.69976321e-03] [-4.16518162e-03 9.44012391e-03 -1.81985886e-03]] Final stress: [ 3.14842030e-05 7.46048152e-06 -2.23592084e-06 -4.43941307e-04 -4.07243291e-13 -2.09198564e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.08041771e-03 -6.13037033e-03 -8.27241582e-05] [ 5.08041772e-03 6.13037035e-03 8.27256942e-05] [-3.61430373e-03 6.03059292e-10 -2.38275053e-10] [ 7.91378575e-04 2.82391772e-03 -9.49730005e-03] [ 7.91379527e-04 -2.82391823e-03 9.49729962e-03] [-7.50057232e-03 -4.58820089e-10 -1.80883668e-10] [ 8.91688952e-04 4.55947988e-03 2.68838550e-03] [ 8.91688397e-04 -4.55947948e-03 -2.68838576e-03] [ 4.16353476e-03 9.44126994e-03 1.82036230e-03] [-5.36958212e-03 -2.65196642e-03 1.70025501e-03] [ 4.16353461e-03 -9.44126990e-03 -1.82036262e-03] [-5.36958208e-03 2.65196633e-03 -1.70025510e-03]] Final stress: [ 3.13639603e-05 7.31745127e-06 -2.30483242e-06 4.43966014e-04 3.11458433e-13 3.30742605e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.20727901e-11 1.07774630e-02 3.17135468e-10] [ 2.72457395e-12 -2.63274965e-03 -4.21992550e-10] [ 3.48889635e-03 1.68814186e-03 6.33883898e-03] [ 2.20435138e-03 -2.64854854e-03 -1.54587323e-04] [-1.09712378e-03 4.20971284e-04 -6.14246521e-03] [-3.48889635e-03 1.68814185e-03 -6.33883896e-03] [ 1.09712417e-03 4.20971532e-04 6.14246505e-03] [-2.20435143e-03 -2.64854850e-03 1.54587304e-04] [ 5.64251066e-03 -7.08480292e-03 -8.15546006e-03] [ 6.63016667e-03 3.55188152e-03 -8.00469450e-03] [-6.63016684e-03 3.55188134e-03 8.00469501e-03] [-5.64251082e-03 -7.08480283e-03 8.15545982e-03]] Final stress: [-2.93904277e-05 4.28905113e-06 1.59221686e-04 3.01652133e-13 -3.76705531e-04 -6.40805336e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.03484168e-12 2.63250049e-03 1.00956529e-10] [ 3.65209892e-12 -1.07768761e-02 2.64174438e-10] [ 3.48827146e-03 -1.68780776e-03 -6.33861624e-03] [-1.09669237e-03 -4.20803653e-04 6.14231381e-03] [ 2.20418078e-03 2.64802928e-03 1.54520568e-04] [-3.48827146e-03 -1.68780806e-03 6.33861612e-03] [-2.20418072e-03 2.64802931e-03 -1.54520595e-04] [ 1.09669204e-03 -4.20803488e-04 -6.14231396e-03] [-6.63005422e-03 -3.55161182e-03 -8.00440508e-03] [-5.64213880e-03 7.08438178e-03 -8.15515885e-03] [ 5.64213895e-03 7.08438185e-03 8.15515875e-03] [ 6.63005432e-03 -3.55161186e-03 8.00440511e-03]] Final stress: [-2.93943955e-05 4.28864528e-06 1.59214526e-04 -1.90181503e-13 3.76691375e-04 3.57065012e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.85174947e-11 -8.99575001e-04 -1.83627551e-11] [ 1.29574963e-11 1.10157147e-02 -2.26544510e-09] [ 2.03762445e-03 3.13338501e-03 6.91683132e-03] [ 3.62340270e-03 -4.35401670e-03 -7.05110351e-03] [-3.56413721e-03 -2.59932167e-03 -7.08156942e-05] [-2.03762440e-03 3.13338604e-03 -6.91683088e-03] [ 3.56413616e-03 -2.59932223e-03 7.08161715e-05] [-3.62340157e-03 -4.35401720e-03 7.05110403e-03] [ 1.47412451e-03 5.58449357e-03 1.73878988e-03] [-8.25531366e-03 -6.82261011e-03 1.74742704e-03] [ 8.25531332e-03 -6.82261002e-03 -1.74742558e-03] [-1.47412430e-03 5.58449364e-03 -1.73879049e-03]] Final stress: [ 2.26676286e-05 1.58207195e-05 -2.21372024e-06 -3.83562920e-13 -4.40587380e-04 -8.38273641e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.09085529e-11 -1.10149012e-02 4.93425366e-10] [-2.24996850e-12 8.99533297e-04 2.88867345e-09] [ 2.03635107e-03 -3.12807336e-03 -6.91873285e-03] [-3.55773841e-03 2.60497688e-03 7.39498582e-05] [ 3.62742653e-03 4.35485112e-03 7.04985081e-03] [-2.03635105e-03 -3.12807493e-03 6.91873219e-03] [-3.62742498e-03 4.35485204e-03 -7.04985158e-03] [ 3.55773720e-03 2.60497759e-03 -7.39504607e-05] [ 8.26498815e-03 6.81165638e-03 1.74777575e-03] [-1.47349352e-03 -5.58572709e-03 1.73913992e-03] [ 1.47349334e-03 -5.58572713e-03 -1.73914170e-03] [-8.26498832e-03 6.81165640e-03 -1.74777533e-03]] Final stress: [ 2.26183435e-05 1.57808389e-05 -2.24145137e-06 1.15009129e-13 4.40628517e-04 -7.88955489e-14] Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.07460674e-03 -6.71222909e-03 3.77804688e-05] [-4.07460673e-03 6.71222907e-03 -3.77807118e-05] [-1.24481506e-03 -9.18862611e-11 3.47036363e-11] [-1.40513226e-03 5.43543940e-05 2.48946654e-03] [-1.40513271e-03 -5.43541358e-05 -2.48946634e-03] [ 5.36588505e-03 -1.16930447e-10 -4.03330299e-11] [-1.20959723e-04 -3.33971746e-03 -8.46965325e-03] [-1.20960108e-04 3.33971768e-03 8.46965308e-03] [ 2.26564921e-03 1.14590264e-02 -8.12126211e-03] [ 1.27451488e-03 8.20491520e-04 -8.05315403e-03] [ 2.26564926e-03 -1.14590265e-02 8.12126246e-03] [ 1.27451493e-03 -8.20491681e-04 8.05315390e-03]] Final stress: [ 4.22259529e-06 -2.94077269e-05 1.59342259e-04 -3.76915768e-04 -2.93724643e-13 1.72084581e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.07476050e-03 -6.71260474e-03 -3.77856664e-05] [ 4.07476051e-03 6.71260471e-03 3.77852601e-05] [-5.36672202e-03 -1.99573536e-10 8.18975959e-11] [ 1.21223188e-04 3.34030124e-03 -8.46985950e-03] [ 1.21222542e-04 -3.34030090e-03 8.46985978e-03] [ 1.24501699e-03 -4.44271668e-11 -6.38618906e-12] [ 1.40499934e-03 -5.44930797e-05 2.48967374e-03] [ 1.40499913e-03 5.44931934e-05 -2.48967385e-03] [-1.27450911e-03 -8.20417160e-04 -8.05356296e-03] [-2.26562104e-03 -1.14594774e-02 -8.12167750e-03] [-1.27450907e-03 8.20417108e-04 8.05356329e-03] [-2.26562095e-03 1.14594772e-02 8.12167732e-03]] Final stress: [ 4.21742118e-06 -2.94089497e-05 1.59348872e-04 3.76928807e-04 -3.51170477e-13 9.62507360e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.10797431e-03 6.01018497e-03 -8.33904163e-05] [-5.10797432e-03 -6.01018494e-03 8.33904432e-05] [ 3.88409682e-03 -4.44916422e-10 1.65038440e-10] [-9.98460570e-04 -2.53384889e-03 9.66535087e-03] [-9.98460984e-04 2.53384921e-03 -9.66535070e-03] [ 7.34600759e-03 8.59016718e-11 9.76692019e-12] [-6.87145019e-04 -4.92924548e-03 -2.57284894e-03] [-6.87144842e-04 4.92924552e-03 2.57284894e-03] [-4.28756749e-03 -9.73195183e-03 1.82197246e-03] [ 5.46609556e-03 2.86577593e-03 1.70238706e-03] [-4.28756770e-03 9.73195169e-03 -1.82197247e-03] [ 5.46609525e-03 -2.86577582e-03 -1.70238742e-03]] Final stress: [ 1.60154044e-05 2.30364203e-05 -2.21858726e-06 -4.44644873e-04 1.11922492e-12 -3.24453387e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.10780645e-03 6.00999274e-03 8.33965510e-05] [ 5.10780643e-03 -6.00999275e-03 -8.33969172e-05] [-7.34859733e-03 -3.02445036e-10 1.35815802e-10] [ 6.80146759e-04 4.92482007e-03 -2.57590560e-03] [ 6.80145588e-04 -4.92481938e-03 2.57590617e-03] [-3.88333182e-03 -3.75715255e-10 -1.42727929e-10] [ 9.98090904e-04 2.53508355e-03 9.66497135e-03] [ 9.98090310e-04 -2.53508316e-03 -9.66497164e-03] [-5.46610043e-03 -2.86011045e-03 1.70272891e-03] [ 4.29602179e-03 9.73159165e-03 1.82230680e-03] [-5.46610045e-03 2.86011045e-03 -1.70272825e-03] [ 4.29602180e-03 -9.73159203e-03 -1.82230736e-03]] Final stress: [ 1.59612475e-05 2.29637812e-05 -2.25481271e-06 4.44665533e-04 -7.71293717e-14 9.17847390e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.28425774e-12 -2.48649338e-03 2.05564030e-10] [-6.20815329e-12 1.06670208e-02 2.80769385e-10] [-3.17113163e-03 1.74252790e-03 6.34564744e-03] [ 1.04778796e-03 4.79126585e-04 -6.28779114e-03] [-2.24412492e-03 -2.80718386e-03 -1.02699490e-04] [ 3.17113165e-03 1.74252755e-03 -6.34564759e-03] [ 2.24412502e-03 -2.80718382e-03 1.02699440e-04] [-1.04778809e-03 4.79126677e-04 6.28779109e-03] [ 6.72991337e-03 3.80537108e-03 -8.00412674e-03] [ 5.52208805e-03 -7.31010534e-03 -8.15251169e-03] [-5.52208806e-03 -7.31010521e-03 8.15251152e-03] [-6.72991335e-03 3.80537100e-03 8.00412668e-03]] Final stress: [-4.26515057e-06 -2.09691527e-05 1.59153374e-04 -9.54969174e-14 -3.76150354e-04 4.84177528e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.76204040e-12 -1.06668064e-02 4.05158812e-10] [ 5.81193347e-12 2.48639971e-03 3.49111427e-10] [-3.17103841e-03 -1.74220076e-03 -6.34563620e-03] [-2.24372901e-03 2.80695382e-03 1.02780073e-04] [ 1.04779777e-03 -4.78922790e-04 6.28769674e-03] [ 3.17103843e-03 -1.74220117e-03 6.34563604e-03] [-1.04779736e-03 -4.78922551e-04 -6.28769694e-03] [ 2.24372873e-03 2.80695401e-03 -1.02780220e-04] [-5.52170783e-03 7.30970437e-03 -8.15266385e-03] [-6.73000643e-03 -3.80533132e-03 -8.00428285e-03] [ 6.73000633e-03 -3.80533132e-03 8.00428274e-03] [ 5.52170777e-03 7.30970439e-03 8.15266370e-03]] Final stress: [-4.27509693e-06 -2.09794484e-05 1.59151023e-04 -3.71052468e-14 3.76145644e-04 -8.84266901e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.37060677e-12 1.12862077e-02 4.14303339e-12] [-1.72995199e-11 -1.05312894e-03 -1.70715738e-09] [-1.62456296e-03 2.83605313e-03 7.16298039e-03] [ 3.73320106e-03 -2.22200719e-03 -3.60364071e-05] [-3.90999300e-03 -4.58045622e-03 -6.92553313e-03] [ 1.62456293e-03 2.83605388e-03 -7.16298009e-03] [ 3.90999252e-03 -4.58045652e-03 6.92553336e-03] [-3.73320019e-03 -2.22200773e-03 3.60368099e-05] [-8.20876808e-03 -6.68501650e-03 1.77388425e-03] [ 1.34182737e-03 5.53488753e-03 1.77443357e-03] [-1.34182745e-03 5.53488753e-03 -1.77443238e-03] [ 8.20876780e-03 -6.68501661e-03 -1.77388467e-03]] Final stress: [ 7.49689515e-06 3.19182758e-05 -2.22999415e-06 3.44844839e-13 -4.47002773e-04 5.92971465e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.49017251e-11 1.05538342e-03 -1.81049146e-09] [ 3.91057671e-12 -1.12899551e-02 -2.91622971e-10] [-1.63078504e-03 -2.83236677e-03 -7.16544430e-03] [-3.90607620e-03 4.57806227e-03 6.92716406e-03] [ 3.73358684e-03 2.22622571e-03 3.69610053e-05] [ 1.63078504e-03 -2.83236551e-03 7.16544480e-03] [-3.73358837e-03 2.22622480e-03 -3.69602800e-05] [ 3.90607739e-03 4.57806152e-03 -6.92716351e-03] [-1.34486925e-03 -5.54013936e-03 1.77566818e-03] [ 8.20951808e-03 6.68550420e-03 1.77489501e-03] [-8.20951788e-03 6.68550440e-03 -1.77489555e-03] [ 1.34486936e-03 -5.54013954e-03 -1.77566732e-03]] Final stress: [ 7.21987451e-06 3.16458979e-05 -2.37547872e-06 -1.40892037e-13 4.47069172e-04 1.05149301e-12] Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.69719902e-03 -4.71548073e-05 -1.18280443e-07] [-4.69719902e-03 4.71548162e-05 1.17185606e-07] [ 6.73412359e-03 -1.13279619e-10 3.90216935e-11] [ 1.16603744e-04 -3.53107533e-03 6.75557800e-03] [ 1.16603865e-04 3.53107527e-03 -6.75557805e-03] [ 6.49130670e-03 1.34150164e-10 8.82586919e-11] [ 2.89041639e-04 -3.87086801e-03 -6.64262805e-03] [ 2.89042086e-04 3.87086780e-03 6.64262829e-03] [-1.18983897e-03 6.10032623e-03 7.11021502e-03] [-1.13132278e-03 6.30139854e-03 7.11032283e-03] [-1.18983902e-03 -6.10032616e-03 -7.11021482e-03] [-1.13132282e-03 -6.30139837e-03 -7.11032225e-03]] Final stress: [ 4.55694489e-05 3.88519989e-05 -7.58084120e-05 -3.38769759e-04 3.09794352e-13 -2.11124919e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.69710563e-03 -4.71534098e-05 1.18452888e-07] [ 4.69710564e-03 4.71534154e-05 -1.17486759e-07] [-6.49103928e-03 7.99455598e-10 -3.56443477e-10] [-2.88961105e-04 3.87078896e-03 -6.64244717e-03] [-2.88959143e-04 -3.87079009e-03 6.64244620e-03] [-6.73389206e-03 3.33541622e-10 1.78810581e-10] [-1.16509181e-04 3.53096743e-03 6.75539400e-03] [-1.16507982e-04 -3.53096814e-03 -6.75539341e-03] [ 1.13115870e-03 -6.30113154e-03 7.11026269e-03] [ 1.18967008e-03 -6.10006531e-03 7.11015646e-03] [ 1.13115871e-03 6.30113193e-03 -7.11026399e-03] [ 1.18966999e-03 6.10006563e-03 -7.11015557e-03]] Final stress: [ 4.55700991e-05 3.88529082e-05 -7.58073121e-05 3.38764813e-04 3.98020752e-13 3.16635599e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.29754329e-03 -2.87862618e-05 -9.60338407e-08] [-3.29754331e-03 2.87862608e-05 9.42652604e-08] [ 6.00148579e-03 -3.90412020e-10 1.64850221e-10] [-9.04571296e-04 -5.35726722e-03 4.79135671e-03] [-9.04572539e-04 5.35726792e-03 -4.79135613e-03] [ 7.63936470e-03 2.18848810e-10 9.60552349e-11] [-1.64450323e-03 -3.99025606e-03 -4.73765368e-03] [-1.64450217e-03 3.99025546e-03 4.73765417e-03] [-5.28262395e-04 5.49569925e-03 -2.02861540e-03] [-4.45544927e-04 5.61267934e-03 -2.02851825e-03] [-5.28262470e-04 -5.49569888e-03 2.02861568e-03] [-4.45544870e-04 -5.61267964e-03 2.02851841e-03]] Final stress: [-4.69437181e-05 -5.16327370e-05 1.55375137e-05 -2.76570526e-04 4.19346302e-14 1.47667315e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.29750444e-03 -2.87859459e-05 9.49936716e-08] [ 3.29750445e-03 2.87859426e-05 -9.64637608e-08] [-7.63941181e-03 -2.04784263e-10 9.93512766e-11] [ 1.64431947e-03 3.99030746e-03 -4.73767790e-03] [ 1.64431929e-03 -3.99030732e-03 4.73767804e-03] [-6.00168422e-03 -1.94924238e-10 -4.56443811e-11] [ 9.04463914e-04 5.35718949e-03 4.79138038e-03] [ 9.04463782e-04 -5.35718940e-03 -4.79138041e-03] [ 4.45771635e-04 -5.61241956e-03 -2.02841754e-03] [ 5.28488729e-04 -5.49544065e-03 -2.02851439e-03] [ 4.45771586e-04 5.61241968e-03 2.02841836e-03] [ 5.28488728e-04 5.49544071e-03 2.02851488e-03]] Final stress: [-4.69389377e-05 -5.16279258e-05 1.55379045e-05 2.76571044e-04 1.44144216e-13 -1.67915464e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.73675430e-12 4.74415489e-03 4.57018346e-10] [ 1.50910466e-11 4.64985166e-03 -1.82785842e-10] [ 2.13575753e-04 1.93281920e-03 7.73514129e-03] [ 3.61941294e-03 -4.35622495e-03 -3.92460485e-03] [-3.78196989e-03 -4.59664742e-03 -3.81165395e-03] [-2.13575750e-04 1.93281901e-03 -7.73514135e-03] [ 3.78196992e-03 -4.59664738e-03 3.81165392e-03] [-3.61941352e-03 -4.35622462e-03 3.92460458e-03] [ 6.22882709e-03 1.26205381e-03 7.10999992e-03] [ 6.17032183e-03 1.06099594e-03 7.11080142e-03] [-6.17032155e-03 1.06099592e-03 -7.11080104e-03] [-6.22882686e-03 1.26205395e-03 -7.11000021e-03]] Final stress: [ 3.88757278e-05 4.55927957e-05 -7.58003189e-05 -4.12508455e-13 -3.38767799e-04 -2.62780801e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.46604258e-11 -4.64991284e-03 3.84137698e-10] [-1.17203591e-11 -4.74421746e-03 1.04103283e-09] [ 2.13352654e-04 -1.93340158e-03 -7.73498242e-03] [-3.78199684e-03 4.59610960e-03 3.81157434e-03] [ 3.61966576e-03 4.35607498e-03 3.92452399e-03] [-2.13352637e-04 -1.93340230e-03 7.73498212e-03] [-3.61966479e-03 4.35607557e-03 -3.92452446e-03] [ 3.78199640e-03 4.59610983e-03 -3.81157455e-03] [-6.17093610e-03 -1.06032877e-03 7.11068702e-03] [-6.22944354e-03 -1.26138903e-03 7.10988654e-03] [ 6.22944329e-03 -1.26138917e-03 -7.10988703e-03] [ 6.17093583e-03 -1.06032881e-03 -7.11068698e-03]] Final stress: [ 3.88620447e-05 4.55791713e-05 -7.58045275e-05 5.16722320e-13 3.38766033e-04 -1.42859357e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.01029816e-12 3.32629024e-03 3.41244501e-10] [-1.72441193e-11 3.26871866e-03 -5.17474805e-10] [-7.62833816e-04 3.97264921e-03 5.50142392e-03] [ 5.09471864e-03 -4.80855540e-03 -2.77783370e-03] [-4.25287536e-03 -3.43585819e-03 -2.72413144e-03] [ 7.62833811e-04 3.97264876e-03 -5.50142408e-03] [ 4.25287523e-03 -3.43585825e-03 2.72413149e-03] [-5.09471777e-03 -4.80855588e-03 2.77783408e-03] [ 5.59528899e-03 5.45618823e-04 -2.02867502e-03] [ 5.51257108e-03 4.28641689e-04 -2.02825770e-03] [-5.51257155e-03 4.28642087e-04 2.02825806e-03] [-5.59528925e-03 5.45618252e-04 2.02867457e-03]] Final stress: [-5.16279268e-05 -4.69389354e-05 1.55379057e-05 5.58011123e-13 -2.76571044e-04 2.06114407e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.50778677e-11 -3.26858729e-03 -1.16678010e-09] [ 6.73795727e-12 -3.32615686e-03 -6.03056312e-10] [-7.62869909e-04 -3.97269420e-03 -5.50123976e-03] [-4.25287260e-03 3.43581486e-03 2.72404154e-03] [ 5.09475134e-03 4.80857117e-03 2.77774149e-03] [ 7.62869925e-04 -3.97269294e-03 5.50124023e-03] [-5.09475298e-03 4.80857024e-03 -2.77774077e-03] [ 4.25287388e-03 3.43581413e-03 -2.72404099e-03] [-5.51206823e-03 -4.28673952e-04 -2.02777638e-03] [-5.59478565e-03 -5.45645645e-04 -2.02819467e-03] [ 5.59478576e-03 -5.45645410e-04 2.02819442e-03] [ 5.51206844e-03 -4.28674103e-04 2.02777665e-03]] Final stress: [-5.16283184e-05 -4.69394706e-05 1.55288992e-05 -3.05391470e-13 2.76569518e-04 8.27906355e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.42591467e-03 -5.37650233e-06 -1.02658548e-08] [-1.42591466e-03 5.37651075e-06 1.04487729e-08] [ 3.46190585e-03 2.55030394e-10 -1.07797229e-10] [ 7.12243896e-04 -1.78253053e-03 2.62946218e-03] [ 7.12244741e-04 1.78253004e-03 -2.62946257e-03] [ 3.70170687e-03 7.15527341e-11 3.97362988e-11] [ 6.11336181e-04 -1.58923271e-03 -2.61658994e-03] [ 6.11336264e-04 1.58923267e-03 2.61659000e-03] [-1.74972773e-03 9.47685914e-05 -2.10376669e-03] [-1.72974449e-03 1.25930037e-04 -2.10375004e-03] [-1.74972773e-03 -9.47686226e-05 2.10376648e-03] [-1.72974453e-03 -1.25929814e-04 2.10375047e-03]] Final stress: [-7.04366055e-06 -8.13825820e-06 4.39800161e-05 -1.35368354e-04 1.66769596e-13 -5.35974990e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.42558574e-03 -5.37704889e-06 1.02964868e-08] [ 1.42558575e-03 5.37704109e-06 -1.10204285e-08] [-3.70380707e-03 -2.41716452e-10 1.00174058e-10] [-6.11075454e-04 1.58863590e-03 -2.61656170e-03] [-6.11075832e-04 -1.58863569e-03 2.61656188e-03] [-3.46174220e-03 2.01241794e-10 8.32386609e-11] [-7.13114263e-04 1.78389343e-03 2.62943696e-03] [-7.13114306e-04 -1.78389340e-03 -2.62943697e-03] [ 1.73069715e-03 -1.24144073e-04 -2.10384330e-03] [ 1.75068164e-03 -9.29800417e-05 -2.10385947e-03] [ 1.73069719e-03 1.24143852e-04 2.10384359e-03] [ 1.75068166e-03 9.29800772e-05 2.10385955e-03]] Final stress: [-7.11106439e-06 -8.20577060e-06 4.39499632e-05 1.35389787e-04 -1.84070264e-13 -6.12755536e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.47318127e-04 6.49708884e-04 3.64271366e-10] [-6.52099617e-04 6.49708874e-04 -3.81943927e-10] [ 3.96339595e-04 9.03349821e-04 1.03298616e-03] [ 8.10412453e-04 -2.05884735e-03 3.82054077e-04] [-9.19744834e-04 8.68797427e-04 -1.41503225e-03] [ 1.78594774e-03 8.96268310e-04 -1.04211590e-03] [ 1.09653279e-04 -8.52178024e-04 -3.77489267e-04] [-1.60859351e-03 -3.31405349e-04 1.41959719e-03] [ 1.06730287e-03 6.97112459e-04 -1.22043442e-03] [ 1.05255364e-03 6.97341204e-04 -1.22043834e-03] [-7.04601502e-04 -1.06004255e-03 1.22043790e-03] [-6.89851989e-04 -1.05981371e-03 1.22043487e-03]] Final stress: [-3.91324829e-05 -3.91324840e-05 1.26334657e-05 -5.46784692e-05 -5.46784689e-05 -1.79745339e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.51724641e-04 -6.49336924e-04 3.46362449e-10] [-6.46949237e-04 -6.49336938e-04 -2.80765325e-10] [ 3.92724153e-04 -9.01291811e-04 -1.03217291e-03] [-9.16435295e-04 -8.68900637e-04 1.41391796e-03] [ 8.09380268e-04 2.05554720e-03 -3.81752842e-04] [ 1.78365595e-03 -8.94204282e-04 1.04129421e-03] [-1.60594391e-03 3.32452387e-04 -1.41847890e-03] [ 1.07957550e-04 8.47735393e-04 3.77192115e-04] [-7.01997579e-04 1.05840471e-03 -1.22454976e-03] [-6.87255332e-04 1.05818364e-03 -1.22454718e-03] [ 1.06566493e-03 -6.94515900e-04 1.22454682e-03] [ 1.05092314e-03 -6.94736852e-04 1.22455041e-03]] Final stress: [-3.91856687e-05 -3.91856705e-05 1.26808458e-05 -5.46418677e-05 5.46418682e-05 1.79502500e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.47262302e-04 6.49652378e-04 -5.16646747e-10] [ 6.52042449e-04 6.49652382e-04 -1.67424917e-10] [-1.78537551e-03 8.95312497e-04 1.04210089e-03] [ 1.60741534e-03 -3.31972521e-04 -1.41957711e-03] [-1.09356933e-04 -8.50967185e-04 3.77484461e-04] [-3.95416252e-04 9.02396883e-04 -1.03297257e-03] [ 9.18391184e-04 8.68534957e-04 1.41501330e-03] [-8.10292471e-04 -2.05793952e-03 -3.82048466e-04] [ 6.89703472e-04 -1.05929916e-03 -1.22135739e-03] [ 7.04451206e-04 -1.05952548e-03 -1.22136024e-03] [-1.05203831e-03 6.97190580e-04 1.22136096e-03] [-1.06678647e-03 6.96964188e-04 1.22135685e-03]] Final stress: [-3.91460181e-05 -3.91460162e-05 1.26433167e-05 5.46681159e-05 -5.46681157e-05 1.79689709e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.51864390e-04 -6.49476148e-04 -3.02384865e-10] [ 6.47087892e-04 -6.49476150e-04 -1.07127238e-10] [-1.78358357e-03 -8.94604093e-04 -1.04142807e-03] [-1.08079931e-04 8.48240306e-04 -3.77240578e-04] [ 1.60632398e-03 3.32017087e-04 1.41866104e-03] [-3.93156963e-04 -9.01691341e-04 1.03230578e-03] [-8.09250319e-04 2.05561515e-03 3.81801862e-04] [ 9.17067628e-04 -8.68897530e-04 -1.41409982e-03] [-1.05214482e-03 -6.95491125e-04 -1.22359678e-03] [-1.06688837e-03 -6.95269088e-04 -1.22359289e-03] [ 6.88008331e-04 1.05940545e-03 1.22359369e-03] [ 7.02751747e-04 1.05962748e-03 1.22359618e-03]] Final stress: [-3.91674466e-05 -3.91674460e-05 1.26725892e-05 5.46428531e-05 5.46428527e-05 -1.79539417e-07] Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.10320803e-12 1.43120491e-03 -1.50776600e-10] [ 8.59322545e-13 1.42045158e-03 9.92847296e-11] [-1.05617171e-04 3.11339072e-04 3.02884747e-03] [ 1.74822532e-03 -2.70736319e-03 -1.52088693e-03] [-1.62361552e-03 -2.51005245e-03 -1.50801360e-03] [ 1.05617170e-04 3.11339076e-04 -3.02884747e-03] [ 1.62361535e-03 -2.51005255e-03 1.50801367e-03] [-1.74822525e-03 -2.70736323e-03 1.52088696e-03] [ 1.19881027e-04 1.75570524e-03 -2.10379113e-03] [ 9.98975399e-05 1.72454315e-03 -2.10375607e-03] [-9.98975135e-05 1.72454321e-03 2.10375592e-03] [-1.19880945e-04 1.75570518e-03 2.10379123e-03]] Final stress: [-8.15895387e-06 -7.06432245e-06 4.39705597e-05 -5.16947924e-14 -1.35374022e-04 2.13776794e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.82609622e-12 -1.42052476e-03 -2.61661109e-11] [ 4.81885545e-12 -1.43127772e-03 -4.85300579e-10] [-1.05272244e-04 -3.11685143e-04 -3.02873549e-03] [-1.62383746e-03 2.51009253e-03 1.50795840e-03] [ 1.74810230e-03 2.70680544e-03 1.52083079e-03] [ 1.05272241e-04 -3.11684477e-04 3.02873575e-03] [-1.74810236e-03 2.70680540e-03 -1.52083076e-03] [ 1.62383751e-03 2.51009249e-03 -1.50795837e-03] [-1.00276281e-04 -1.72407549e-03 -2.10375261e-03] [-1.20259588e-04 -1.75523639e-03 -2.10378804e-03] [ 1.20259662e-04 -1.75523668e-03 2.10378835e-03] [ 1.00276211e-04 -1.72407521e-03 2.10375249e-03]] Final stress: [-8.13845566e-06 -7.04385870e-06 4.39801412e-05 1.25244455e-15 1.35369199e-04 -1.17594726e-12] Minimization converged after 68 steps. Minimization converged after 68 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-0.00530067 0.02312006 0.02091795] [-0.00893671 -0.02327214 -0.00998047] [ 0.0066026 0.00608381 -0.01761992] [-0.02328275 -0.00465195 -0.02926323] [-0.00405704 0.00320904 -0.01286706] [-0.00904857 0.00041004 0.01379534] [ 0.00151166 0.01365563 0.00909211] [-0.0045803 0.01946596 0.01994779] [ 0.00881727 -0.01802073 0.00169965] [ 0.01592284 -0.02268085 -0.0047841 ] [ 0.01255654 0.0020495 -0.00856634] [ 0.00979511 0.00063163 0.01762829]] Final stress: [ 5.61217431e-03 3.17130218e-03 3.31283570e-02 -2.92652191e-06 9.09998137e-03 2.95926199e-03] Minimization converged after 65 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 4.89654355e-03 1.25199570e-04 -2.53223852e-07] [-4.89654382e-03 -1.25199644e-04 -1.78567265e-07] [ 1.72591287e-03 -3.00277181e-04 -3.73218882e-03] [-3.69824584e-03 1.52246535e-03 9.90245348e-04] [-1.75524441e-03 1.24959346e-03 2.74240921e-03] [-1.72591270e-03 3.00265315e-04 -3.73219397e-03] [ 3.69826722e-03 -1.52245274e-03 9.90235202e-04] [ 1.75523029e-03 -1.24958567e-03 2.74240239e-03] [-2.11668784e-03 -4.12547151e-04 -1.24944549e-03] [ 2.11668336e-03 4.12543716e-04 -1.24949220e-03] [-1.48453128e-03 -1.54489132e-03 1.24921827e-03] [ 1.48452860e-03 1.54488629e-03 1.24924185e-03]] Final stress: [ 1.07617426e-04 8.44102586e-05 8.78869406e-05 6.20243109e-12 -5.70604496e-12 -1.53625044e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.89846758e-03 1.25501679e-04 2.21853903e-07] [ 4.89846895e-03 -1.25503306e-04 3.34793868e-07] [ 1.72849557e-03 3.01462131e-04 3.73524667e-03] [-1.76299829e-03 -1.25021724e-03 -2.74685588e-03] [-3.70573075e-03 -1.51916541e-03 -9.88891787e-04] [-1.72849468e-03 -3.01405085e-04 3.73526947e-03] [ 1.76296069e-03 1.25019520e-03 -2.74683816e-03] [ 3.70572538e-03 1.51916788e-03 -9.88892862e-04] [-1.50293800e-03 1.55041862e-03 -1.24531786e-03] [ 1.50295381e-03 -1.55044207e-03 -1.24535045e-03] [-2.11052405e-03 4.14706910e-04 1.24550021e-03] [ 2.11054896e-03 -4.14719308e-04 1.24557400e-03]] Final stress: [ 1.07812723e-04 8.45136950e-05 8.79041944e-05 -3.44060925e-11 -3.10923808e-11 1.53869510e-04] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.63111706e-03 2.64385114e-03 -3.13965267e-06] [-1.63111705e-03 -2.64385114e-03 3.13886834e-06] [ 2.17547793e-03 9.26702323e-11 -3.71600962e-11] [ 9.36461525e-04 -3.98795110e-04 4.12579093e-03] [ 9.36461801e-04 3.98794961e-04 -4.12579106e-03] [-6.42787933e-04 1.72332700e-10 9.04047012e-11] [-4.88522965e-04 -2.22365102e-04 -9.64151200e-04] [-4.88522398e-04 2.22364783e-04 9.64151486e-04] [ 3.52995557e-04 6.62774366e-04 -1.47793621e-03] [ 6.38375391e-05 4.15351580e-03 -1.48754830e-03] [ 3.52995525e-04 -6.62774220e-04 1.47793624e-03] [ 6.38375268e-05 -4.15351575e-03 1.48754884e-03]] Final stress: [-1.94674195e-06 2.94026455e-05 4.44057506e-05 -1.72557758e-04 1.71017601e-13 1.90164828e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.62590633e-03 2.63528070e-03 3.06388916e-06] [ 1.62590633e-03 -2.63528072e-03 -3.06379744e-06] [ 6.36698996e-04 -3.26787345e-10 1.27283485e-10] [ 4.87577674e-04 2.22497554e-04 -9.61141937e-04] [ 4.87576679e-04 -2.22496983e-04 9.61142373e-04] [-2.16933995e-03 1.27809856e-10 3.99140539e-11] [-9.45643320e-04 3.92808305e-04 4.12020641e-03] [-9.45643775e-04 -3.92808059e-04 -4.12020662e-03] [-5.29130364e-05 -4.12687031e-03 -1.47822090e-03] [-3.48606517e-04 -6.61174146e-04 -1.46870114e-03] [-5.29129384e-05 4.12686995e-03 1.47822105e-03] [-3.48606468e-04 6.61173910e-04 1.46870050e-03]] Final stress: [-2.10512837e-06 2.94280521e-05 4.41996597e-05 1.72303374e-04 -4.94800132e-13 -2.31556297e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.08443111e-02 -1.57387483e-02 3.29617518e-04] [-1.08443111e-02 1.57387482e-02 -3.29617564e-04] [ 5.09111300e-03 1.04617075e-10 -8.45768166e-11] [-1.38232973e-03 -6.01251521e-03 6.59195287e-03] [-1.38232996e-03 6.01251544e-03 -6.59195282e-03] [ 1.53763977e-02 -3.97856947e-10 -9.56068356e-11] [ 3.59016748e-04 -6.48147449e-03 -2.20768705e-02] [ 3.59016181e-04 6.48147482e-03 2.20768703e-02] [ 5.35318918e-03 1.25594745e-02 -2.45340097e-02] [-3.71931992e-03 -9.04836403e-03 -2.39925765e-02] [ 5.35318915e-03 -1.25594744e-02 2.45340101e-02] [-3.71932010e-03 9.04836370e-03 2.39925765e-02]] Final stress: [-6.59729283e-05 -2.39273188e-04 4.40626844e-04 -1.04394442e-03 3.61221050e-13 1.33186050e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.08430035e-02 -1.57370782e-02 -3.29528231e-04] [ 1.08430036e-02 1.57370782e-02 3.29527626e-04] [-1.53734664e-02 -5.21693551e-10 1.85839983e-10] [-3.59206265e-04 6.47883011e-03 -2.20744875e-02] [-3.59206618e-04 -6.47883008e-03 2.20744876e-02] [-5.08884584e-03 5.63735349e-11 -2.68348722e-12] [ 1.38261073e-03 6.01219319e-03 6.59082130e-03] [ 1.38261033e-03 -6.01219315e-03 -6.59082140e-03] [ 3.71756609e-03 9.04619436e-03 -2.39879651e-02] [-5.35281781e-03 -1.25621261e-02 -2.45292626e-02] [ 3.71756616e-03 -9.04619446e-03 2.39879656e-02] [-5.35281747e-03 1.25621266e-02 2.45292627e-02]] Final stress: [-6.60050936e-05 -2.39266570e-04 4.40519851e-04 1.04379266e-03 -8.79238891e-13 -2.05046481e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.09887566e-11 4.27850912e-03 5.08022860e-12] [-7.96899412e-12 -1.03881356e-03 3.78279461e-10] [ 1.42776088e-03 -7.58366484e-05 2.93195936e-03] [ 1.04587008e-03 -6.66541470e-04 1.04513569e-04] [ 4.12164134e-04 -4.79112767e-04 -3.01158368e-03] [-1.42776088e-03 -7.58360885e-05 -2.93195916e-03] [-4.12164057e-04 -4.79112716e-04 3.01158362e-03] [-1.04586962e-03 -6.66541729e-04 -1.04513394e-04] [ 2.56177818e-03 -1.87582036e-03 -1.47373015e-03] [ 2.21544051e-03 1.47746334e-03 -1.46347644e-03] [-2.21544073e-03 1.47746312e-03 1.46347593e-03] [-2.56177847e-03 -1.87582024e-03 1.47372997e-03]] Final stress: [-3.95952504e-06 3.12155065e-05 4.40929533e-05 4.07655665e-13 -1.72262139e-04 -7.31865487e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.11421649e-12 1.04282332e-03 -2.63179930e-10] [-1.39372740e-11 -4.29458453e-03 2.29357335e-10] [ 1.43493196e-03 6.80148031e-05 -2.93768620e-03] [ 4.04066888e-04 4.73563689e-04 3.01585283e-03] [ 1.04442963e-03 6.68104747e-04 -1.03054812e-04] [-1.43493196e-03 6.80148187e-05 2.93768619e-03] [-1.04443023e-03 6.68104414e-04 1.03055062e-04] [-4.04066040e-04 4.73563203e-04 -3.01585246e-03] [-2.23560903e-03 -1.48285753e-03 -1.47420363e-03] [-2.57445282e-03 1.89905534e-03 -1.48465796e-03] [ 2.57445260e-03 1.89905569e-03 1.48465743e-03] [ 2.23560900e-03 -1.48285795e-03 1.47420358e-03]] Final stress: [-3.78193532e-06 3.11940871e-05 4.43335475e-05 2.22923925e-13 1.72557384e-04 1.57498985e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.04464400e-11 -3.99554862e-03 -1.75427818e-10] [ 5.13165070e-11 2.59525927e-02 -4.09879980e-10] [-4.36794185e-03 4.36541241e-03 1.66531573e-02] [ 5.69221826e-03 -6.98361681e-03 -1.69923267e-02] [-6.78214813e-03 -6.93323520e-03 -6.33799358e-05] [ 4.36794196e-03 4.36541297e-03 -1.66531571e-02] [ 6.78214720e-03 -6.93323587e-03 6.33803817e-05] [-5.69221853e-03 -6.98361667e-03 1.69923266e-02] [ 6.93214472e-03 1.15895641e-02 -2.38947195e-02] [-3.57773718e-03 -1.30166469e-02 -2.46761537e-02] [ 3.57773781e-03 -1.30166466e-02 2.46761539e-02] [-6.93214435e-03 1.15895644e-02 2.38947194e-02]] Final stress: [-1.19150445e-04 -1.86132480e-04 4.41093055e-04 -1.84618523e-12 -1.04260577e-03 3.57299777e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.97665802e-11 -2.59549814e-02 -7.39491800e-11] [-6.71114702e-12 3.99583275e-03 3.53501309e-10] [-4.36805631e-03 -4.36781993e-03 -1.66537359e-02] [-6.78421896e-03 6.92979003e-03 6.21716685e-05] [ 5.69191798e-03 6.98553482e-03 1.69942187e-02] [ 4.36805652e-03 -4.36781983e-03 1.66537358e-02] [-5.69191750e-03 6.98553501e-03 -1.69942190e-02] [ 6.78421877e-03 6.92979013e-03 -6.21717610e-05] [ 3.57624894e-03 1.30216401e-02 -2.46786245e-02] [-6.93292116e-03 -1.15895710e-02 -2.38970658e-02] [ 6.93292110e-03 -1.15895711e-02 2.38970657e-02] [-3.57624941e-03 1.30216404e-02 2.46786247e-02]] Final stress: [-1.19220509e-04 -1.86219412e-04 4.41111852e-04 -4.91157863e-13 1.04268719e-03 -2.81576548e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.62818073e-03 -2.67404130e-03 3.09874138e-06] [-1.62818072e-03 2.67404130e-03 -3.09790433e-06] [-3.20737212e-04 -8.50649298e-11 2.30089165e-11] [-6.78525004e-04 1.04130399e-04 9.79691227e-04] [-6.78524691e-04 -1.04130581e-04 -9.79691383e-04] [ 1.83124981e-03 4.08859483e-11 3.48974287e-12] [ 1.12261234e-03 -7.25073849e-04 -4.09618728e-03] [ 1.12261183e-03 7.25074139e-04 4.09618703e-03] [ 4.88337804e-05 4.10447755e-03 -1.48849823e-03] [ 3.80003404e-04 7.14762923e-04 -1.47884079e-03] [ 4.88338446e-05 -4.10447788e-03 1.48849805e-03] [ 3.80003345e-04 -7.14762662e-04 1.47884050e-03]] Final stress: [ 3.11426758e-05 -3.73991138e-06 4.44130050e-05 -1.72759952e-04 -4.32826212e-14 -1.24868863e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.62711675e-03 -2.67231108e-03 -3.08329631e-06] [ 1.62711676e-03 2.67231109e-03 3.08358133e-06] [-1.83095954e-03 -1.53273181e-10 5.71135520e-11] [-1.12412399e-03 7.23387539e-04 -4.09507858e-03] [-1.12412421e-03 -7.23387416e-04 4.09507866e-03] [ 3.20178751e-04 5.51672833e-11 1.37987565e-11] [ 6.77876081e-04 -1.03540757e-04 9.79121778e-04] [ 6.77876066e-04 1.03540769e-04 -9.79121795e-04] [-3.79001297e-04 -7.14345239e-04 -1.47706197e-03] [-4.64770317e-05 -4.09892674e-03 -1.48670105e-03] [-3.79001302e-04 7.14345171e-04 1.47706184e-03] [-4.64770390e-05 4.09892677e-03 1.48670077e-03]] Final stress: [ 3.11441184e-05 -3.77351393e-06 4.43716717e-05 1.72709835e-04 2.41445912e-14 -2.25881966e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.09882818e-02 1.49437464e-02 -3.38465358e-04] [-1.09882818e-02 -1.49437464e-02 3.38466321e-04] [ 1.23915207e-02 6.56221372e-10 -2.58040170e-10] [ 1.32329402e-03 -8.59119649e-03 2.30533854e-02] [ 1.32329506e-03 8.59119595e-03 -2.30533859e-02] [ 8.79457315e-03 -9.26273824e-11 -2.12458157e-11] [-2.37172769e-03 -4.17409513e-03 -6.04496335e-03] [-2.37172810e-03 4.17409534e-03 6.04496319e-03] [-4.54235433e-03 -1.06454444e-02 -2.40466021e-02] [ 5.98602254e-03 1.39920248e-02 -2.45799046e-02] [-4.54235429e-03 1.06454443e-02 2.40466019e-02] [ 5.98602261e-03 -1.39920250e-02 2.45799048e-02]] Final stress: [-1.86437294e-04 -1.19334639e-04 4.41615891e-04 -1.04367772e-03 -2.23437580e-13 -1.85491622e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.09820164e-02 1.49366559e-02 3.38085127e-04] [ 1.09820164e-02 -1.49366560e-02 -3.38086431e-04] [-8.78950199e-03 -3.96888787e-10 7.76978834e-11] [ 2.36713426e-03 4.16695508e-03 -6.04385398e-03] [ 2.36713230e-03 -4.16695407e-03 6.04385471e-03] [-1.23848298e-02 7.21199886e-10 4.04334342e-10] [-1.32590376e-03 8.58743628e-03 2.30418458e-02] [-1.32590360e-03 -8.58743646e-03 -2.30418455e-02] [-5.97917856e-03 -1.39858488e-02 -2.45628986e-02] [ 4.54309813e-03 1.06369398e-02 -2.40301855e-02] [-5.97917834e-03 1.39858483e-02 2.45628984e-02] [ 4.54309849e-03 -1.06369403e-02 2.40301855e-02]] Final stress: [-1.86427687e-04 -1.19342164e-04 4.41244009e-04 1.04312316e-03 -1.69037662e-12 -1.49195368e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.15042800e-12 -1.01430598e-03 6.24984206e-10] [-1.84817773e-12 4.27688493e-03 -4.61039061e-10] [-1.04714443e-03 -2.22860423e-05 2.92929933e-03] [-5.91055734e-04 -1.88759351e-04 -3.05641117e-03] [-1.19001184e-03 -9.96562501e-04 1.01899201e-04] [ 1.04714443e-03 -2.22862552e-05 -2.92929942e-03] [ 1.19001164e-03 -9.96562607e-04 -1.01899125e-04] [ 5.91055665e-04 -1.88759312e-04 3.05641113e-03] [ 2.26528904e-03 1.53249589e-03 -1.47796758e-03] [ 2.54893270e-03 -1.95617736e-03 -1.48824711e-03] [-2.54893259e-03 -1.95617720e-03 1.48824757e-03] [-2.26528889e-03 1.53249578e-03 1.47796700e-03]] Final stress: [ 2.93708599e-05 -1.95225957e-06 4.44056283e-05 -2.09557811e-13 -1.72648241e-04 6.04185858e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.11987198e-12 -4.27648352e-03 1.70085038e-10] [ 5.39131502e-12 1.01424994e-03 -5.91615693e-10] [-1.04725603e-03 2.24755971e-05 -2.92915601e-03] [-1.19002491e-03 9.96497356e-04 -1.01932849e-04] [-5.91150544e-04 1.89068776e-04 3.05630178e-03] [ 1.04725603e-03 2.24755794e-05 2.92915601e-03] [ 5.91150427e-04 1.89068706e-04 -3.05630172e-03] [ 1.19002470e-03 9.96497471e-04 1.01932768e-04] [-2.54861491e-03 1.95546887e-03 -1.48791937e-03] [-2.26459409e-03 -1.53239386e-03 -1.47764424e-03] [ 2.26459426e-03 -1.53239384e-03 1.47764483e-03] [ 2.54861506e-03 1.95546893e-03 1.48791922e-03]] Final stress: [ 2.93676194e-05 -1.96195045e-06 4.43964994e-05 -2.78587513e-13 1.72641422e-04 -1.40168822e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.00628138e-11 2.65815829e-02 -3.58183445e-10] [ 1.88599103e-12 -4.88611407e-03 -4.61845756e-10] [ 2.57420521e-03 3.94916780e-03 1.66703737e-02] [ 8.56821584e-03 -9.03887142e-03 -3.80261107e-04] [-4.21077251e-03 -4.10853409e-03 -1.59345017e-02] [-2.57420521e-03 3.94916815e-03 -1.66703735e-02] [ 4.21077256e-03 -4.10853402e-03 1.59345017e-02] [-8.56821562e-03 -9.03887150e-03 3.80261226e-04] [-2.77723422e-03 -1.16493236e-02 -2.46745689e-02] [ 6.28675317e-03 9.99982666e-03 -2.38586368e-02] [-6.28675333e-03 9.99982654e-03 2.38586371e-02] [ 2.77723410e-03 -1.16493234e-02 2.46745691e-02]] Final stress: [-2.39593105e-04 -6.60084897e-05 4.40639407e-04 -2.04758390e-13 -1.04421221e-03 -8.92322595e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.83250857e-12 4.88676526e-03 -6.46216271e-11] [-5.82380722e-11 -2.65882693e-02 1.96084172e-10] [ 2.57921167e-03 -3.94857189e-03 -1.66758848e-02] [-4.21810797e-03 4.11197254e-03 1.59375011e-02] [ 8.56624692e-03 9.04524388e-03 3.82617359e-04] [-2.57921156e-03 -3.94857177e-03 1.66758848e-02] [-8.56624684e-03 9.04524387e-03 -3.82617417e-04] [ 4.21810844e-03 4.11197214e-03 -1.59375008e-02] [-6.28541115e-03 -1.00020890e-02 -2.38688833e-02] [ 2.78696243e-03 1.16441967e-02 -2.46852232e-02] [-2.78696258e-03 1.16441968e-02 2.46852231e-02] [ 6.28541070e-03 -1.00020892e-02 2.38688831e-02]] Final stress: [-2.39511882e-04 -6.58785785e-05 4.40913546e-04 1.45796155e-13 1.04454824e-03 1.05902280e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.70552834e-03 -6.84849241e-05 -2.95740396e-07] [-3.70552833e-03 6.84849335e-05 2.95625778e-07] [ 1.15916807e-02 -3.32043172e-11 -3.01321347e-12] [-3.13529170e-03 -9.72457912e-03 5.77298268e-03] [-3.13529156e-03 9.72457906e-03 -5.77298277e-03] [ 1.31320893e-02 9.65845109e-11 6.14681924e-11] [-3.76753530e-03 -8.53576159e-03 -5.61602356e-03] [-3.76753513e-03 8.53576149e-03 5.61602368e-03] [-9.48665570e-04 2.55773777e-03 -1.19953384e-04] [-8.04864257e-04 2.83995780e-03 -1.19469835e-04] [-9.48665570e-04 -2.55773777e-03 1.19953319e-04] [-8.04864262e-04 -2.83995771e-03 1.19469926e-04]] Final stress: [-2.98798954e-05 -4.03503342e-05 1.74159705e-05 -4.76525247e-04 9.94935077e-14 -2.29296247e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.70525278e-03 -6.84757347e-05 2.95760143e-07] [ 3.70525278e-03 6.84757180e-05 -2.95464308e-07] [-1.31309587e-02 8.66772128e-11 -6.18736072e-11] [ 3.76724988e-03 8.53500127e-03 -5.61560855e-03] [ 3.76725012e-03 -8.53500141e-03 5.61560844e-03] [-1.15906335e-02 -3.86306527e-11 -1.45715055e-11] [ 3.13503123e-03 9.72376680e-03 5.77254421e-03] [ 3.13503098e-03 -9.72376666e-03 -5.77254431e-03] [ 8.04739581e-04 -2.83969703e-03 -1.19443400e-04] [ 9.48522642e-04 -2.55751665e-03 -1.19926703e-04] [ 8.04739604e-04 2.83969692e-03 1.19443389e-04] [ 9.48522633e-04 2.55751672e-03 1.19926703e-04]] Final stress: [-2.98785276e-05 -4.03475202e-05 1.74143650e-05 4.76491777e-04 -4.31291991e-14 -3.54900777e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.00995901e-02 -2.20384501e-04 -1.38918399e-06] [-1.00995903e-02 2.20384438e-04 1.38810630e-06] [ 1.49703171e-02 3.34427837e-09 -1.35957465e-09] [-3.28351945e-03 -1.35523061e-02 1.37161291e-02] [-3.28352092e-03 1.35523068e-02 -1.37161287e-02] [ 1.88339997e-02 1.26509497e-09 5.21354813e-10] [-4.84217408e-03 -1.06613038e-02 -1.32615791e-02] [-4.84216882e-03 1.06613008e-02 1.32615815e-02] [ 4.60357436e-04 2.12340069e-02 -8.12354210e-03] [ 8.62765774e-04 2.20835051e-02 -8.12238963e-03] [ 4.60357022e-04 -2.12340051e-02 8.12353962e-03] [ 8.62766640e-04 -2.20835092e-02 8.12239120e-03]] Final stress: [-1.08366203e-04 -1.40837320e-04 1.35346419e-04 -7.15337866e-04 -1.87622077e-12 1.21289188e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.00875426e-02 -2.19839984e-04 1.38906900e-06] [ 1.00875425e-02 2.19839928e-04 -1.39024440e-06] [-1.88084149e-02 1.18586895e-09 -5.08776942e-10] [ 4.83513722e-03 1.06506619e-02 -1.32457669e-02] [ 4.83513719e-03 -1.06506620e-02 1.32457667e-02] [-1.49544987e-02 1.69442767e-09 6.68853523e-10] [ 3.28090916e-03 1.35334631e-02 1.36993554e-02] [ 3.28091125e-03 -1.35334642e-02 -1.36993545e-02] [-8.62075725e-04 -2.20568886e-02 -8.11654252e-03] [-4.60057576e-04 -2.12081260e-02 -8.11767907e-03] [-8.62075578e-04 2.20568880e-02 8.11654149e-03] [-4.60057490e-04 2.12081249e-02 8.11768038e-03]] Final stress: [-1.08100274e-04 -1.40506205e-04 1.35265485e-04 7.14467565e-04 -1.00533935e-12 1.65551239e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.71286414e-12 3.77384474e-03 2.21395263e-11] [ 6.05343502e-12 3.63688771e-03 -1.19072979e-10] [-6.40371650e-04 8.72178208e-03 6.57449737e-03] [ 9.51915433e-03 -7.71736482e-03 -3.36666792e-03] [-8.74083260e-03 -6.46300851e-03 -3.20971933e-03] [ 6.40371658e-04 8.72178220e-03 -6.57449732e-03] [ 8.74083249e-03 -6.46300857e-03 3.20971938e-03] [-9.51915434e-03 -7.71736485e-03 3.36666792e-03] [ 2.77066807e-03 1.01770470e-03 -1.20413801e-04] [ 2.62687867e-03 7.35520312e-04 -1.18975125e-04] [-2.62687860e-03 7.35520308e-04 1.18975228e-04] [-2.77066804e-03 1.01770471e-03 1.20413691e-04]] Final stress: [-4.03490940e-05 -2.98795697e-05 1.74147562e-05 -9.95444367e-14 -4.76504376e-04 -6.73867793e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.34291486e-12 -3.63720015e-03 3.28108564e-11] [ 5.60471877e-12 -3.77417856e-03 -3.48129324e-10] [-6.40405252e-04 -8.72265861e-03 -6.57505680e-03] [-8.74172155e-03 6.46367749e-03 3.20998596e-03] [ 9.52009671e-03 7.71811551e-03 3.36696144e-03] [ 6.40405283e-04 -8.72265845e-03 6.57505690e-03] [-9.52009711e-03 7.71811528e-03 -3.36696124e-03] [ 8.74172162e-03 6.46367745e-03 -3.20998590e-03] [-2.62719334e-03 -7.35607314e-04 -1.19005221e-04] [-2.77100409e-03 -1.01783769e-03 -1.20444059e-04] [ 2.77100421e-03 -1.01783761e-03 1.20444244e-04] [ 2.62719350e-03 -7.35607352e-04 1.19004998e-04]] Final stress: [-4.03526675e-05 -2.98814686e-05 1.74164672e-05 -2.27290824e-13 4.76542872e-04 2.07121827e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.35323640e-10 1.03070418e-02 1.71694497e-09] [-1.15402737e-10 9.86738183e-03 1.09563372e-09] [-1.54253504e-03 1.10374903e-02 1.55530004e-02] [ 1.30502567e-02 -1.14640795e-02 -8.00837503e-03] [-1.11353304e-02 -8.33826353e-03 -7.55489759e-03] [ 1.54253503e-03 1.10374907e-02 -1.55530005e-02] [ 1.11353340e-02 -8.33826141e-03 7.55489578e-03] [-1.30502526e-02 -1.14640820e-02 8.00837666e-03] [ 2.18330297e-02 -2.37375687e-04 -8.11771676e-03] [ 2.14314700e-02 -1.08498248e-03 -8.11046512e-03] [-2.14314738e-02 -1.08498340e-03 8.11046430e-03] [-2.18330335e-02 -2.37376628e-04 8.11771499e-03]] Final stress: [-1.40616708e-04 -1.08222007e-04 1.35156082e-04 6.41942022e-12 -7.14461113e-04 -4.93194057e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 5.65423133e-12 -9.90552168e-03 9.17559341e-10] [ 3.00543125e-11 -1.03487862e-02 -1.72312562e-09] [-1.55755919e-03 -1.10789962e-02 -1.56161197e-02] [-1.11746922e-02 8.36578236e-03 7.58489915e-03] [ 1.31061643e-02 1.15185014e-02 8.04156972e-03] [ 1.55755926e-03 -1.10789960e-02 1.56161198e-02] [-1.31061654e-02 1.15185007e-02 -8.04156926e-03] [ 1.11746922e-02 8.36578226e-03 -7.58489912e-03] [-2.15177530e-02 1.08598166e-03 -8.13075313e-03] [-2.19206197e-02 2.35884918e-04 -8.13803546e-03] [ 2.19206201e-02 2.35885332e-04 8.13803698e-03] [ 2.15177535e-02 1.08598143e-03 8.13075187e-03]] Final stress: [-1.41708108e-04 -1.09096986e-04 1.35442141e-04 -6.48968484e-13 7.17333367e-04 1.28120669e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.78971697e-03 4.98587060e-03 9.43593664e-07] [-5.18201638e-03 4.98586278e-03 -9.43750343e-07] [ 1.62785244e-02 8.76256380e-03 9.07289307e-03] [ 7.73936495e-03 -1.99135145e-02 3.56072384e-03] [-1.36333180e-02 4.09684509e-04 -1.26267591e-02] [ 1.51967554e-02 8.86845189e-03 -9.62335549e-03] [ 8.16600701e-03 -2.05465865e-02 -3.28547682e-03] [-1.29781993e-02 1.65026623e-03 1.29019744e-02] [ 4.70724635e-03 9.49718281e-03 4.20056923e-03] [ 3.87446146e-03 9.88192625e-03 4.19399156e-03] [-1.01059409e-02 -4.48327309e-03 -4.19535690e-03] [-9.27316802e-03 -4.09843474e-03 -4.19920369e-03]] Final stress: [ 5.22319983e-05 5.22321124e-05 2.67764455e-06 -5.49888622e-04 -5.49888624e-04 -1.53025040e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.18218151e-03 -4.98601524e-03 9.43752290e-07] [-4.78985663e-03 -4.98602307e-03 -9.43795148e-07] [ 1.62790409e-02 -8.76301939e-03 -9.07313499e-03] [-1.36339329e-02 -4.09869802e-04 1.26271050e-02] [ 7.73967336e-03 1.99143890e-02 -3.56082853e-03] [ 1.51974373e-02 -8.86891493e-03 9.62363449e-03] [-1.29788899e-02 -1.65032820e-03 -1.29023388e-02] [ 8.16622549e-03 2.05472977e-02 3.28556297e-03] [-1.01061570e-02 4.48341698e-03 4.19545408e-03] [-9.27332902e-03 4.09855311e-03 4.19930107e-03] [ 4.70740513e-03 -9.49735857e-03 -4.20066686e-03] [ 3.87456488e-03 -9.88212765e-03 -4.19408842e-03]] Final stress: [ 5.22273788e-05 5.22274933e-05 2.67669720e-06 -5.49907794e-04 5.49907796e-04 1.53035133e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.78906772e-03 4.98516717e-03 -9.43199424e-07] [ 5.18125871e-03 4.98515932e-03 9.43198209e-07] [-1.51940718e-02 8.86770799e-03 9.62168790e-03] [ 1.29768648e-02 1.65057227e-03 -1.28997696e-02] [-8.16441006e-03 -2.05432988e-02 3.28493675e-03] [-1.62758203e-02 8.76184711e-03 -9.07138936e-03] [ 1.36319414e-02 4.10090844e-04 1.26246362e-02] [-7.73774644e-03 -1.99101622e-02 -3.56010184e-03] [ 9.27151362e-03 -4.09895741e-03 4.19903995e-03] [ 1.01040501e-02 -4.48369026e-03 4.19519486e-03] [-3.87504962e-03 9.88010104e-03 -4.19382997e-03] [-4.70759823e-03 9.49546294e-03 -4.20040489e-03]] Final stress: [ 5.22309674e-05 5.22310811e-05 2.66788131e-06 5.49808237e-04 -5.49808238e-04 1.52981335e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.18149112e-03 -4.98537623e-03 -9.43358136e-07] [ 4.78926904e-03 -4.98538406e-03 9.43307548e-07] [-1.51947836e-02 -8.86758320e-03 -9.62230036e-03] [-8.16505898e-03 2.05443258e-02 -3.28513990e-03] [ 1.29768043e-02 -1.65032934e-03 1.29005846e-02] [-1.62767469e-02 -8.76171564e-03 9.07195309e-03] [-7.73829749e-03 1.99110262e-02 3.56032954e-03] [ 1.36319978e-02 -4.09638846e-04 -1.26254267e-02] [-3.87458495e-03 -9.88088958e-03 4.19380065e-03] [-4.70720193e-03 -9.49622212e-03 4.20037650e-03] [ 9.27225333e-03 4.09851235e-03 -4.19901136e-03] [ 1.01048582e-02 4.48327462e-03 -4.19516597e-03]] Final stress: [ 5.22372135e-05 5.22373276e-05 2.67472292e-06 5.49831090e-04 5.49831091e-04 -1.52994120e-05] Minimization converged after 67 steps. Minimization converged after 68 steps. Minimization converged after 66 steps. Minimization converged after 69 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 56 steps. Final forces: [[-0.00685883 -0.0074873 0.00757868] [-0.01578101 0.00233665 -0.00499466] [-0.0071712 -0.00218962 -0.00433262] [ 0.00467641 -0.00051137 0.00183169] [ 0.00239863 -0.00392997 -0.01711379] [-0.00042619 -0.00219041 0.00119661] [ 0.00309863 0.00925422 -0.0044531 ] [-0.00391626 -0.00391146 0.00567704] [ 0.00351293 0.00243453 0.01648036] [ 0.00597782 0.00546955 -0.00611604] [ 0.0017968 0.00522428 -0.00416628] [ 0.01269225 -0.0044991 0.00841213]] Final stress: [ 0.00505491 0.00259356 0.03283966 0.00016152 -0.00884472 0.00322506] Minimization converged after 69 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[ 0.032142 -0.00811053 -0.02796478] [ 0.01041891 0.01259035 0.03533362] [ 0.01853801 -0.01029236 0.00890346] [-0.0074418 -0.0091382 -0.00730371] [-0.01209852 0.01829578 0.01053914] [ 0.00941551 0.01256127 -0.0159766 ] [-0.01087127 -0.00755846 0.00288529] [-0.00011574 0.00548471 -0.03273204] [-0.01708491 0.00161982 -0.00266736] [-0.00890061 0.00815461 0.0204297 ] [-0.0123637 0.00025529 0.01305078] [-0.00163787 -0.02386227 -0.0044975 ]] Final stress: [ 0.00509869 0.00275292 0.0334372 -0.00030267 0.00913962 0.00284718] Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.61440361e-03 -6.32286812e-06 6.08713535e-07] [-1.61440336e-03 6.32303700e-06 6.04450056e-07] [ 3.10613431e-04 -1.70468011e-04 -1.19947364e-03] [-8.00699101e-05 9.07302342e-04 7.76552583e-04] [ 5.92995633e-04 -8.58589581e-05 4.22102952e-04] [-3.10613291e-04 1.70519566e-04 -1.19945202e-03] [ 8.00175253e-05 -9.07332646e-04 7.76577627e-04] [-5.92949974e-04 8.58327503e-05 4.22124998e-04] [ 5.82027594e-04 -4.97009273e-04 -1.56634720e-04] [-5.82023890e-04 4.97010705e-04 -1.56596756e-04] [ 2.24744985e-04 -3.31828747e-04 1.56775933e-04] [-2.24742351e-04 3.31832103e-04 1.56809881e-04]] Final stress: [ 2.01567790e-05 2.76757508e-05 2.42574574e-05 -6.79537632e-12 3.76790935e-12 -5.37627717e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.61956773e-03 -6.32222810e-06 -5.78451809e-07] [ 1.61956747e-03 6.32232265e-06 -6.22283538e-07] [ 3.08405111e-04 1.63645296e-04 1.20262231e-03] [ 5.87750073e-04 8.84958012e-05 -4.23616463e-04] [-7.21782665e-05 -9.01050460e-04 -7.78232658e-04] [-3.08405380e-04 -1.63640817e-04 1.20262418e-03] [-5.87751168e-04 -8.84964174e-05 -4.23615826e-04] [ 7.21868646e-05 9.01045672e-04 -7.78228750e-04] [ 2.22926147e-04 3.34238103e-04 -1.53750193e-04] [-2.22929331e-04 -3.34236764e-04 -1.53726222e-04] [ 5.84264393e-04 4.99468834e-04 1.53570839e-04] [-5.84268178e-04 -4.99469342e-04 1.53553523e-04]] Final stress: [2.00330309e-05 2.75568368e-05 2.41481289e-05 6.24740571e-12 1.67050884e-12 5.38105640e-05] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.91331640e-04 1.31480220e-03 -1.80167831e-06] [-7.91331636e-04 -1.31480219e-03 1.80221037e-06] [ 9.99728927e-04 1.13986507e-10 -5.64668156e-11] [ 6.01074851e-04 -2.49697487e-04 2.04961540e-03] [ 6.01075527e-04 2.49697104e-04 -2.04961572e-03] [-2.50234090e-04 1.24730556e-10 4.90315139e-11] [ 4.18802609e-05 1.89533913e-04 -6.20394627e-04] [ 4.18804317e-05 -1.89534010e-04 6.20394706e-04] [-1.38487996e-04 4.29554878e-04 -5.51262422e-04] [-8.78832872e-05 2.01269540e-03 -5.54354231e-04] [-1.38487989e-04 -4.29554907e-04 5.51262018e-04] [-8.78833596e-05 -2.01269514e-03 5.54354353e-04]] Final stress: [-2.31992309e-06 1.17755469e-05 2.16264281e-05 -8.41703357e-05 2.09877900e-13 -5.79212304e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.91504668e-04 1.31517239e-03 1.80286496e-06] [ 7.91504656e-04 -1.31517237e-03 -1.80290330e-06] [ 2.50462995e-04 2.07481626e-10 -7.87328648e-11] [-4.19407224e-05 -1.89687640e-04 -6.20572588e-04] [-4.19407399e-05 1.89687636e-04 6.20572582e-04] [-1.00027041e-03 -3.02317319e-10 -1.11318333e-10] [-6.00795577e-04 2.50157381e-04 2.04982352e-03] [-6.00795173e-04 -2.50157600e-04 -2.04982333e-03] [ 8.77318793e-05 -2.01354458e-03 -5.54559193e-04] [ 1.38403307e-04 -4.29574776e-04 -5.51465903e-04] [ 8.77317522e-05 2.01354509e-03 5.54559134e-04] [ 1.38403361e-04 4.29574573e-04 5.51466011e-04]] Final stress: [-2.31673966e-06 1.17719277e-05 2.16301330e-05 8.41806051e-05 2.50176787e-13 1.46837214e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.64642346e-03 -2.64420655e-03 9.70718726e-06] [-1.64642347e-03 2.64420654e-03 -9.70636153e-06] [-3.83691322e-04 3.97964252e-10 -1.58156227e-10] [-1.32305185e-04 -4.82707777e-04 1.08388475e-03] [-1.32304666e-04 4.82707473e-04 -1.08388499e-03] [ 2.60046471e-03 -6.56966555e-10 -2.54219360e-10] [ 5.26330719e-04 -5.74379263e-04 -3.98553924e-03] [ 5.26329943e-04 5.74379675e-04 3.98553889e-03] [ 3.14597185e-04 2.96874189e-03 -3.10422658e-03] [-1.70585868e-04 2.17653090e-04 -3.08859136e-03] [ 3.14597234e-04 -2.96874165e-03 3.10422676e-03] [-1.70585820e-04 -2.17653177e-04 3.08859134e-03]] Final stress: [-8.21664792e-06 -4.51659071e-05 5.36066260e-05 -1.80898647e-04 -1.65886890e-13 7.93378411e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.64174527e-03 -2.63654698e-03 -9.64846667e-06] [ 1.64174527e-03 2.63654697e-03 9.64825987e-06] [-2.59205709e-03 -2.70648360e-12 7.80368067e-12] [-5.34272507e-04 5.68539059e-04 -3.97970329e-03] [-5.34272547e-04 -5.68539012e-04 3.97970334e-03] [ 3.80782553e-04 -1.59643205e-10 -5.51411655e-11] [ 1.32434820e-04 4.80844684e-04 1.08084794e-03] [ 1.32434404e-04 -4.80844449e-04 -1.08084810e-03] [ 1.71689634e-04 -2.19211334e-04 -3.07121446e-03] [-3.05959709e-04 -2.95430962e-03 -3.08677264e-03] [ 1.71689652e-04 2.19211259e-04 3.07121478e-03] [-3.05959755e-04 2.95430958e-03 3.08677270e-03]] Final stress: [-7.99288054e-06 -4.50250948e-05 5.33726313e-05 1.80568680e-04 2.97155762e-15 3.79274700e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.67312169e-12 2.11397245e-03 -2.55739530e-10] [ 9.74908862e-13 -5.31653563e-04 2.05117786e-10] [ 6.32917025e-04 -3.12449202e-04 1.54403669e-03] [ 3.17587791e-04 -5.74680644e-04 -5.72320079e-05] [ 2.45508733e-04 -1.28547257e-04 -1.47632512e-03] [-6.32917021e-04 -3.12449200e-04 -1.54403669e-03] [-2.45508824e-04 -1.28547306e-04 1.47632517e-03] [-3.17587842e-04 -5.74680622e-04 5.72319880e-05] [ 1.20363729e-03 -6.68614608e-04 -5.52587461e-04] [ 1.24305960e-03 8.93132263e-04 -5.54775078e-04] [-1.24305953e-03 8.93132293e-04 5.54774879e-04] [-1.20363723e-03 -6.68614600e-04 5.52587686e-04]] Final stress: [-2.74751919e-06 1.21974480e-05 2.16412315e-05 -1.12286055e-13 -8.42256230e-05 6.09563113e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.39097112e-12 5.31063627e-04 -9.29647298e-11] [-2.59528452e-12 -2.11192170e-03 1.55219454e-10] [ 6.32016391e-04 3.13082229e-04 -1.54320559e-03] [ 2.46510630e-04 1.29487406e-04 1.47584599e-03] [ 3.17979407e-04 5.73931802e-04 5.68776626e-05] [-6.32016390e-04 3.13081935e-04 1.54320549e-03] [-3.17978921e-04 5.73932086e-04 -5.68778705e-05] [-2.46510897e-04 1.29487554e-04 -1.47584609e-03] [-1.24041605e-03 -8.92115954e-04 -5.53603737e-04] [-1.20203477e-03 6.66043511e-04 -5.51402016e-04] [ 1.20203468e-03 6.66043418e-04 5.51402078e-04] [ 1.24041593e-03 -8.92115917e-04 5.53604027e-04]] Final stress: [-2.76100067e-06 1.22135246e-05 2.16202154e-05 1.86061364e-13 8.41915362e-05 -2.68962050e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.72112163e-11 -9.66628903e-04 2.93025311e-10] [ 1.78626312e-11 4.26590617e-03 -6.86786190e-10] [-1.46356471e-03 1.49317747e-04 2.91775668e-03] [ 1.83231296e-04 -7.93453741e-04 -2.95639250e-03] [-8.19875029e-04 -8.65572155e-04 -1.07731723e-05] [ 1.46356475e-03 1.49317898e-04 -2.91775663e-03] [ 8.19874241e-04 -8.65572611e-04 1.07735060e-05] [-1.83231532e-04 -7.93453575e-04 2.95639238e-03] [ 1.85776392e-03 1.35556786e-03 -3.10239842e-03] [ 1.32299388e-03 -1.49549843e-03 -3.08753047e-03] [-1.32299344e-03 -1.49549821e-03 3.08753101e-03] [-1.85776340e-03 1.35556795e-03 3.10239800e-03]] Final stress: [-9.99958118e-06 -4.33491623e-05 5.35888273e-05 -9.83966767e-13 -1.80818892e-04 2.20044239e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.20891919e-11 -4.26603657e-03 7.74358827e-10] [-3.41460762e-12 9.66665955e-04 3.79025014e-10] [-1.46361956e-03 -1.49397959e-04 -2.91780105e-03] [-8.19915369e-04 8.65603634e-04 1.07712640e-05] [ 1.83285064e-04 7.93413387e-04 2.95643638e-03] [ 1.46361954e-03 -1.49398539e-04 2.91780082e-03] [-1.83283800e-04 7.93414116e-04 -2.95643695e-03] [ 8.19914559e-04 8.65604077e-04 -1.07716287e-05] [-1.32309438e-03 1.49568073e-03 -3.08763433e-03] [-1.85786455e-03 -1.35561472e-03 -3.10249768e-03] [ 1.85786442e-03 -1.35561506e-03 3.10249787e-03] [ 1.32309410e-03 1.49568095e-03 3.08763414e-03]] Final stress: [-1.00004776e-05 -4.33489221e-05 5.35905732e-05 3.94612390e-13 1.80821693e-04 -1.20222049e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.91122924e-04 -1.32308547e-03 1.80021526e-06] [-7.91122927e-04 1.32308546e-03 -1.80016355e-06] [-2.84105799e-04 -1.60816842e-10 6.39197170e-11] [ 5.15501629e-05 1.72858224e-04 6.24640011e-04] [ 5.15494867e-05 -1.72857840e-04 -6.24639716e-04] [ 1.02829742e-03 6.65056497e-11 1.72433990e-11] [ 5.89031053e-04 -2.34040807e-04 -2.04257398e-03] [ 5.89030920e-04 2.34040883e-04 2.04257390e-03] [-8.99568349e-05 2.00323761e-03 -5.55253417e-04] [-1.31596901e-04 4.42537509e-04 -5.52153021e-04] [-8.99567941e-05 -2.00323775e-03 5.55253466e-04] [-1.31596858e-04 -4.42537728e-04 5.52152620e-04]] Final stress: [ 1.21905733e-05 -2.74405387e-06 2.16410646e-05 -8.42473174e-05 -2.82529168e-13 2.04183152e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.90982881e-04 -1.32293510e-03 -1.79979095e-06] [ 7.90982881e-04 1.32293510e-03 1.79958803e-06] [-1.02867314e-03 -1.19734778e-10 4.73624208e-11] [-5.89224392e-04 2.34103878e-04 -2.04246327e-03] [-5.89224264e-04 -2.34103949e-04 2.04246322e-03] [ 2.84048299e-04 5.98137055e-11 2.20887470e-11] [-5.14838050e-05 -1.72744438e-04 6.24535541e-04] [-5.14837955e-05 1.72744431e-04 -6.24535527e-04] [ 1.31563378e-04 -4.42370121e-04 -5.51830589e-04] [ 9.04743084e-05 -2.00235550e-03 -5.54930531e-04] [ 1.31563385e-04 4.42370065e-04 5.51830648e-04] [ 9.04742591e-05 2.00235569e-03 5.54930638e-04]] Final stress: [ 1.21935835e-05 -2.74778844e-06 2.16350575e-05 8.42447031e-05 1.31393571e-13 -5.05122152e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.64924341e-03 2.61423313e-03 -9.74329461e-06] [-1.64924341e-03 -2.61423313e-03 9.74224525e-06] [ 1.86100388e-03 -2.41259930e-10 1.07640779e-10] [ 8.80845417e-04 -1.18906867e-03 4.01587412e-03] [ 8.80845428e-04 1.18906868e-03 -4.01587408e-03] [ 3.78682470e-04 -2.62379706e-10 -8.14744958e-11] [-4.83934564e-04 1.29753209e-04 -1.06741859e-03] [-4.83935824e-04 -1.29752526e-04 1.06741810e-03] [-1.98211285e-04 1.64101940e-04 -3.08782820e-03] [ 3.30701260e-04 3.01785091e-03 -3.10340174e-03] [-1.98211133e-04 -1.64102351e-04 3.08782932e-03] [ 3.30701175e-04 -3.01785068e-03 3.10340210e-03]] Final stress: [-4.33686969e-05 -1.00072679e-05 5.35909105e-05 -1.80695404e-04 -1.83997871e-13 -1.22039580e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.63925808e-03 2.59812949e-03 9.62049671e-06] [ 1.63925809e-03 -2.59812952e-03 -9.61975505e-06] [-3.75707458e-04 1.46568788e-10 -8.22576811e-11] [ 4.79874304e-04 -1.26142387e-04 -1.06107209e-03] [ 4.79874182e-04 1.26142445e-04 1.06107209e-03] [-1.85191386e-03 8.09120154e-10 3.07509938e-10] [-8.93485301e-04 1.16888770e-03 4.00323671e-03] [-8.93484788e-04 -1.16888800e-03 -4.00323649e-03] [-3.12166724e-04 -2.98678600e-03 -3.06630147e-03] [ 2.00330005e-04 -1.67889302e-04 -3.05088965e-03] [-3.12166614e-04 2.98678551e-03 3.06630055e-03] [ 2.00330084e-04 1.67889105e-04 3.05088938e-03]] Final stress: [-4.30847529e-05 -9.51733280e-06 5.30932404e-05 1.79993200e-04 -6.15335836e-13 -6.98181857e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.11337739e-12 -5.23885072e-04 1.09241739e-10] [-4.77870836e-12 2.10678428e-03 -5.35087444e-10] [-6.48276949e-04 -2.94317263e-04 1.53759557e-03] [-2.41971692e-04 -1.59882508e-04 -1.48804260e-03] [-2.91142918e-04 -5.60441498e-04 -6.00761655e-05] [ 6.48276950e-04 -2.94317104e-04 -1.53759551e-03] [ 2.91142359e-04 -5.60441825e-04 6.00764112e-05] [ 2.41972051e-04 -1.59882702e-04 1.48804277e-03] [ 1.24788196e-03 9.03010263e-04 -5.53960709e-04] [ 1.19450392e-03 -6.79818447e-04 -5.51729942e-04] [-1.19450386e-03 -6.79818242e-04 5.51730220e-04] [-1.24788183e-03 9.03010117e-04 5.53960385e-04]] Final stress: [ 1.17690714e-05 -2.30673758e-06 2.16290270e-05 -1.83665563e-13 -8.41965878e-05 7.47615975e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.18901667e-11 -2.10058251e-03 -5.24888744e-11] [-5.16547803e-12 5.22211610e-04 -1.18726988e-10] [-6.46225101e-04 2.96049119e-04 -1.53503720e-03] [-2.92471000e-04 5.58179620e-04 5.89651691e-05] [-2.44779964e-04 1.63102671e-04 1.48660282e-03] [ 6.46225093e-04 2.96049436e-04 1.53503733e-03] [ 2.44780212e-04 1.63102821e-04 -1.48660293e-03] [ 2.92471182e-04 5.58179503e-04 -5.89650873e-05] [-1.18963635e-03 6.71736067e-04 -5.48213636e-04] [-1.23921324e-03 -8.99882140e-04 -5.50488358e-04] [ 1.23921309e-03 -8.99882367e-04 5.50488429e-04] [ 1.18963611e-03 6.71736173e-04 5.48213636e-04]] Final stress: [ 1.18168622e-05 -2.35586932e-06 2.15645409e-05 4.00362878e-13 8.40971401e-05 -6.89825806e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.46381196e-12 4.28620575e-03 1.42612458e-10] [ 9.82414535e-12 -9.95781529e-04 -1.55137419e-09] [ 7.68947399e-04 6.53138198e-05 2.94277989e-03] [ 1.24981787e-03 -1.45634729e-03 5.06547275e-06] [ 1.37806387e-04 -1.19057446e-04 -2.89884073e-03] [-7.68947410e-04 6.53138823e-05 -2.94277980e-03] [-1.37805994e-04 -1.19057239e-04 2.89884061e-03] [-1.24981855e-03 -1.45634691e-03 -5.06571589e-06] [ 1.35357325e-03 -1.44326907e-03 -3.08702342e-03] [ 1.83179495e-03 1.30814751e-03 -3.10161450e-03] [-1.83179473e-03 1.30814724e-03 3.10161612e-03] [-1.35357317e-03 -1.44326872e-03 3.08702348e-03]] Final stress: [-4.51597764e-05 -8.19378926e-06 5.35712964e-05 -2.54615284e-13 -1.80710981e-04 -1.37090112e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.39878591e-12 9.89009929e-04 -2.25898167e-10] [-9.89095346e-12 -4.25835007e-03 2.75189440e-09] [ 7.65391707e-04 -5.11444628e-05 -2.93132830e-03] [ 1.50834475e-04 1.30393285e-04 2.88984502e-03] [ 1.24576541e-03 1.44223915e-03 -7.80112304e-06] [-7.65391703e-04 -5.11453926e-05 2.93132789e-03] [-1.24576391e-03 1.44224000e-03 7.80042048e-06] [-1.50835691e-04 1.30393941e-04 -2.88984558e-03] [-1.80884847e-03 -1.30109549e-03 -3.06278766e-03] [-1.34757201e-03 1.41427734e-03 -3.04752626e-03] [ 1.34757196e-03 1.41427701e-03 3.04752445e-03] [ 1.80884824e-03 -1.30109524e-03 3.06278862e-03]] Final stress: [-4.48451736e-05 -7.69100347e-06 5.30444931e-05 2.28230849e-13 1.79965656e-04 -1.17983137e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.40720060e-03 -4.97028122e-05 -1.73852659e-07] [-3.40720061e-03 4.97028607e-05 1.73889521e-07] [ 1.11981231e-02 -1.26403639e-10 3.60572515e-11] [-2.50547596e-03 -4.81347855e-03 5.38296107e-03] [-2.50547594e-03 4.81347854e-03 -5.38296112e-03] [ 7.71438639e-03 6.59032671e-11 6.57997347e-12] [-6.72775755e-04 -7.94104969e-03 -5.26980439e-03] [-6.72775818e-04 7.94104964e-03 5.26980445e-03] [-1.48297839e-03 2.40327205e-03 -1.88889768e-03] [-1.38782406e-03 2.60649522e-03 -1.88862798e-03] [-1.48297833e-03 -2.40327211e-03 1.88889769e-03] [-1.38782406e-03 -2.60649510e-03 1.88862788e-03]] Final stress: [ 1.10222824e-04 1.02806844e-04 1.08085260e-04 -3.95053419e-04 -4.31401363e-14 -4.48090363e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.40797161e-03 -4.97275694e-05 1.73945744e-07] [ 3.40797161e-03 4.97275889e-05 -1.73933815e-07] [-7.72032655e-03 -2.70628764e-11 1.31589537e-11] [ 6.74460638e-04 7.94537454e-03 -5.27108422e-03] [ 6.74460692e-04 -7.94537454e-03 5.27108419e-03] [-1.12039283e-02 -9.45762890e-11 -1.11999178e-11] [ 2.50714262e-03 4.81787021e-03 5.38431323e-03] [ 2.50714269e-03 -4.81787024e-03 -5.38431315e-03] [ 1.38867207e-03 -2.60674002e-03 -1.88699703e-03] [ 1.48388041e-03 -2.40340366e-03 -1.88726710e-03] [ 1.38867200e-03 2.60674014e-03 1.88699700e-03] [ 1.48388046e-03 2.40340367e-03 1.88726706e-03]] Final stress: [ 1.10227603e-04 1.02807399e-04 1.08063671e-04 3.95179876e-04 1.86633817e-13 -9.06729965e-14] Minimization converged after 43 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.87921155e-12 3.45691263e-03 -4.56053993e-11] [ 8.39770055e-12 3.35750838e-03 -6.53832670e-12] [ 1.83599573e-03 5.27046149e-03 6.15006536e-03] [ 5.50464402e-03 -4.23964603e-03 -3.13219957e-03] [-7.24980957e-03 -7.30911912e-03 -3.01904146e-03] [-1.83599574e-03 5.27046147e-03 -6.15006536e-03] [ 7.24980948e-03 -7.30911915e-03 3.01904150e-03] [-5.50464414e-03 -4.23964594e-03 3.13219950e-03] [ 2.55257838e-03 1.53715462e-03 -1.88916317e-03] [ 2.45742582e-03 1.33393848e-03 -1.88827153e-03] [-2.45742571e-03 1.33393849e-03 1.88827151e-03] [-2.55257830e-03 1.53715468e-03 1.88916326e-03]] Final stress: [ 1.02807942e-04 1.10223861e-04 1.08084857e-04 -2.39211159e-13 -3.95050727e-04 7.68285226e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.24520082e-11 -3.35781629e-03 1.33797708e-11] [-1.95555000e-11 -3.45724246e-03 -4.93717389e-11] [ 1.83596869e-03 -5.27264035e-03 -6.15061705e-03] [-7.25187527e-03 7.31052648e-03 3.01930155e-03] [ 5.50675954e-03 4.24112202e-03 3.13249149e-03] [-1.83596870e-03 -5.27264036e-03 6.15061706e-03] [-5.50675952e-03 4.24112199e-03 -3.13249148e-03] [ 7.25187532e-03 7.31052644e-03 -3.01930147e-03] [-2.45734061e-03 -1.33410622e-03 -1.88763521e-03] [-2.55251781e-03 -1.53737252e-03 -1.88852715e-03] [ 2.55251781e-03 -1.53737248e-03 1.88852716e-03] [ 2.45734057e-03 -1.33410626e-03 1.88763515e-03]] Final stress: [1.02806862e-04 1.10224651e-04 1.08076243e-04 7.97870021e-14 3.95108509e-04 2.21728936e-13] Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.03926977e-03 1.04828067e-03 9.48652693e-09] [-1.05729156e-03 1.04828064e-03 -9.49095234e-09] [ 1.63309369e-04 8.32191955e-04 1.60980286e-03] [ 7.03486418e-04 -1.82894761e-03 5.97037079e-04] [-7.90570482e-04 9.05484265e-04 -2.20678191e-03] [ 1.60414623e-03 8.33638632e-04 -1.62780711e-03] [-2.43660194e-05 -5.66823563e-04 -5.88034927e-04] [-1.50355498e-03 -3.27994345e-04 2.21578401e-03] [ 1.84299641e-03 8.45904671e-04 -3.22278739e-03] [ 1.80800896e-03 8.60989988e-04 -3.22283710e-03] [-8.70940970e-04 -1.83304537e-03 3.22283005e-03] [-8.35953606e-04 -1.81795994e-03 3.22279445e-03]] Final stress: [-4.74057744e-05 -4.74057740e-05 4.55492468e-05 -1.02444766e-04 -1.02444766e-04 -5.96537314e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.05686129e-03 -1.04785541e-03 9.44266077e-09] [-1.03884954e-03 -1.04785543e-03 -9.51054601e-09] [ 1.64236318e-04 -8.32169169e-04 -1.60940301e-03] [-7.90807232e-04 -9.05016063e-04 2.20623189e-03] [ 7.03769709e-04 1.82942548e-03 -5.96886860e-04] [ 1.60447629e-03 -8.33620556e-04 1.62739833e-03] [-1.50349987e-03 3.27952539e-04 -2.21522954e-03] [-2.37776706e-05 5.67825228e-04 5.87889172e-04] [-8.70605243e-04 1.83131836e-03 -3.22040771e-03] [-8.35637125e-04 1.81623737e-03 -3.22037214e-03] [ 1.84126192e-03 -8.45580766e-04 3.22036513e-03] [ 1.80629374e-03 -8.60661593e-04 3.22041481e-03]] Final stress: [-4.73799074e-05 -4.73799069e-05 4.55174128e-05 -1.02425224e-04 1.02425224e-04 5.96250554e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.03929085e-03 1.04830200e-03 -9.49310103e-09] [ 1.05731314e-03 1.04830199e-03 9.49722566e-09] [-1.60413184e-03 8.33625425e-04 1.62783351e-03] [ 1.50354027e-03 -3.28005054e-04 -2.21581990e-03] [ 2.43856701e-05 -5.66780024e-04 5.88044388e-04] [-1.63271632e-04 8.32178909e-04 -1.60982881e-03] [ 7.90544486e-04 9.05493493e-04 2.20681756e-03] [-7.03478821e-04 -1.82892464e-03 -5.97046793e-04] [ 8.35977734e-04 -1.81802512e-03 -3.22292728e-03] [ 8.70966079e-04 -1.83311083e-03 -3.22296290e-03] [-1.80807377e-03 8.61014681e-04 3.22296996e-03] [-1.84306218e-03 8.45929170e-04 3.22292027e-03]] Final stress: [-4.74069155e-05 -4.74069148e-05 4.55511191e-05 1.02445805e-04 -1.02445805e-04 5.96552119e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.05694337e-03 -1.04793653e-03 -9.45415325e-09] [ 1.03892970e-03 -1.04793655e-03 9.52437851e-09] [-1.60441689e-03 -8.33602742e-04 -1.62748519e-03] [ 2.38751993e-05 5.67644118e-04 -5.87920187e-04] [ 1.50348445e-03 3.27973555e-04 2.21534742e-03] [-1.64072473e-04 -8.32152227e-04 1.60948815e-03] [-7.03725626e-04 1.82933618e-03 5.96918756e-04] [ 7.90740767e-04 -9.05084159e-04 -2.20634893e-03] [-1.80658890e-03 -8.60736472e-04 -3.22089436e-03] [-1.84156077e-03 -8.45654749e-04 -3.22084470e-03] [ 8.35709696e-04 1.81653384e-03 3.22085169e-03] [ 8.70681484e-04 1.83161574e-03 3.22088728e-03]] Final stress: [-4.73846222e-05 -4.73846216e-05 4.55238998e-05 1.02429044e-04 1.02429043e-04 -5.96306094e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 6.53799915e-03 -1.29982727e-04 -1.42613901e-06] [-9.66000873e-03 1.05620067e-04 3.24783459e-07] [ 2.82391881e-03 -3.49701532e-03 7.85613981e-03] [-1.87622556e-03 1.34471964e-04 7.22677022e-04] [ 1.29623047e-03 -2.33262465e-03 -8.74651945e-03] [-3.93102550e-04 3.69902953e-03 8.09019105e-03] [ 2.96436355e-03 -8.36122973e-04 -8.55825735e-03] [ 2.86950583e-04 2.89750049e-03 6.36554387e-04] [ 5.42762417e-03 3.17757389e-03 5.66133545e-03] [-6.43373618e-03 -4.48830441e-03 5.44671713e-03] [-6.69428502e-03 4.91358306e-03 -5.44559281e-03] [ 5.72027130e-03 -3.64372890e-03 -5.66214387e-03]] Final stress: [ 1.37456946e-04 1.21300136e-04 -8.44334715e-06 -5.78171102e-04 -8.33758692e-07 -2.04058880e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-9.65139586e-03 -1.05402113e-04 -3.22916772e-07] [ 6.53354430e-03 1.29707983e-04 1.42195800e-06] [ 2.82114565e-03 3.48933190e-03 -7.84658177e-03] [ 1.28692602e-03 2.32779448e-03 8.73443703e-03] [-1.87530779e-03 -1.29788941e-04 -7.20712011e-04] [-3.91919487e-04 -3.69050139e-03 -8.07997021e-03] [ 2.84329458e-04 -2.89849303e-03 -6.34586176e-04] [ 2.95306478e-03 8.36653672e-04 8.54663026e-03] [-6.67855589e-03 -4.90817577e-03 5.43844224e-03] [ 5.71435478e-03 3.64036862e-03 5.65479446e-03] [ 5.42248690e-03 -3.17520096e-03 -5.65398943e-03] [-6.41867285e-03 4.48370556e-03 -5.43956344e-03]] Final stress: [ 1.37278503e-04 1.21157007e-04 -8.43219170e-06 -5.77572044e-04 8.32135363e-07 2.03780824e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 9.64827499e-03 -1.05320508e-04 3.22448403e-07] [-6.53181640e-03 1.29605633e-04 -1.41888713e-06] [ 3.92363138e-04 -3.68742393e-03 8.07620713e-03] [-2.94931460e-03 8.37474909e-04 -8.54234200e-03] [-2.83550829e-04 -2.89923649e-03 6.33854809e-04] [-2.82061317e-03 3.48656841e-03 7.84306631e-03] [ 1.87545757e-03 -1.28870524e-04 7.19976178e-04] [-1.28322456e-03 2.32656877e-03 -8.72998030e-03] [ 6.41223660e-03 4.48163665e-03 5.43694114e-03] [-5.42005548e-03 -3.17482273e-03 5.65129111e-03] [-5.71163060e-03 3.63962232e-03 -5.65209641e-03] [ 6.67187333e-03 -4.90580251e-03 -5.43582152e-03]] Final stress: [ 1.37253183e-04 1.21144912e-04 -8.40941096e-06 5.77344034e-04 8.31494195e-07 -2.03670781e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-6.53409659e-03 -1.29744676e-04 1.42208490e-06] [ 9.65247654e-03 1.05431383e-04 -3.23211872e-07] [ 3.92055073e-04 3.69091893e-03 -8.08108023e-03] [-2.85384989e-04 2.89847581e-03 -6.35054571e-04] [-2.95445774e-03 -8.36714800e-04 8.54813762e-03] [-2.82186306e-03 -3.48964162e-03 -7.84760564e-03] [-1.28789370e-03 -2.32858988e-03 8.73600553e-03] [ 1.87488542e-03 1.30581051e-04 -7.21185891e-04] [-5.71533628e-03 -3.64088307e-03 5.65542008e-03] [ 6.68147555e-03 4.90951098e-03 5.43904103e-03] [ 6.42150622e-03 -4.48492897e-03 -5.44016261e-03] [-5.42336644e-03 3.17558488e-03 -5.65461419e-03]] Final stress: [ 1.37310738e-04 1.21184506e-04 -8.42340433e-06 5.77654480e-04 -8.32394820e-07 2.03817148e-04] Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 0.00810234 0.00169406 -0.00023545] [-0.00807804 0.00142351 0.00023673] [ 0.0018666 -0.00406623 0.01334071] [-0.00198183 -0.0006011 -0.00683072] [ 0.00029105 -0.00359209 -0.00651493] [-0.0019036 0.00311058 0.00258394] [ 0.00260769 -0.00138177 -0.00134252] [-0.00094488 0.00145315 -0.00123753] [ 0.00552632 0.00477088 0.00568284] [-0.00679345 -0.00380693 0.00541315] [-0.00530507 0.00431213 -0.00568624] [ 0.00661288 -0.00331619 -0.00540996]] Final stress: [ 1.21413009e-04 1.37098043e-04 -8.43824061e-06 -8.32218304e-07 -5.77577003e-04 -2.03773393e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-0.0081019 0.00169394 0.00023542] [ 0.0080776 0.00142343 -0.0002367 ] [ 0.00190354 0.00310891 -0.00258317] [ 0.00094404 0.00145294 0.00123716] [-0.00260683 -0.00138196 0.00134213] [-0.00186655 -0.00406442 -0.01333907] [-0.00029036 -0.00359149 0.00651414] [ 0.00198111 -0.00060053 0.00682986] [-0.00661136 -0.00331704 0.00540962] [ 0.00530451 0.00431262 0.00568585] [ 0.00679191 -0.00380769 -0.0054128 ] [-0.00552573 0.0047713 -0.00568244]] Final stress: [ 1.21411097e-04 1.37093551e-04 -8.43659656e-06 8.32115144e-07 -5.77525570e-04 2.03740730e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 0.00807386 -0.00142233 0.00023644] [-0.00809812 -0.00169252 -0.00023516] [ 0.00190193 -0.00311049 0.00258293] [-0.00260597 0.00137895 -0.00134195] [ 0.00094454 -0.00145371 -0.00123711] [-0.00186498 0.00405669 0.0133295 ] [ 0.00197622 0.0006012 -0.00682487] [-0.00028692 0.00358979 -0.00650955] [ 0.00678695 0.00380678 0.0054084 ] [-0.00552028 -0.00476462 0.00567774] [-0.00660653 0.00331672 -0.00540522] [ 0.0052993 -0.00430648 -0.00568113]] Final stress: [ 1.21319138e-04 1.36983641e-04 -8.42616687e-06 8.31200281e-07 5.77202992e-04 -2.03604405e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-0.00808722 -0.00142604 -0.00023739] [ 0.0081116 -0.00169739 0.00023611] [ 0.00186991 0.00408724 -0.01336562] [ 0.00029992 0.00359758 0.00652688] [-0.00199369 0.00060175 0.0068437 ] [-0.00190703 -0.00311085 -0.00258622] [-0.0009458 -0.00145171 0.0012385 ] [ 0.00261138 0.00138776 0.00134383] [-0.00531817 -0.00432466 0.00569701] [ 0.00662889 0.00331442 0.00541991] [ 0.00554001 -0.00478479 -0.00569358] [-0.0068098 0.00380669 -0.00542311]] Final stress: [ 1.21602536e-04 1.37333447e-04 -8.46331353e-06 -8.34527966e-07 5.78417288e-04 2.04159414e-04] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.21213065e-04 -1.63854808e-03 3.36014898e-06] [-9.21213063e-04 1.63854807e-03 -3.36026720e-06] [-9.16104629e-04 -4.27211220e-13 -1.79503696e-12] [-4.33113164e-04 -7.43784348e-04 4.17251178e-04] [-4.33113170e-04 7.43784353e-04 -4.17251168e-04] [ 2.16939163e-03 5.83999182e-11 2.29583965e-11] [-4.95001367e-04 -5.17529662e-04 -1.96345814e-03] [-4.95001282e-04 5.17529611e-04 1.96345817e-03] [ 5.39359353e-04 2.40365853e-03 -2.18240175e-03] [ 6.83324717e-04 9.46115848e-05 -2.17746779e-03] [ 5.39359347e-04 -2.40365854e-03 2.18240176e-03] [ 6.83324696e-04 -9.46115834e-05 2.17746782e-03]] Final stress: [-3.06315958e-05 -4.29967306e-05 3.08467382e-05 -9.40093864e-05 4.66110961e-14 3.75829288e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.21201092e-04 -1.63853736e-03 -3.36010421e-06] [ 9.21201096e-04 1.63853736e-03 3.36010924e-06] [-2.16942088e-03 -1.05144801e-11 -1.32828328e-12] [ 4.95002213e-04 5.17490649e-04 -1.96345195e-03] [ 4.95002181e-04 -5.17490631e-04 1.96345196e-03] [ 9.16135910e-04 -1.91396907e-12 -6.63677350e-14] [ 4.33225916e-04 7.43887809e-04 4.17189674e-04] [ 4.33225902e-04 -7.43887801e-04 -4.17189674e-04] [-6.83448762e-04 -9.45875645e-05 -2.17737238e-03] [-5.39337954e-04 -2.40363083e-03 -2.18230625e-03] [-6.83448775e-04 9.45875566e-05 2.17737238e-03] [-5.39337944e-04 2.40363082e-03 2.18230624e-03]] Final stress: [-3.06325175e-05 -4.29990272e-05 3.08442746e-05 9.40092276e-05 -2.24685576e-15 -3.33699456e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.40473446e-12 1.36216559e-03 5.41155368e-12] [-5.36753969e-12 -3.46223257e-04 -6.38998841e-10] [ 2.75186617e-04 -2.07843006e-04 9.61812646e-04] [ 1.25758264e-04 -4.60179394e-04 -8.15809358e-05] [ 1.56071342e-04 1.10852402e-04 -8.76994976e-04] [-2.75186623e-04 -2.07842940e-04 -9.61812607e-04] [-1.56071148e-04 1.10852515e-04 8.76994912e-04] [-1.25757984e-04 -4.60179555e-04 8.15810721e-05] [ 8.36664247e-04 -5.77818085e-04 -2.67651236e-04] [ 1.02709940e-03 6.27016956e-04 -2.67645335e-04] [-1.02709963e-03 6.27016895e-04 2.67645902e-04] [-8.36664476e-04 -5.77818124e-04 2.67651192e-04]] Final stress: [-3.78086122e-06 1.48151299e-06 1.33325877e-05 3.40860426e-13 -4.96269259e-05 -5.20503179e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.42684907e-12 3.46205598e-04 6.78298317e-10] [ 2.47202849e-12 -1.36237230e-03 -5.68148449e-10] [ 2.75390968e-04 2.07849486e-04 -9.61862033e-04] [ 1.55734026e-04 -1.10847646e-04 8.76918666e-04] [ 1.25162620e-04 4.59746930e-04 8.17077755e-05] [-2.75390969e-04 2.07849246e-04 9.61861951e-04] [-1.25161954e-04 4.59747307e-04 -8.17080611e-05] [-1.55734470e-04 -1.10847383e-04 -8.76918857e-04] [-1.02810525e-03 -6.27161210e-04 -2.67635825e-04] [-8.36916807e-04 5.78495611e-04 -2.67642534e-04] [ 8.36916737e-04 5.78495398e-04 2.67643346e-04] [ 1.02810510e-03 -6.27161039e-04 2.67635462e-04]] Final stress: [-3.75375622e-06 1.49597604e-06 1.33422251e-05 1.45836603e-13 4.96215464e-05 -8.31515017e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.23598407e-12 -7.08944059e-04 -4.21004266e-11] [-3.07426629e-12 2.55419375e-03 4.03654079e-11] [-1.53535740e-03 8.33204474e-04 1.37557773e-03] [ 6.63005332e-04 -3.83020912e-04 -1.46994738e-03] [-5.95428646e-04 -1.51420711e-04 8.90286621e-05] [ 1.53535740e-03 8.33204457e-04 -1.37557774e-03] [ 5.95428670e-04 -1.51420692e-04 -8.90286729e-05] [-6.63005343e-04 -3.83020914e-04 1.46994738e-03] [ 1.18395113e-03 5.59137217e-04 -2.17734349e-03] [ 1.31459161e-03 -1.78052490e-03 -2.18345560e-03] [-1.31459160e-03 -1.78052491e-03 2.18345558e-03] [-1.18395116e-03 5.59137208e-04 2.17734353e-03]] Final stress: [-3.11370700e-05 -4.24974857e-05 3.08539622e-05 3.12189079e-14 -9.40063006e-05 7.45888216e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.71833334e-12 -2.55365968e-03 4.80060461e-11] [-1.21118867e-13 7.08735693e-04 8.07363622e-11] [-1.53501792e-03 -8.33008055e-04 -1.37537009e-03] [-5.95324876e-04 1.51013352e-04 -8.90914285e-05] [ 6.62805164e-04 3.83297655e-04 1.46980292e-03] [ 1.53501791e-03 -8.33008118e-04 1.37537006e-03] [-6.62805099e-04 3.83297699e-04 -1.46980295e-03] [ 5.95324819e-04 1.51013381e-04 8.90914002e-05] [-1.31403462e-03 1.77992845e-03 -2.18342211e-03] [-1.18355413e-03 -5.58769409e-04 -2.17731404e-03] [ 1.18355413e-03 -5.58769417e-04 2.17731399e-03] [ 1.31403462e-03 1.77992845e-03 2.18342211e-03]] Final stress: [-3.11376652e-05 -4.25047870e-05 3.08513751e-05 2.19072016e-14 9.39977955e-05 -1.47804580e-14] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.21848198e-04 1.62987726e-03 -3.36462397e-06] [-9.21848201e-04 -1.62987726e-03 3.36494914e-06] [ 9.85398011e-04 9.74842982e-11 -3.79666545e-11] [ 9.16656955e-05 -1.53611233e-03 1.97119996e-03] [ 9.16658538e-05 1.53611222e-03 -1.97119999e-03] [ 2.75639050e-04 -7.40926678e-11 -4.40635161e-11] [-1.02022425e-03 2.73810298e-04 -4.12748434e-04] [-1.02022440e-03 -2.73810231e-04 4.12748375e-04] [ 6.75011753e-04 7.91744675e-05 -2.17643073e-03] [ 5.44876450e-04 2.41648546e-03 -2.18135530e-03] [ 6.75011746e-04 -7.91744722e-05 2.17643060e-03] [ 5.44876490e-04 -2.41648543e-03 2.18135529e-03]] Final stress: [-4.24692585e-05 -3.11071766e-05 3.08397766e-05 -9.39410035e-05 -8.37684896e-14 -1.19758052e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.21928334e-04 1.63013988e-03 3.36546258e-06] [ 9.21928333e-04 -1.63013988e-03 -3.36475601e-06] [-2.75515799e-04 4.24983238e-10 -1.75130335e-10] [ 1.02051876e-03 -2.73801402e-04 -4.12735172e-04] [ 1.02051947e-03 2.73801015e-04 4.12734887e-04] [-9.85970666e-04 1.51184685e-11 4.47967933e-12] [-9.15702331e-05 1.53658728e-03 1.97134261e-03] [-9.15702295e-05 -1.53658731e-03 -1.97134258e-03] [-5.44746220e-04 -2.41690012e-03 -2.18122061e-03] [-6.75387781e-04 -7.90696935e-05 -2.17629510e-03] [-5.44746210e-04 2.41690012e-03 2.18122014e-03] [-6.75387760e-04 7.90696744e-05 2.17629528e-03]] Final stress: [-4.24715078e-05 -3.11101475e-05 3.08362576e-05 9.39488146e-05 -5.36654988e-14 3.70024658e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.98286448e-12 -3.43550899e-04 3.39375205e-10] [ 7.38992826e-12 1.36029555e-03 -5.38355426e-10] [-5.12265887e-04 -2.01881755e-04 9.60018784e-04] [-3.79253501e-05 -9.99096868e-05 -8.80933158e-04] [-1.31251428e-06 -2.54277824e-04 -8.23288530e-05] [ 5.12265883e-04 -2.01881973e-04 -9.60018854e-04] [ 1.31262716e-06 -2.54277761e-04 8.23288220e-05] [ 3.79249800e-05 -9.99094619e-05 8.80933003e-04] [ 1.03019227e-03 6.31324892e-04 -2.67985864e-04] [ 8.34394633e-04 -5.83628024e-04 -2.67987070e-04] [-8.34394507e-04 -5.83628022e-04 2.67987708e-04] [-1.03019215e-03 6.31324965e-04 2.67985681e-04]] Final stress: [ 1.33503829e-06 -3.58540223e-06 1.33501725e-05 -2.47857365e-13 -4.96136997e-05 -1.55357031e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.39873155e-12 -1.36011472e-03 1.89077506e-11] [ 1.16612289e-11 3.43563468e-04 -4.56814437e-10] [-5.12665697e-04 2.02060232e-04 -9.60039709e-04] [-1.32562013e-06 2.54301577e-04 8.23155339e-05] [-3.78788727e-05 1.00352442e-04 8.80968455e-04] [ 5.12665707e-04 2.02060560e-04 9.60039843e-04] [ 3.78785783e-05 1.00352249e-04 -8.80968306e-04] [ 1.32531233e-06 2.54301745e-04 -8.23156530e-05] [-8.34067706e-04 5.82840043e-04 -2.67678973e-04] [-1.02946520e-03 -6.31278905e-04 -2.67678592e-04] [ 1.02946553e-03 -6.31278969e-04 2.67678962e-04] [ 8.34067942e-04 5.82840274e-04 2.67678877e-04]] Final stress: [ 1.32523684e-06 -3.60433926e-06 1.33379111e-05 -5.29991720e-13 4.96180684e-05 -6.02539641e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.35959119e-12 2.55827613e-03 2.10081385e-10] [-1.41567338e-11 -7.16822043e-04 2.40103604e-10] [ 3.63200292e-04 8.24002774e-04 1.37564057e-03] [ 1.19143014e-03 -1.16952582e-03 8.77484427e-05] [-7.43177394e-05 6.46420517e-04 -1.45809294e-03] [-3.63200298e-04 8.24002461e-04 -1.37564066e-03] [ 7.43180143e-05 6.46420660e-04 1.45809285e-03] [-1.19143036e-03 -1.16952567e-03 -8.77484786e-05] [ 1.32047011e-03 -1.76508294e-03 -2.18147590e-03] [ 1.17667370e-03 5.43458442e-04 -2.17534952e-03] [-1.17667371e-03 5.43458445e-04 2.17534935e-03] [-1.32047013e-03 -1.76508295e-03 2.18147583e-03]] Final stress: [-4.29535607e-05 -3.06003023e-05 3.08364091e-05 2.27821009e-14 -9.39580832e-05 7.75059508e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.50547091e-12 7.16942136e-04 2.68941319e-10] [ 3.88651165e-13 -2.55849019e-03 2.79120143e-10] [ 3.63451218e-04 -8.24172162e-04 -1.37570687e-03] [-7.44572789e-05 -6.46521653e-04 1.45815130e-03] [ 1.19159475e-03 1.16981387e-03 -8.77404194e-05] [-3.63451258e-04 -8.24172463e-04 1.37570677e-03] [-1.19159451e-03 1.16981403e-03 8.77402900e-05] [ 7.44570531e-05 -6.46521507e-04 -1.45815143e-03] [-1.17659135e-03 -5.43557553e-04 -2.17532498e-03] [-1.32064437e-03 1.76521156e-03 -2.18145333e-03] [ 1.32064441e-03 1.76521154e-03 2.18145320e-03] [ 1.17659134e-03 -5.43557593e-04 2.17532492e-03]] Final stress: [-4.29551619e-05 -3.06024426e-05 3.08351839e-05 1.53743963e-13 9.39635601e-05 1.99794169e-13] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.34330137e-03 -8.31895162e-06 -1.18852637e-08] [-1.34330136e-03 8.31895555e-06 1.19273941e-08] [ 8.12513826e-04 -3.80620393e-11 1.41836823e-11] [-3.39398856e-04 -1.99181960e-03 1.82621261e-03] [-3.39398847e-04 1.99181960e-03 -1.82621261e-03] [ 2.36144318e-03 -3.12409691e-11 -1.40026557e-11] [-1.09991746e-03 -6.71681753e-04 -1.81118003e-03] [-1.09991744e-03 6.71681745e-04 1.81118004e-03] [ 5.90831294e-04 1.40907633e-03 -2.75283622e-03] [ 6.04807901e-04 1.44128295e-03 -2.75282527e-03] [ 5.90831253e-04 -1.40907630e-03 2.75283621e-03] [ 6.04807881e-04 -1.44128291e-03 2.75282524e-03]] Final stress: [-4.79772061e-05 -4.90857060e-05 3.65388539e-05 -1.44343001e-04 1.41614485e-13 -3.56807616e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.34306017e-03 -8.31663972e-06 1.18936736e-08] [ 1.34306018e-03 8.31663850e-06 -1.19135891e-08] [-2.36141460e-03 1.20600020e-11 -6.08325236e-12] [ 1.09958771e-03 6.71953693e-04 -1.81099423e-03] [ 1.09958772e-03 -6.71953697e-04 1.81099423e-03] [-8.13042989e-04 1.46313669e-11 5.20998427e-12] [ 3.39346115e-04 1.99161583e-03 1.82602272e-03] [ 3.39346091e-04 -1.99161581e-03 -1.82602272e-03] [-6.04369994e-04 -1.44087739e-03 -2.75159767e-03] [-5.90395211e-04 -1.40867969e-03 -2.75160863e-03] [-6.04369991e-04 1.44087736e-03 2.75159767e-03] [-5.90395206e-04 1.40867969e-03 2.75160865e-03]] Final stress: [-4.79567933e-05 -4.90650267e-05 3.65262532e-05 1.44326717e-04 -3.86290212e-14 -4.21987762e-14] Minimization converged after 69 steps. Minimization converged after 67 steps. Minimization converged after 68 steps. Minimization converged after 69 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.45103179e-02 -5.79294070e-04 -1.29174872e-05] [-2.41096252e-02 4.51206619e-04 2.48068780e-06] [ 5.20890500e-03 -6.60602846e-03 1.69275067e-02] [-2.81079689e-03 -4.94594578e-04 2.55038029e-03] [ 3.54472681e-03 -4.71618704e-03 -2.02451759e-02] [ 7.75243921e-04 7.43647007e-03 1.79749609e-02] [ 5.85413084e-03 -8.23238077e-04 -1.93317991e-02] [ 1.72268058e-03 5.52816163e-03 2.13035391e-03] [ 6.41132431e-03 8.57837632e-03 1.82477222e-03] [-8.78288834e-03 -7.78083777e-03 7.28917595e-04] [-9.83822442e-03 9.66681730e-03 -7.18666372e-04] [ 7.51420545e-03 -1.06608519e-02 -1.83081337e-03]] Final stress: [ 2.16650581e-04 1.46462305e-04 1.62969543e-04 -1.20082331e-03 -3.48430395e-06 -4.00679621e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-2.41082921e-02 -4.51143808e-04 -2.46923376e-06] [ 1.45097378e-02 5.79208910e-04 1.29166310e-05] [ 5.20665900e-03 6.60605237e-03 -1.69265117e-02] [ 3.54296755e-03 4.71258271e-03 2.02427136e-02] [-2.81279660e-03 4.97047876e-04 -2.54906633e-03] [ 7.76564846e-04 -7.43623852e-03 -1.79737644e-02] [ 1.71843119e-03 -5.52743706e-03 -2.12907267e-03] [ 5.85061020e-03 8.23489703e-04 1.93294690e-02] [-9.83288932e-03 -9.66630181e-03 7.13799399e-04] [ 7.51470229e-03 1.06602618e-02 1.82587101e-03] [ 6.41204541e-03 -8.57809089e-03 -1.81983028e-03] [-8.77774022e-03 7.78056873e-03 -7.24054987e-04]] Final stress: [ 2.16517036e-04 1.46339657e-04 1.62984745e-04 -1.20074110e-03 3.48363432e-06 4.00639288e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 2.41236000e-02 -4.51353144e-04 2.47393430e-06] [-1.45178267e-02 5.79531004e-04 -1.29200178e-05] [-7.79964425e-04 -7.43549703e-03 1.79795776e-02] [-5.84429902e-03 8.20228523e-04 -1.93357086e-02] [-1.71866316e-03 -5.53256672e-03 2.12995363e-03] [-5.20619173e-03 6.60496182e-03 1.69317202e-02] [ 2.81183274e-03 5.04740995e-04 2.55016962e-03] [-3.53867084e-03 4.71330784e-03 -2.02494847e-02] [ 8.76270198e-03 7.77481168e-03 7.09214518e-04] [-6.40393692e-03 -8.58400449e-03 1.80596624e-03] [-7.50701388e-03 1.06673609e-02 -1.81201248e-03] [ 9.81843204e-03 -9.66152142e-03 -6.98949976e-04]] Final stress: [ 2.16393713e-04 1.46179016e-04 1.63225160e-04 1.20102961e-03 3.48554347e-06 -4.00641727e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.45016843e-02 -5.78300475e-04 1.28870755e-05] [ 2.40890032e-02 4.50482730e-04 -2.45547028e-06] [-7.76172232e-04 7.42239043e-03 -1.79557797e-02] [-1.70769576e-03 5.52692655e-03 -2.12380162e-03] [-5.83099172e-03 -8.28702483e-04 1.93077477e-02] [-5.20101663e-03 -6.59434860e-03 -1.69105185e-02] [-3.52584831e-03 -4.70011221e-03 2.02195093e-02] [ 2.81664700e-03 -5.02496233e-04 -2.54338054e-03] [-7.51409900e-03 -1.06544754e-02 1.82237228e-03] [ 9.80931478e-03 9.66264712e-03 7.11652817e-04] [ 8.75595860e-03 -7.77960928e-03 -7.21888496e-04] [-6.41341563e-03 8.57559780e-03 -1.81634487e-03]] Final stress: [ 2.16234865e-04 1.46168741e-04 1.62794032e-04 1.19984758e-03 -3.47861052e-06 4.00226199e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.87764906e-13 1.35180766e-03 5.32415209e-11] [-6.84717748e-12 1.33516619e-03 4.35606143e-11] [-7.57759034e-04 1.48873013e-03 2.10016567e-03] [ 1.71760496e-03 -1.48476518e-03 -1.05763700e-03] [-9.45898348e-04 -1.51008187e-04 -1.04260130e-03] [ 7.57759038e-04 1.48873012e-03 -2.10016568e-03] [ 9.45898376e-04 -1.51008166e-04 1.04260129e-03] [-1.71760485e-03 -1.48476525e-03 1.05763705e-03] [ 1.43249561e-03 -5.82115147e-04 -2.75377947e-03] [ 1.41851761e-03 -6.14328485e-04 -2.75372578e-03] [-1.41851768e-03 -6.14328489e-04 2.75372571e-03] [-1.43249567e-03 -5.82115199e-04 2.75377940e-03]] Final stress: [-4.91024248e-05 -4.79937217e-05 3.65477679e-05 1.54884475e-13 -1.44355478e-04 8.95078649e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.82448571e-12 -1.33488126e-03 1.88338287e-11] [-7.39004301e-13 -1.35151715e-03 2.44524700e-11] [-7.57388161e-04 -1.48832409e-03 -2.09998548e-03] [-9.46063708e-04 1.51703088e-04 1.04251356e-03] [ 1.71739713e-03 1.48480896e-03 1.05754452e-03] [ 7.57388165e-04 -1.48832409e-03 2.09998549e-03] [-1.71739716e-03 1.48480893e-03 -1.05754451e-03] [ 9.46063696e-04 1.51703095e-04 -1.04251357e-03] [-1.41798575e-03 6.13606967e-04 -2.75232822e-03] [-1.43196160e-03 5.81404280e-04 -2.75238185e-03] [ 1.43196163e-03 5.81404303e-04 2.75238182e-03] [ 1.41798576e-03 6.13606966e-04 2.75232820e-03]] Final stress: [-4.90753736e-05 -4.79669845e-05 3.65350395e-05 -5.24526593e-14 1.44336207e-04 7.19250505e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 0.01935324 0.00540039 -0.00102723] [-0.01922513 0.00420209 0.00103925] [ 0.00330608 -0.00879964 0.03022603] [-0.0033477 -0.00275643 -0.0158282 ] [ 0.0008335 -0.00757712 -0.01444263] [-0.00354095 0.00524604 0.00468511] [ 0.00436945 -0.00223939 -0.00255423] [-0.00194494 0.00182636 -0.00209419] [ 0.00912294 0.01137931 0.00187695] [-0.00812644 -0.00905434 0.00066057] [-0.00808916 0.00933146 -0.0019092 ] [ 0.00728913 -0.00695873 -0.00063222]] Final stress: [ 1.46620183e-04 2.16472327e-04 1.63164770e-04 -3.48757598e-06 -1.20144876e-03 -4.00921451e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-0.01935817 0.00540176 0.0010274 ] [ 0.01923002 0.00420324 -0.0010394 ] [ 0.00353929 0.00524868 -0.00468607] [ 0.00194583 0.00182743 0.00209463] [-0.00436846 -0.00223501 0.00255474] [-0.00330433 -0.00879532 -0.03022893] [-0.00083023 -0.00757857 0.01444395] [ 0.00334255 -0.00276089 0.01582978] [-0.00728275 -0.00695974 0.00062413] [ 0.00808586 0.00932793 0.00190135] [ 0.00812023 -0.00905567 -0.00065249] [-0.00911984 0.01137616 -0.0018691 ]] Final stress: [ 1.46481210e-04 2.16345663e-04 1.63262052e-04 3.48834362e-06 -1.20155245e-03 4.00917235e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 0.01922296 -0.00420072 0.00103857] [-0.01935098 -0.00539824 -0.00102657] [ 0.00353842 -0.00524695 0.00468434] [-0.00436663 0.00223366 -0.00255371] [ 0.00194398 -0.00182902 -0.002094 ] [-0.00330369 0.00877975 0.030211 ] [ 0.00333604 0.00275658 -0.01582014] [-0.00082388 0.00757402 -0.01443561] [ 0.00811333 0.00905832 0.00065553] [-0.00911333 -0.01136906 0.00187108] [-0.00727639 0.00696422 -0.00062723] [ 0.00808017 -0.00932255 -0.00190329]] Final stress: [ 1.46500269e-04 2.16306557e-04 1.63139233e-04 3.48583211e-06 1.20106131e-03 -4.00678146e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-0.01922865 -0.00420327 -0.0010394 ] [ 0.0193568 -0.00540176 0.00102739] [ 0.00330425 0.0087977 -0.03022879] [ 0.00083376 0.00757478 0.01444392] [-0.00334602 0.00275728 0.01582966] [-0.0035392 -0.00525023 -0.00468661] [-0.00194765 -0.00182587 0.0020949 ] [ 0.00437021 0.00223651 0.00255501] [-0.00808624 -0.00932895 0.00190019] [ 0.00728164 0.00696252 0.00062299] [ 0.0091202 -0.01137712 -0.00186794] [-0.00811909 0.00905839 -0.00065134]] Final stress: [ 1.46473955e-04 2.16336565e-04 1.63276438e-04 -3.48778393e-06 1.20152800e-03 4.00915078e-04] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.86305926e-02 -1.02391970e-03 -1.58360452e-05] [-1.86305924e-02 1.02391944e-03 1.58494401e-05] [ 5.07625388e-02 5.89718547e-10 -5.17260689e-10] [-1.10443951e-02 -2.22137237e-02 2.74486724e-02] [-1.10443935e-02 2.22137232e-02 -2.74486736e-02] [ 3.71065209e-02 1.26846420e-09 5.00852922e-10] [-2.38442567e-03 -3.63159126e-02 -2.50918952e-02] [-2.38442987e-03 3.63159149e-02 2.50918930e-02] [-6.91874510e-03 2.00469434e-02 -2.68859726e-02] [-4.95637042e-03 2.42876907e-02 -2.68650667e-02] [-6.91874427e-03 -2.00469466e-02 2.68859678e-02] [-4.95637072e-03 -2.42876908e-02 2.68650616e-02]] Final stress: [ 4.54229025e-04 2.99181415e-04 8.84935088e-04 -1.73993355e-03 -4.08555702e-12 -6.53984341e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.86300325e-02 -1.02404841e-03 1.58442189e-05] [ 1.86300327e-02 1.02404845e-03 -1.58481463e-05] [-3.71270653e-02 2.65571546e-09 -1.08217532e-09] [ 2.38963790e-03 3.63243602e-02 -2.50927903e-02] [ 2.38964749e-03 -3.63243655e-02 2.50927859e-02] [-5.07754432e-02 4.20193007e-09 1.82478251e-09] [ 1.10461312e-02 2.22286070e-02 2.74501628e-02] [ 1.10461330e-02 -2.22286085e-02 -2.74501613e-02] [ 4.96134338e-03 -2.42788446e-02 -2.68569711e-02] [ 6.92410364e-03 -2.00373750e-02 -2.68778850e-02] [ 4.96134399e-03 2.42788421e-02 2.68569699e-02] [ 6.92410265e-03 2.00373775e-02 2.68778924e-02]] Final stress: [ 4.54047651e-04 2.98970984e-04 8.84740492e-04 1.74020250e-03 -6.80033226e-13 -1.08843372e-11] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.35141529e-10 1.96542163e-02 9.57857262e-10] [ 9.65536726e-11 1.76067883e-02 1.47750104e-09] [ 8.75106473e-03 2.35869181e-02 3.02965056e-02] [ 2.58179284e-02 -2.06041524e-02 -1.63829855e-02] [-3.27372470e-02 -3.34863935e-02 -1.40253820e-02] [-8.75106483e-03 2.35869169e-02 -3.02965065e-02] [ 3.27372432e-02 -3.34863955e-02 1.40253832e-02] [-2.58179262e-02 -2.06041537e-02 1.63829858e-02] [ 2.31472251e-02 8.05573257e-03 -2.69194705e-02] [ 2.11851675e-02 3.81739503e-03 -2.68351869e-02] [-2.11851673e-02 3.81739747e-03 2.68351854e-02] [-2.31472239e-02 8.05573052e-03 2.69194691e-02]] Final stress: [ 2.99102713e-04 4.54145608e-04 8.84933319e-04 -1.11808978e-12 -1.73995926e-03 9.74241797e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.32158804e-10 -1.76063612e-02 -8.05329320e-11] [ 1.69320030e-10 -1.96539937e-02 -1.30006592e-08] [ 8.75020591e-03 -2.35907724e-02 -3.02992701e-02] [-3.27444180e-02 3.34950879e-02 1.40265263e-02] [ 2.58261968e-02 2.06144821e-02 1.63846348e-02] [-8.75020592e-03 -2.35907703e-02 3.02992713e-02] [-2.58262015e-02 2.06144793e-02 -1.63846322e-02] [ 3.27444180e-02 3.34950877e-02 -1.40265260e-02] [-2.11785486e-02 -3.82485158e-03 -2.68235092e-02] [-2.31408885e-02 -8.06376865e-03 -2.69078089e-02] [ 2.31408908e-02 -8.06376754e-03 2.69078198e-02] [ 2.11785507e-02 -3.82485162e-03 2.68235073e-02]] Final stress: [ 2.99071993e-04 4.54138819e-04 8.84748075e-04 -2.31242646e-12 1.74016459e-03 2.35184014e-12] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.92659 -0.00206 0.296 0.00011 -0.00141 -0.00002] [ -0.00206 0.92665 0.29822 0.00059 -0.00174 0.00026] [ 0.296 0.29822 2.25773 0.00138 -0.00003 -0.00016] [ 0.00011 0.00059 0.00138 -274.28743 -0.00022 -0.00003] [ -0.00141 -0.00174 -0.00003 -0.00022 -274.28642 -0.00007] [ -0.00002 0.00026 -0.00016 -0.00003 -0.00007 0.4698 ]] 95%% Error estimate [ASE units]: [[ 0.00406 0.01163 0.00307 0.00077 0.00612 0.00021] [ 0.01163 0.00457 0.00929 0.00255 0.00499 0.00028] [ 0.00307 0.00929 0.0001 0.00469 0.00306 0.00026] [ 0.00077 0.00255 0.00469 34073.49763 0.00093 0.00004] [ 0.00612 0.00499 0.00306 0.00093 34073.40384 0.05091] [ 0.00021 0.00028 0.00026 0.00004 0.05091 0.04066]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 17036.748813 is too big compared to maximum elastic constant component 274.287425 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.005477 Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 3 steps. Minimization converged after 19 steps. Minimization converged after 22 steps. Minimization converged after 3 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 29 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 59 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 58 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 27 steps. Minimization converged after 25 steps. Minimization converged after 3 steps. Minimization converged after 20 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.08595258e-09 -5.04789300e-03 4.81492584e-08] [-2.08710871e-09 5.04789311e-03 -7.71555798e-08] [ 3.07169949e-02 5.01718633e-09 -2.03544662e-09] [ 7.62726270e-03 3.40114523e-02 3.10685878e-03] [ 7.62730416e-03 -3.40114760e-02 -3.10687723e-03] [-3.07169957e-02 2.18439649e-08 9.36516008e-09] [-7.62726470e-03 -3.40114540e-02 3.10686163e-03] [-7.62725096e-03 3.40114457e-02 -3.10685333e-03] [ 2.10694238e-02 8.31698665e-03 1.07931966e-01] [-2.10694465e-02 -8.31697806e-03 1.07932045e-01] [ 2.10694273e-02 -8.31699973e-03 -1.07931970e-01] [-2.10694510e-02 8.31699617e-03 -1.07932009e-01]] Final stress: [ 2.49158949e-03 1.72239296e-03 -1.39020395e-04 5.46469224e-11 -5.36059346e-12 -6.29757536e-11] Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.49172682e-10 1.30420443e-02 -6.17362095e-09] [-7.85449129e-10 -1.30420441e-02 4.97878994e-08] [-3.22895452e-03 -7.38218597e-10 1.01406994e-10] [-1.71648341e-03 5.81918707e-03 -7.48713010e-03] [-1.71648054e-03 -5.81918875e-03 7.48712846e-03] [ 3.22895463e-03 -1.85679954e-08 -7.79480949e-09] [ 1.71650126e-03 -5.81917644e-03 -7.48713848e-03] [ 1.71647626e-03 5.81919100e-03 7.48712600e-03] [ 2.20083255e-03 -5.81356244e-04 3.98269012e-04] [-2.20083808e-03 5.81360913e-04 3.98232828e-04] [ 2.20083163e-03 5.81360201e-04 -3.98270120e-04] [-2.20083875e-03 -5.81358648e-04 -3.98253521e-04]] Final stress: [4.07648165e-04 9.27817184e-04 1.84614305e-03 1.15830927e-11 3.62181330e-12 3.20383084e-12] Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.29953006e-10 -1.55585936e-02 -1.63777618e-08] [-2.93497615e-10 1.55585927e-02 -4.11245743e-08] [ 7.89553274e-03 9.27059474e-09 -3.62003194e-09] [-1.44813258e-03 2.47260993e-04 8.71837819e-03] [-1.44814727e-03 -2.47253025e-04 -8.71837205e-03] [-7.89553259e-03 3.69366930e-08 1.50643106e-08] [ 1.44810459e-03 -2.47277650e-04 8.71839171e-03] [ 1.44815679e-03 2.47247439e-04 -8.71836679e-03] [-3.99128101e-03 -1.59543922e-03 4.45809330e-04] [ 3.99128721e-03 1.59542541e-03 4.45840491e-04] [-3.99127946e-03 1.59543289e-03 -4.45821423e-04] [ 3.99129123e-03 -1.59544219e-03 -4.45813408e-04]] Final stress: [ 1.09567864e-03 2.90340289e-04 1.87678413e-03 -1.52269412e-11 -2.20475852e-11 2.06680916e-11] Minimization converged after 24 steps. Minimization converged after 22 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.47185178e-10 6.13538590e-02 6.06541462e-09] [-2.67045924e-09 -6.13538587e-02 8.75649900e-08] [-2.80689191e-02 1.74282817e-08 -7.69674249e-09] [-2.07208261e-02 3.08023001e-02 -4.03639633e-02] [-2.07207862e-02 -3.08023235e-02 4.03639435e-02] [ 2.80689197e-02 -1.51843844e-08 -6.62310787e-09] [ 2.07208159e-02 -3.08023058e-02 -4.03639584e-02] [ 2.07207895e-02 3.08023215e-02 4.03639449e-02] [ 1.03321065e-03 -3.61681655e-02 -4.59512129e-02] [-1.03320581e-03 3.61681671e-02 -4.59512472e-02] [ 1.03321114e-03 3.61681654e-02 4.59511860e-02] [-1.03320747e-03 -3.61681618e-02 4.59512281e-02]] Final stress: [-1.63299701e-04 1.24602126e-03 1.26349767e-03 1.01181478e-12 7.52646445e-12 -1.41421138e-11] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.29221596e-08 4.26070052e-02 -1.30300513e-07] [ 5.62127195e-08 -4.26070100e-02 -7.98775391e-07] [ 1.88600890e-01 -9.97383427e-08 4.21246676e-08] [-1.06679760e-01 1.59301987e-01 7.92737056e-03] [-1.06680001e-01 -1.59301845e-01 -7.92724719e-03] [-1.88600902e-01 2.89737374e-07 1.17795403e-07] [ 1.06679778e-01 -1.59301974e-01 7.92734623e-03] [ 1.06680095e-01 1.59301781e-01 -7.92718119e-03] [ 2.19197746e-03 6.19895199e-02 5.27521545e-01] [-2.19206979e-03 -6.19895720e-02 5.27521927e-01] [ 2.19200559e-03 -6.19896254e-02 -5.27521368e-01] [-2.19205728e-03 6.19895430e-02 -5.27521624e-01]] Final stress: [ 1.76488876e-02 1.71828607e-02 1.57277997e-02 -1.33228260e-10 -6.97207982e-11 -1.41878618e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-8.39597836e-12 -1.65453655e-03 3.09522348e-08] [-4.84441931e-10 1.65453744e-03 -7.10938799e-08] [ 1.21624396e-02 1.41278744e-09 -4.26443103e-10] [-7.01555413e-03 1.21035118e-02 -1.58976453e-03] [-7.01553134e-03 -1.21035247e-02 1.58975477e-03] [-1.21624394e-02 3.81851550e-09 2.43663669e-09] [ 7.01551843e-03 -1.21035327e-02 -1.58974776e-03] [ 7.01555112e-03 1.21035145e-02 1.58976394e-03] [-3.16335542e-03 -3.38954709e-03 5.85783854e-02] [ 3.16336712e-03 3.38955713e-03 5.85784485e-02] [-3.16335950e-03 3.38956101e-03 -5.85783847e-02] [ 3.16336405e-03 -3.38954611e-03 -5.85784175e-02]] Final stress: [ 1.25532190e-03 7.90768840e-04 -3.80407042e-04 -1.28146729e-11 1.87840817e-11 4.95210722e-12] Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.83303825e-10 2.19536166e-02 -9.03224584e-09] [-2.74762636e-10 -2.19536164e-02 6.48909666e-09] [-6.84372130e-03 6.45180109e-09 -2.54841107e-09] [-3.40497457e-03 1.50366040e-02 -1.40313925e-02] [-3.40496133e-03 -1.50366116e-02 1.40313865e-02] [ 6.84372127e-03 1.66316186e-09 9.10229749e-10] [ 3.40496901e-03 -1.50366070e-02 -1.40313897e-02] [ 3.40497566e-03 1.50366032e-02 1.40313931e-02] [ 3.11308799e-03 -1.15918643e-02 5.94801470e-03] [-3.11309175e-03 1.15918669e-02 5.94801410e-03] [ 3.11308753e-03 1.15918663e-02 -5.94801811e-03] [-3.11309194e-03 -1.15918658e-02 -5.94800395e-03]] Final stress: [2.47504088e-04 1.39821903e-03 1.55323902e-03 7.03096392e-12 4.89936037e-12 2.09580917e-12] Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.10980255 -0.04980442 0.0110848 ] [-0.10980255 0.04980441 0.01108461] [ 0.2149779 -0.05504338 -0.1089401 ] [-0.08173202 0.18920426 0.11857007] [ 0.09766496 -0.04894072 -0.03139083] [-0.2149779 0.05504339 -0.1089401 ] [ 0.081732 -0.18920427 0.11857007] [-0.09766489 0.04894068 -0.0313908 ] [-0.064276 0.02103397 -0.04080933] [ 0.06427599 -0.02103394 -0.04080922] [ 0.1990284 -0.10825195 0.05148544] [-0.19902843 0.10825196 0.05148538]] Final stress: [ 8.70825705e-03 1.15902300e-02 1.63042596e-02 4.21948896e-11 -9.21476751e-13 -3.61714853e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.10981024 -0.04980806 -0.01108467] [ 0.10981025 0.04980805 -0.01108456] [ 0.21498017 0.05505761 0.10892633] [ 0.09767652 0.04892144 0.03139161] [-0.08174638 -0.18920055 -0.11855693] [-0.21498016 -0.05505765 0.10892631] [-0.09767647 -0.04892141 0.03139158] [ 0.08174632 0.18920058 -0.11855696] [ 0.19904653 0.10824771 -0.05150206] [-0.19904653 -0.10824772 -0.05150215] [-0.06428418 -0.02105174 0.04082574] [ 0.06428419 0.02105173 0.04082576]] Final stress: [ 8.70796682e-03 1.15899105e-02 1.63044868e-02 -6.11508234e-11 -9.18745065e-12 3.62096177e-05] Minimization converged after 25 steps. Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.74694054e-10 -2.80434759e-02 1.20788960e-08] [ 2.26438868e-11 2.80434753e-02 1.17990589e-08] [ 1.62066322e-02 6.43432652e-09 -2.43976064e-09] [-5.08028719e-03 2.59419943e-03 1.68972917e-02] [-5.08029446e-03 -2.59419542e-03 -1.68972886e-02] [-1.62066323e-02 -7.73475595e-09 -3.41139485e-09] [ 5.08030785e-03 -2.59418761e-03 1.68972822e-02] [ 5.08028390e-03 2.59420129e-03 -1.68972937e-02] [-8.95610854e-03 3.20135450e-03 5.75924813e-03] [ 8.95610168e-03 -3.20136126e-03 5.75924019e-03] [-8.95610708e-03 -3.20136031e-03 -5.75924485e-03] [ 8.95610432e-03 3.20135119e-03 -5.75925322e-03]] Final stress: [ 1.81926497e-03 -4.95474004e-05 1.63197875e-03 8.87355877e-12 -9.53274603e-12 8.86595811e-12] Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 25 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.11293973 0.01967076 0.06195653] [-0.11293973 -0.01967076 0.06195652] [ 0.07616524 0.04382065 -0.12362061] [-0.0620646 0.01323917 0.00455582] [ 0.06964283 0.03156728 0.04166104] [-0.07616524 -0.04382065 -0.12362061] [ 0.0620646 -0.01323917 0.00455582] [-0.06964283 -0.03156728 0.04166104] [ 0.02835804 0.02167957 -0.0425936 ] [-0.02835804 -0.02167957 -0.0425936 ] [ 0.0222135 -0.10637989 0.05804082] [-0.0222135 0.10637989 0.05804082]] Final stress: [-5.79879748e-04 4.17482497e-03 7.16826198e-03 7.15399074e-13 -4.54794631e-13 -2.77068935e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.11294294 0.01967256 -0.06195328] [ 0.11294294 -0.01967256 -0.0619533 ] [ 0.07617547 -0.04380827 0.12362739] [ 0.06963124 -0.03157847 -0.04167221] [-0.06208786 -0.01324245 -0.00455401] [-0.07617547 0.04380826 0.12362739] [-0.06963123 0.03157847 -0.04167221] [ 0.06208785 0.01324245 -0.00455402] [ 0.02221062 0.10638991 -0.05803336] [-0.02221062 -0.10638991 -0.05803336] [ 0.02833569 -0.02168175 0.04258549] [-0.02833569 0.02168175 0.04258548]] Final stress: [-5.79375437e-04 4.17528975e-03 7.16857953e-03 -8.56289263e-12 2.54835998e-12 2.77068875e-03] Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.41356433e-02 -2.50507154e-04 3.69515373e-01] [ 1.41356432e-02 2.50506169e-04 3.69515359e-01] [ 1.88706063e-01 3.28377670e-01 -1.37983673e-01] [-3.62348979e-01 1.56203721e-02 -1.48126318e-01] [ 1.73770801e-01 -3.26194728e-01 -1.13739298e-01] [-1.88706063e-01 -3.28377673e-01 -1.37983675e-01] [ 3.62348982e-01 -1.56203695e-02 -1.48126320e-01] [-1.73770803e-01 3.26194730e-01 -1.13739299e-01] [-2.58057362e-02 -2.52867298e-02 1.64510551e-01] [ 2.58057361e-02 2.52867294e-02 1.64510554e-01] [-2.18145902e-02 -1.94980532e-02 -1.34176623e-01] [ 2.18145884e-02 1.94980533e-02 -1.34176632e-01]] Final stress: [ 1.13906633e-02 1.66086074e-02 1.39512279e-02 4.26952796e-12 1.22072876e-12 -1.84336488e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 1.41380570e-02 -2.50382481e-04 -3.69513126e-01] [-1.41380569e-02 2.50383155e-04 -3.69513132e-01] [ 1.88706366e-01 -3.28376434e-01 1.37977218e-01] [ 1.73769988e-01 3.26197603e-01 1.13742593e-01] [-3.62343636e-01 -1.56226815e-02 1.48127386e-01] [-1.88706367e-01 3.28376436e-01 1.37977219e-01] [-1.73769995e-01 -3.26197607e-01 1.13742597e-01] [ 3.62343640e-01 1.56226795e-02 1.48127388e-01] [-2.18135770e-02 1.94935542e-02 1.34176171e-01] [ 2.18135799e-02 -1.94935528e-02 1.34176178e-01] [-2.58020505e-02 2.52855180e-02 -1.64510246e-01] [ 2.58020515e-02 -2.52855169e-02 -1.64510246e-01]] Final stress: [1.13907087e-02 1.66087164e-02 1.39513376e-02 3.89771404e-12 7.65352355e-12 1.84337285e-03] Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.45588142e-09 2.93410970e-02 -7.49382723e-08] [ 1.72980283e-07 -2.93411131e-02 -2.50950350e-06] [ 2.37140253e-01 -7.63735318e-07 3.17215964e-07] [ 4.96649125e-02 2.64012500e-01 7.35251116e-02] [ 4.96630592e-02 -2.64011423e-01 -7.35242105e-02] [-2.37140294e-01 3.25530993e-07 1.25318679e-07] [-4.96643954e-02 -2.64012196e-01 7.35247807e-02] [-4.96641571e-02 2.64012044e-01 -7.35246500e-02] [ 1.81223555e-01 1.07617386e-01 4.21694374e-01] [-1.81223381e-01 -1.07617681e-01 4.21695035e-01] [ 1.81223600e-01 -1.07617584e-01 -4.21693308e-01] [-1.81223326e-01 1.07617409e-01 -4.21694990e-01]] Final stress: [ 1.60292444e-02 2.01427100e-02 1.57071541e-02 -8.80471206e-10 -1.54035395e-09 1.82701698e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.37138806e-11 -4.11512143e-03 4.06555856e-09] [-1.89169419e-09 4.11512274e-03 -1.75964151e-07] [ 1.37889053e-02 -4.94320618e-08 2.15774933e-08] [ 8.77881738e-03 1.76865102e-02 4.48234566e-03] [ 8.77875034e-03 -1.76864715e-02 -4.48231070e-03] [-1.37889058e-02 -1.66422622e-08 -5.01934052e-09] [-8.77878931e-03 -1.76864945e-02 4.48233221e-03] [-8.77877007e-03 1.76864840e-02 -4.48232123e-03] [ 1.42220190e-02 6.10717627e-03 3.72771714e-02] [-1.42220179e-02 -6.10715714e-03 3.72772297e-02] [ 1.42220131e-02 -6.10714976e-03 -3.72770903e-02] [-1.42220203e-02 6.10716719e-03 -3.72772015e-02]] Final stress: [ 8.84740316e-04 8.21570426e-04 -1.31457351e-04 1.06654782e-11 3.22842487e-11 3.20877323e-11] Minimization converged after 3 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.10176516 -0.04724797 0.00169178] [-0.10176516 0.04724797 0.00169172] [ 0.12016189 -0.0062565 -0.07573402] [-0.04914067 0.10501453 0.07171184] [ 0.02707752 0.00831021 -0.00038029] [-0.12016189 0.0062565 -0.07573402] [ 0.04914065 -0.10501454 0.07171184] [-0.02707752 -0.00831021 -0.00038029] [-0.04114134 0.01320909 -0.01176339] [ 0.04114135 -0.01320909 -0.01176335] [ 0.06130647 -0.05104875 0.01447411] [-0.06130647 0.05104876 0.01447408]] Final stress: [ 5.00423835e-03 5.06212574e-03 7.93731050e-03 -1.05232709e-11 -6.00252695e-12 -9.68607095e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.10177003 -0.04725046 -0.00169175] [ 0.10177003 0.04725046 -0.00169175] [ 0.12015361 0.00625074 0.07573072] [ 0.02707109 -0.00829958 0.00038043] [-0.04913106 -0.1050091 -0.07170871] [-0.12015361 -0.00625072 0.07573073] [-0.0270711 0.00829957 0.00038044] [ 0.04913107 0.1050091 -0.07170871] [ 0.06130269 0.05105178 -0.01447119] [-0.06130269 -0.05105179 -0.01447118] [-0.04114152 -0.01320415 0.01176048] [ 0.04114153 0.01320415 0.01176049]] Final stress: [ 5.00414474e-03 5.06200500e-03 7.93720730e-03 1.46574854e-11 -1.63519725e-11 9.68635200e-04] Minimization converged after 28 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-4.99993380e-11 9.06049158e-02 2.15887885e-09] [ 1.77307679e-09 -9.06049156e-02 -2.50817766e-08] [-1.09459048e-01 -8.38881165e-09 3.37015765e-09] [-8.78319610e-02 1.43569451e-01 -8.19547696e-02] [-8.78319683e-02 -1.43569447e-01 8.19547733e-02] [ 1.09459048e-01 8.46495501e-09 3.35409538e-09] [ 8.78319588e-02 -1.43569452e-01 -8.19547689e-02] [ 8.78319721e-02 1.43569444e-01 8.19547751e-02] [-5.37948346e-02 -1.78297142e-01 -6.64969437e-02] [ 5.37948335e-02 1.78297144e-01 -6.64969297e-02] [-5.37948345e-02 1.78297141e-01 6.64969457e-02] [ 5.37948326e-02 -1.78297140e-01 6.64969340e-02]] Final stress: [ 6.42514188e-03 5.12672224e-03 1.22661959e-02 -2.49285549e-12 5.76029249e-12 -9.52381092e-12] Minimization converged after 24 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 45 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 0.02737658 0.00136097 -0.0021587 ] [-0.02737658 -0.00136097 -0.0021587 ] [-0.01085063 -0.00352646 -0.01764266] [-0.00190826 -0.00863605 0.00706294] [ 0.0054887 0.02453037 0.0123464 ] [ 0.01085063 0.00352646 -0.01764266] [ 0.00190826 0.00863605 0.00706294] [-0.0054887 -0.02453037 0.0123464 ] [-0.00399828 -0.00058618 -0.00439792] [ 0.00399828 0.00058618 -0.00439792] [-0.00239094 -0.00988294 0.00478994] [ 0.00239094 0.00988294 0.00478994]] Final stress: [-9.34962945e-04 -8.05798303e-04 -5.41762474e-04 6.41524767e-13 1.20388584e-13 -6.41332317e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.0273798 0.00136114 0.00215883] [ 0.0273798 -0.00136114 0.00215883] [-0.01084885 0.00352462 0.01764947] [ 0.005486 -0.02453131 -0.01235044] [-0.00190963 0.00863493 -0.0070658 ] [ 0.01084885 -0.00352462 0.01764947] [-0.005486 0.02453131 -0.01235044] [ 0.00190963 -0.00863493 -0.0070658 ] [-0.00237952 0.00988657 -0.0048043 ] [ 0.00237952 -0.00988657 -0.0048043 ] [-0.00401189 0.00058817 0.00441224] [ 0.00401189 -0.00058817 0.00441224]] Final stress: [-9.34929715e-04 -8.05764108e-04 -5.41460167e-04 -4.96253190e-13 -2.89517409e-13 6.41223720e-04] Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 2 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 2 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-6.46813159e-11 -2.69714172e-02 4.40646375e-09] [ 1.17317561e-09 2.69714172e-02 9.38532746e-08] [ 8.75669248e-03 3.29826562e-08 -1.40124676e-08] [ 1.93544198e-03 -3.61816939e-03 1.74219412e-02] [ 1.93549282e-03 3.61814009e-03 -1.74219664e-02] [-8.75669230e-03 -1.11314278e-08 -4.84731942e-09] [-1.93546225e-03 3.61815812e-03 1.74219507e-02] [-1.93547300e-03 -3.61815195e-03 -1.74219566e-02] [-4.93168527e-03 2.26453169e-03 -1.31789321e-02] [ 4.93168513e-03 -2.26453095e-03 -1.31789593e-02] [-4.93168668e-03 -2.26452703e-03 1.31788931e-02] [ 4.93168599e-03 2.26452756e-03 1.31789501e-02]] Final stress: [ 6.21169589e-04 -8.57325867e-04 8.49030029e-05 -2.47977090e-12 -2.30844145e-12 1.76728678e-11] Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 1.20494947e-10 1.09028173e-01 7.00218328e-10] [-1.69154798e-09 -1.09028173e-01 1.95211567e-08] [-9.46310041e-03 4.29555835e-09 -1.65277014e-09] [-7.90637208e-02 1.75327274e-01 -1.24385766e-01] [-7.90637200e-02 -1.75327275e-01 1.24385766e-01] [ 9.46310059e-03 -1.25584676e-08 -5.03407637e-09] [ 7.90637309e-02 -1.75327268e-01 -1.24385771e-01] [ 7.90637165e-02 1.75327277e-01 1.24385764e-01] [ 3.58288233e-02 -6.03020596e-02 -7.33169387e-02] [-3.58288256e-02 6.03020606e-02 -7.33169529e-02] [ 3.58288223e-02 6.03020638e-02 7.33169409e-02] [-3.58288251e-02 -6.03020643e-02 7.33169446e-02]] Final stress: [ 8.12953058e-03 9.35186339e-03 1.46807314e-02 6.32816865e-12 -7.29498026e-12 1.66965507e-11] Minimization converged after 25 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-1.14606324e-10 6.79648888e-02 -2.37858044e-09] [-6.37316883e-10 -6.79648888e-02 1.22158402e-08] [-3.40295801e-02 1.47122137e-09 -5.56944046e-10] [-2.76388445e-02 5.54113113e-02 -4.54355678e-02] [-2.76388428e-02 -5.54113123e-02 4.54355670e-02] [ 3.40295802e-02 -3.55753810e-09 -1.47455790e-09] [ 2.76388474e-02 -5.54113096e-02 -4.54355692e-02] [ 2.76388403e-02 5.54113137e-02 4.54355658e-02] [ 2.20036442e-02 -4.71666346e-02 -2.02563524e-02] [-2.20036442e-02 4.71666341e-02 -2.02563612e-02] [ 2.20036444e-02 4.71666341e-02 2.02563524e-02] [-2.20036442e-02 -4.71666346e-02 2.02563576e-02]] Final stress: [ 1.51898972e-03 3.30867834e-03 5.65186554e-03 1.95014248e-12 -2.84767455e-12 -1.50231441e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 6.77911061e-11 2.21326833e-02 1.69547643e-09] [-1.40040482e-09 -2.21326826e-02 1.17905064e-07] [-1.25565811e-02 5.69651859e-08 -2.40409216e-08] [-1.74441898e-03 5.07972909e-03 -1.49371714e-02] [-1.74429589e-03 -5.07979999e-03 1.49371125e-02] [ 1.25565817e-02 1.30110592e-09 7.26346854e-10] [ 1.74435204e-03 -5.07976714e-03 -1.49371393e-02] [ 1.74436232e-03 5.07976149e-03 1.49371442e-02] [ 1.73288571e-03 -6.68083125e-03 -1.26015197e-02] [-1.73288309e-03 6.68083988e-03 -1.26015280e-02] [ 1.73288501e-03 6.68083559e-03 1.26014521e-02] [-1.73288631e-03 -6.68082666e-03 1.26015531e-02]] Final stress: [-6.91213003e-04 3.55153630e-04 1.89330402e-05 2.72251734e-12 2.55457904e-11 -2.00337573e-11] Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.76068057e-12 1.37619043e-04 2.28630670e-10] [-8.33900310e-12 -1.37619038e-04 -1.75819330e-09] [ 3.93271646e-04 -5.23411536e-10 2.23508739e-10] [-2.94469624e-04 4.96748976e-04 2.96934668e-04] [-2.94470694e-04 -4.96748364e-04 -2.96934150e-04] [-3.93271656e-04 -5.95397620e-11 -1.62476838e-11] [ 2.94470162e-04 -4.96748672e-04 2.96934414e-04] [ 2.94470531e-04 4.96748465e-04 -2.96934241e-04] [-8.44576236e-05 3.24406559e-05 2.54339677e-04] [ 8.44574659e-05 -3.24405289e-05 2.54340304e-04] [-8.44576867e-05 -3.24403971e-05 -2.54339054e-04] [ 8.44574904e-05 3.24404426e-05 -2.54340295e-04]] Final stress: [ 1.07985565e-04 -3.25928548e-05 2.22031032e-05 2.81749308e-13 1.32955330e-13 7.18319236e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-4.43703407e-12 -1.40665621e-04 6.28208707e-10] [-2.27573516e-12 1.40665613e-04 -1.71298462e-09] [ 6.30787879e-04 -9.45913348e-11 4.78878326e-11] [-2.18401011e-04 3.96560228e-04 -2.92418343e-04] [-2.18401264e-04 -3.96560083e-04 2.92418480e-04] [-6.30787891e-04 2.88511659e-10 1.23592874e-10] [ 2.18401124e-04 -3.96560171e-04 -2.92418391e-04] [ 2.18401322e-04 3.96560054e-04 2.92418505e-04] [ 7.86890125e-05 -3.62213531e-05 2.53120200e-04] [-7.86891125e-05 3.62212681e-05 2.53121331e-04] [ 7.86890479e-05 3.62211877e-05 -2.53119897e-04] [-7.86891003e-05 -3.62213165e-05 -2.53120971e-04]] Final stress: [-3.28179281e-05 1.07724045e-04 2.21089057e-05 1.44309723e-13 -1.70894531e-13 -2.54934952e-13] Minimization converged after 2 steps. Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-7.82535370e-10 4.21179314e-02 -3.37422941e-08] [-4.14808049e-11 -4.21179323e-02 1.70825142e-09] [-5.51730207e-03 -5.34619691e-08 2.25672303e-08] [-2.04106153e-02 3.89098155e-02 -3.72951135e-02] [-2.04107409e-02 -3.89097432e-02 3.72951732e-02] [ 5.51730229e-03 -4.45994125e-08 -1.87430500e-08] [ 2.04107116e-02 -3.89097600e-02 -3.72951599e-02] [ 2.04106404e-02 3.89098011e-02 3.72951248e-02] [ 6.50628053e-03 -4.15589979e-02 -1.85419741e-02] [-6.50627888e-03 4.15589902e-02 -1.85420617e-02] [ 6.50627869e-03 4.15590014e-02 1.85420469e-02] [-6.50627547e-03 -4.15590082e-02 1.85419925e-02]] Final stress: [ 1.02689978e-03 2.51830875e-03 2.15489257e-03 4.53159555e-14 -5.37705473e-11 4.70673072e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-6.43236661e-09 -6.84663936e-02 1.02780260e-07] [ 6.80951101e-10 6.84663945e-02 1.12679114e-08] [ 4.06366909e-02 6.63263504e-08 -2.69265941e-08] [-1.34936532e-02 5.00814099e-02 6.57959652e-02] [-1.34935509e-02 -5.00814687e-02 -6.57960141e-02] [-4.06366904e-02 -3.91525405e-08 -1.45929826e-08] [ 1.34936013e-02 -5.00814405e-02 6.57959913e-02] [ 1.34936151e-02 5.00814328e-02 -6.57959846e-02] [-3.69087711e-02 -1.64525795e-02 -3.42560972e-02] [ 3.69087736e-02 1.64525991e-02 -3.42560185e-02] [-3.69087842e-02 1.64526239e-02 3.42560468e-02] [ 3.69087745e-02 -1.64526052e-02 3.42560386e-02]] Final stress: [ 8.04756704e-03 -8.74206354e-04 8.40977835e-03 2.54842710e-11 -1.69950516e-11 9.72842417e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 1.18805812e-08 -7.47625187e-02 -1.38152811e-07] [-1.00065223e-09 7.47625238e-02 -4.42565631e-08] [ 5.12944003e-02 -2.51508722e-07 1.02317788e-07] [-2.21410849e-02 3.86805069e-02 5.62914842e-02] [-2.21414222e-02 -3.86803097e-02 -5.62913205e-02] [-5.12943984e-02 -1.20697624e-07 -5.01204355e-08] [ 2.21412289e-02 -3.86804200e-02 5.62914070e-02] [ 2.21411159e-02 3.86804886e-02 -5.62914669e-02] [-2.97370972e-02 -2.41065912e-02 -9.64464873e-02] [ 2.97371796e-02 2.41066239e-02 -9.64467283e-02] [-2.97371043e-02 2.41066428e-02 9.64466936e-02] [ 2.97371714e-02 -2.41065742e-02 9.64465485e-02]] Final stress: [ 8.00984946e-03 -1.45351397e-03 8.80745367e-03 -1.86037633e-10 2.79425826e-10 -4.45120189e-12] Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 28 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.00630793e-09 6.84095601e-02 1.59307398e-08] [-1.53004582e-09 -6.84095599e-02 2.34749810e-08] [-4.46554908e-02 -1.46192805e-08 6.01286487e-09] [-5.84569944e-02 8.11246839e-02 -6.90159156e-02] [-5.84570121e-02 -8.11246739e-02 6.90159243e-02] [ 4.46554909e-02 -3.62909203e-08 -1.49674931e-08] [ 5.84570293e-02 -8.11246636e-02 -6.90159326e-02] [ 5.84569797e-02 8.11246926e-02 6.90159083e-02] [ 5.26783347e-03 -1.01907155e-01 -3.24975155e-02] [-5.26783228e-03 1.01907161e-01 -3.24975470e-02] [ 5.26783116e-03 1.01907162e-01 3.24975359e-02] [-5.26783432e-03 -1.01907157e-01 3.24975116e-02]] Final stress: [ 3.80640589e-03 4.06936588e-03 7.80260225e-03 2.86328866e-12 -1.59039657e-11 5.16664453e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.67796407e-09 6.73516120e-02 5.00779225e-08] [-2.54686324e-09 -6.73516117e-02 4.63799084e-08] [-5.59665728e-02 4.52210074e-08 -1.85778788e-08] [-3.12865558e-02 7.22387248e-02 -3.93536176e-02] [-3.12864752e-02 -7.22387718e-02 3.93535790e-02] [ 5.59665727e-02 -9.15727616e-09 -3.58976895e-09] [ 3.12865234e-02 -7.22387434e-02 -3.93536020e-02] [ 3.12865061e-02 7.22387540e-02 3.93535941e-02] [-4.35352116e-03 -6.62831484e-02 -1.08228338e-01] [ 4.35352136e-03 6.62831484e-02 -1.08228313e-01] [-4.35351976e-03 6.62831477e-02 1.08228301e-01] [ 4.35352091e-03 -6.62831475e-02 1.08228322e-01]] Final stress: [ 1.48819103e-03 3.07682854e-03 6.53921756e-03 -6.73668670e-13 2.20867927e-11 -6.03182494e-12] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 4.83072672e-02 -2.29480116e-02 -2.36072902e-05] [-4.83072670e-02 2.29480117e-02 -2.36016886e-05] [ 3.65693025e-02 9.41645872e-03 -4.06667660e-02] [-1.03927977e-02 3.33801735e-02 3.64399416e-02] [-8.70305141e-03 -1.09105916e-02 3.76497597e-03] [-3.65693025e-02 -9.41645493e-03 -4.06667645e-02] [ 1.03927945e-02 -3.33801754e-02 3.64399431e-02] [ 8.70305227e-03 1.09105911e-02 3.76497644e-03] [-4.40038766e-03 -9.70595491e-03 -4.06873971e-02] [ 4.40038853e-03 9.70595392e-03 -4.06873980e-02] [-6.74366715e-03 -1.46695894e-02 4.11728465e-02] [ 6.74366839e-03 1.46695889e-02 4.11728509e-02]] Final stress: [ 2.24762797e-03 1.34922539e-03 3.02958454e-03 -3.38550990e-12 -1.61775272e-12 -1.09063550e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-4.88635218e-02 -2.31941092e-02 2.33289094e-05] [ 4.88635216e-02 2.31941093e-02 2.33224704e-05] [ 3.75246855e-02 -9.67857039e-03 4.10583086e-02] [-8.91139438e-03 1.11934281e-02 -3.82501064e-03] [-1.06299576e-02 -3.42555877e-02 -3.67552414e-02] [-3.75246855e-02 9.67856992e-03 4.10583083e-02] [ 8.91139607e-03 -1.11934272e-02 -3.82501148e-03] [ 1.06299563e-02 3.42555885e-02 -3.67552421e-02] [-6.68210307e-03 1.51101890e-02 -4.21506776e-02] [ 6.68210274e-03 -1.51101896e-02 -4.21506754e-02] [-4.70611829e-03 9.79588254e-03 4.16492971e-02] [ 4.70611827e-03 -9.79588322e-03 4.16492932e-02]] Final stress: [ 2.29500098e-03 1.39936414e-03 3.11434710e-03 1.70955488e-13 -2.69132036e-13 1.09388053e-03] Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 0.08303616 0.02964494 0.00095335] [-0.08303616 -0.02964494 0.00095336] [ 0.09715235 -0.0088619 -0.07217493] [-0.02775061 0.04108155 0.00214826] [ 0.02505942 0.05636866 0.04507864] [-0.09715235 0.0088619 -0.07217493] [ 0.0277506 -0.04108155 0.00214826] [-0.02505942 -0.05636867 0.04507864] [ 0.01159672 0.04796844 -0.07036739] [-0.01159672 -0.04796844 -0.07036739] [ 0.04633075 -0.09838034 0.09436205] [-0.04633075 0.09838034 0.09436206]] Final stress: [-9.06063300e-05 5.38337463e-03 9.75734326e-03 -4.38611566e-12 1.40860935e-12 -2.82520803e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.08303767 0.02964569 -0.00095346] [ 0.08303767 -0.02964569 -0.00095345] [ 0.097156 0.00886066 0.07217626] [ 0.0250619 -0.05636533 -0.04507734] [-0.02774615 -0.0410847 -0.00214975] [-0.097156 -0.00886066 0.07217626] [-0.0250619 0.05636534 -0.04507734] [ 0.02774615 0.0410847 -0.00214975] [ 0.04633585 0.09838176 -0.09436664] [-0.04633585 -0.09838176 -0.09436665] [ 0.0116013 -0.04796895 0.07037093] [-0.0116013 0.04796895 0.07037094]] Final stress: [-9.05777124e-05 5.38362307e-03 9.75768842e-03 -1.76128350e-12 -2.33896112e-12 2.82524195e-03] Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 7.12741521e-02 -5.32354516e-02 1.14117617e-03] [ 3.52319103e-02 -5.32665440e-02 -1.14124984e-03] [-7.65524597e-02 -1.06818410e-04 -2.89069718e-02] [-1.15044492e-02 1.24604129e-02 -2.99020470e-03] [ 1.06850224e-02 2.19974072e-02 3.75345081e-02] [-1.92166500e-02 7.65877310e-03 1.41765829e-02] [-5.84307433e-02 1.01529904e-01 1.03794185e-02] [ 8.58823735e-05 1.13802761e-02 -3.01931574e-02] [ 1.26184062e-01 4.74817267e-02 -1.66345300e-02] [ 5.40210067e-02 8.43013936e-02 -2.17090078e-02] [-1.01849102e-01 -1.08928244e-01 2.13600348e-02] [-2.99286322e-02 -7.12728354e-02 1.69834011e-02]] Final stress: [-0.00176028 -0.00175789 0.0026028 -0.00426564 -0.00426574 -0.00115154] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.52314968e-02 5.32660633e-02 1.14124092e-03] [ 7.12736045e-02 5.32349711e-02 -1.14116971e-03] [-7.65515352e-02 1.06455113e-04 2.89065344e-02] [ 1.06844283e-02 -2.19973666e-02 -3.75338848e-02] [-1.15042577e-02 -1.24598281e-02 2.99005447e-03] [-1.92161622e-02 -7.65912386e-03 -1.41761498e-02] [ 8.53664023e-05 -1.13803622e-02 3.01925365e-02] [-5.84301919e-02 -1.01528685e-01 -1.03792652e-02] [-1.01849809e-01 1.08928995e-01 -2.13599655e-02] [-2.99297323e-02 7.12738086e-02 -1.69833562e-02] [ 1.26184727e-01 -4.74827374e-02 1.66344927e-02] [ 5.40220657e-02 -8.43021901e-02 2.17089323e-02]] Final stress: [-0.00176027 -0.00175787 0.00260279 -0.00426563 0.00426573 0.00115153] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-7.12736367e-02 -5.32349861e-02 -1.14116991e-03] [-3.52314946e-02 -5.32660783e-02 1.14124291e-03] [ 1.92162541e-02 7.65911285e-03 -1.41761677e-02] [-8.54079902e-05 1.13804048e-02 3.01925691e-02] [ 5.84302614e-02 1.01528806e-01 -1.03792726e-02] [ 7.65516178e-02 -1.06460159e-04 2.89065576e-02] [-1.06844395e-02 2.19973655e-02 -3.75339208e-02] [ 1.15043060e-02 1.24599204e-02 2.99005877e-03] [ 2.99298028e-02 -7.12740056e-02 -1.69833719e-02] [ 1.01849952e-01 -1.08929220e-01 -2.13599884e-02] [-5.40222409e-02 8.43023104e-02 2.17089544e-02] [-1.26184975e-01 4.74828308e-02 1.66345084e-02]] Final stress: [-0.00176027 -0.00175787 0.0026028 0.00426563 -0.00426573 0.00115153] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.52316135e-02 5.32662121e-02 -1.14124427e-03] [-7.12737855e-02 5.32351199e-02 1.14117251e-03] [ 1.92163712e-02 -7.65901489e-03 1.41762871e-02] [ 5.84304018e-02 -1.01529125e-01 1.03793145e-02] [-8.55448811e-05 -1.13803701e-02 -3.01927391e-02] [ 7.65518621e-02 1.06562696e-04 -2.89066772e-02] [ 1.15043495e-02 -1.24600648e-02 -2.99010092e-03] [-1.06846072e-02 -2.19973771e-02 3.75340901e-02] [-5.40218950e-02 -8.43020533e-02 -2.17089707e-02] [-1.26184724e-01 -4.74825186e-02 -1.66345154e-02] [ 2.99294708e-02 7.12736788e-02 1.69833808e-02] [ 1.01849715e-01 1.08928951e-01 2.13600025e-02]] Final stress: [-0.00176027 -0.00175788 0.0026028 0.00426563 0.00426573 -0.00115153] Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 63 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 7.45636663e-05 -1.77473005e-05 7.21778149e-05] [-7.45636638e-05 1.77473025e-05 7.21778433e-05] [ 3.37864414e-04 1.95516753e-04 5.22441010e-04] [ 1.11732485e-04 7.01517613e-04 -1.28016307e-04] [ 1.84342352e-04 -5.86423159e-04 -4.72369376e-04] [-3.37864410e-04 -1.95516871e-04 5.22440959e-04] [-1.11732413e-04 -7.01517573e-04 -1.28016343e-04] [-1.84342471e-04 5.86423229e-04 -4.72369434e-04] [ 3.36239901e-04 -1.12142346e-04 9.82790341e-04] [-3.36239883e-04 1.12142341e-04 9.82790252e-04] [ 2.58686682e-04 2.39511400e-04 -9.77023347e-04] [-2.58686659e-04 -2.39511389e-04 -9.77023413e-04]] Final stress: [ 3.32248454e-05 3.74991284e-05 8.26480544e-06 -4.94454865e-14 -1.39189212e-15 1.58379328e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-7.43795030e-05 -1.78027134e-05 -7.21779988e-05] [ 7.43795060e-05 1.78027148e-05 -7.21781972e-05] [ 3.37936589e-04 -1.95434772e-04 -5.23211038e-04] [ 1.86026574e-04 5.87644383e-04 4.73521325e-04] [ 1.13372135e-04 -7.02588958e-04 1.27645137e-04] [-3.37936586e-04 1.95434791e-04 -5.23211025e-04] [-1.86026614e-04 -5.87644403e-04 4.73521347e-04] [-1.13372120e-04 7.02588959e-04 1.27645146e-04] [ 2.60351859e-04 -2.40309748e-04 9.77267549e-04] [-2.60351846e-04 2.40309741e-04 9.77267669e-04] [ 3.37880989e-04 1.12223240e-04 -9.83044926e-04] [-3.37880983e-04 -1.12223235e-04 -9.83044989e-04]] Final stress: [ 3.32199707e-05 3.75213686e-05 8.26449975e-06 -3.55008137e-14 2.35541422e-14 -1.58376096e-04] Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 2 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.97504679e-10 9.11552441e-04 9.18866494e-09] [-2.95191205e-10 -9.11551511e-04 -1.09130375e-08] [-2.68853834e-04 1.71933445e-09 -3.66297187e-10] [-4.61122374e-05 2.46519607e-04 -5.11996123e-04] [-4.60904229e-05 -2.46532007e-04 5.11987133e-04] [ 2.68853645e-04 -2.21797546e-08 -8.22476977e-09] [ 4.61132806e-05 -2.46518737e-04 -5.11996702e-04] [ 4.61049149e-05 2.46523938e-04 5.11993381e-04] [ 2.52334719e-04 1.23500464e-04 6.06855943e-05] [-2.52338809e-04 -1.23485333e-04 6.06938817e-05] [ 2.52330578e-04 -1.23484031e-04 -6.06731318e-05] [-2.52341342e-04 1.23495630e-04 -6.06837176e-05]] Final stress: [4.51091130e-05 6.59270116e-05 1.65564261e-04 1.20292209e-11 2.25671218e-11 1.25904850e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.51501733e-10 2.90383005e-03 3.65150574e-08] [ 1.10482845e-10 -2.90383017e-03 -2.10360022e-08] [-5.30551527e-04 -1.62889038e-08 7.18612583e-09] [-6.51553840e-04 1.03269803e-03 -2.00138576e-03] [-6.51607106e-04 -1.03266763e-03 2.00141103e-03] [ 5.30551542e-04 -4.14478240e-08 -1.70111393e-08] [ 6.51598594e-04 -1.03267258e-03 -2.00140759e-03] [ 6.51545782e-04 1.03270332e-03 2.00138181e-03] [ 4.12595109e-04 -1.66236931e-05 -2.54170625e-04] [-4.12587580e-04 1.66200488e-05 -2.54182950e-04] [ 4.12592552e-04 1.66341491e-05 2.54207473e-04] [-4.12584187e-04 -1.66337807e-05 2.54140961e-04]] Final stress: [-8.39632178e-06 1.14183769e-04 -7.96844439e-05 -1.36859552e-11 -3.98553064e-12 5.02656279e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.06509757e-09 -1.16741102e-02 -8.54525158e-08] [ 7.73495878e-10 1.16741104e-02 8.22460900e-08] [-1.81487263e-03 5.21642792e-08 -2.36078999e-08] [ 2.69317410e-03 -6.55336093e-03 7.17909891e-03] [ 2.69326556e-03 6.55330808e-03 -7.17914664e-03] [ 1.81487324e-03 1.08750578e-07 4.38097518e-08] [-2.69333203e-03 6.55327043e-03 7.17917420e-03] [-2.69312601e-03 -6.55338920e-03 -7.17907885e-03] [-3.56353711e-03 -2.14618271e-03 4.88078826e-04] [ 3.56354675e-03 2.14618597e-03 4.88110093e-04] [-3.56354000e-03 2.14619252e-03 -4.88221392e-04] [ 3.56354629e-03 -2.14618530e-03 -4.88032141e-04]] Final stress: [ 1.55626366e-04 -7.66299042e-04 6.17983685e-05 -1.76530234e-11 -6.46794353e-12 1.90045767e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.37487832e-11 -4.25440942e-03 -3.98851659e-08] [ 8.73023320e-11 4.25440625e-03 -2.99347331e-08] [ 1.10104815e-03 -2.63321436e-08 1.13771021e-08] [ 5.00994787e-04 -1.26267614e-03 2.71147561e-03] [ 5.00884961e-04 1.26273874e-03 -2.71142472e-03] [-1.10104811e-03 3.97366657e-08 1.46418484e-08] [-5.00923917e-04 1.26271608e-03 2.71144279e-03] [-5.00956002e-04 -1.26269878e-03 -2.71145761e-03] [-9.05865655e-04 1.58737010e-04 -1.05367881e-03] [ 9.05854429e-04 -1.58782106e-04 -1.05371620e-03] [-9.05851942e-04 -1.58792177e-04 1.05371540e-03] [ 9.05863256e-04 1.58747133e-04 1.05368735e-03]] Final stress: [ 5.17467429e-05 -1.96985854e-04 -1.28196015e-04 -2.29649145e-13 -7.34478271e-11 -4.20126912e-11] Minimization converged after 43 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.28721165e-03 -1.23568857e-02 -3.42505916e-04] [-6.28721165e-03 1.23568857e-02 3.42505863e-04] [ 2.80541093e-03 1.13833926e-11 -2.32553575e-11] [-2.91478905e-03 1.71899511e-03 4.98754138e-03] [-2.91478924e-03 -1.71899500e-03 -4.98754133e-03] [ 1.07203112e-02 5.42738048e-10 2.12844460e-10] [ 4.77994254e-03 -8.54017716e-03 -1.69881887e-02] [ 4.77994369e-03 8.54017650e-03 1.69881892e-02] [-1.44682262e-03 8.21484619e-03 8.71205061e-03] [-8.93980774e-04 -1.07521457e-04 8.53838591e-03] [-1.44682266e-03 -8.21484607e-03 -8.71205133e-03] [-8.93980739e-04 1.07521344e-04 -8.53838590e-03]] Final stress: [ 2.71647914e-04 9.44396254e-05 -1.64148901e-05 -7.75345068e-04 -5.44213589e-14 4.66295437e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.28721160e-03 -1.23568856e-02 3.42505865e-04] [ 6.28721160e-03 1.23568856e-02 -3.42504454e-04] [-1.07203112e-02 -1.09197390e-10 3.04631459e-11] [-4.77994285e-03 8.54017690e-03 -1.69881887e-02] [-4.77994322e-03 -8.54017668e-03 1.69881889e-02] [-2.80541090e-03 -2.82139509e-10 -1.34148806e-10] [ 2.91478944e-03 -1.71899484e-03 4.98754115e-03] [ 2.91478880e-03 1.71899521e-03 -4.98754149e-03] [ 8.93980746e-04 1.07521369e-04 8.53838609e-03] [ 1.44682259e-03 -8.21484607e-03 8.71205013e-03] [ 8.93980770e-04 -1.07521452e-04 -8.53838630e-03] [ 1.44682261e-03 8.21484597e-03 -8.71205103e-03]] Final stress: [ 2.71647911e-04 9.44396242e-05 -1.64148910e-05 7.75345063e-04 -7.62482472e-14 5.47818928e-14] Minimization converged after 41 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.18285413e-12 -5.58467002e-03 4.36488053e-10] [ 1.15841378e-11 1.83774485e-02 5.96686767e-10] [-3.57964296e-03 -3.01094137e-03 1.46271092e-02] [ 3.40700006e-03 2.09039636e-03 -1.12425958e-02] [-1.06681583e-02 -8.11718152e-03 1.63211330e-03] [ 3.57964296e-03 -3.01094178e-03 -1.46271094e-02] [ 1.06681585e-02 -8.11718141e-03 -1.63211341e-03] [-3.40700082e-03 2.09039680e-03 1.12425955e-02] [ 4.21188908e-03 6.51032090e-03 1.16700359e-02] [ 3.94844702e-03 -3.86898373e-03 5.69963475e-03] [-3.94844674e-03 -3.86898373e-03 -5.69963503e-03] [-4.21188882e-03 6.51032103e-03 -1.16700360e-02]] Final stress: [ 2.39497314e-04 1.31698476e-04 -1.58969629e-05 -4.02608606e-13 -7.76581103e-04 -2.78241254e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.48650101e-12 -1.83774485e-02 1.46783429e-10] [-3.10847737e-12 5.58467001e-03 7.82869734e-10] [-3.57964295e-03 3.01094181e-03 -1.46271094e-02] [-1.06681583e-02 8.11718151e-03 -1.63211333e-03] [ 3.40700011e-03 -2.09039639e-03 1.12425958e-02] [ 3.57964296e-03 3.01094142e-03 1.46271092e-02] [-3.40700016e-03 -2.09039642e-03 -1.12425958e-02] [ 1.06681583e-02 8.11718153e-03 1.63211329e-03] [-3.94844698e-03 3.86898373e-03 5.69963495e-03] [-4.21188889e-03 -6.51032123e-03 1.16700355e-02] [ 4.21188888e-03 -6.51032103e-03 -1.16700362e-02] [ 3.94844706e-03 3.86898354e-03 -5.69963501e-03]] Final stress: [ 2.39497315e-04 1.31698475e-04 -1.58969629e-05 -8.69012472e-14 7.76581103e-04 8.15086069e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.10412578e-02 1.05945197e-02 8.08091144e-05] [-2.10412570e-02 -1.05945198e-02 8.07544430e-05] [ 6.16880473e-03 2.62988580e-04 -1.62281877e-02] [-4.40949724e-03 1.75802000e-02 2.92417184e-03] [ 1.86129204e-03 -6.55791827e-03 1.31890558e-02] [-6.16880478e-03 -2.63010184e-04 -1.62281965e-02] [ 4.40949606e-03 -1.75802007e-02 2.92417192e-03] [-1.86130502e-03 6.55792629e-03 1.31890496e-02] [ 3.48500925e-03 -5.11077035e-03 -1.45918779e-02] [-3.48500066e-03 5.11077585e-03 -1.45918600e-02] [ 8.89258403e-03 -1.34044081e-03 1.46260714e-02] [-8.89257921e-03 1.34044973e-03 1.46260380e-02]] Final stress: [ 1.97312933e-04 9.46713364e-04 7.85544366e-04 -9.54730798e-12 9.48391154e-12 -6.45413429e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.10317790e-02 1.05896606e-02 -8.07962663e-05] [ 2.10317791e-02 -1.05896604e-02 -8.07642008e-05] [ 6.16499616e-03 -2.54297324e-04 1.62085621e-02] [ 1.87075739e-03 6.55826258e-03 -1.31706117e-02] [-4.41584305e-03 -1.75902393e-02 -2.92296562e-03] [-6.16499596e-03 2.54269805e-04 1.62085510e-02] [-1.87075368e-03 -6.55826019e-03 -1.31706139e-02] [ 4.41583089e-03 1.75902464e-02 -2.92297158e-03] [ 8.90724093e-03 1.31819937e-03 -1.46375656e-02] [-8.90723468e-03 -1.31819144e-03 -1.46375907e-02] [ 3.45852360e-03 5.10988409e-03 1.46033808e-02] [-3.45852172e-03 -5.10987428e-03 1.46033857e-02]] Final stress: [ 1.97531049e-04 9.46545867e-04 7.85621254e-04 -9.09247236e-12 1.34606572e-11 6.45047181e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 0.06528218 -0.02682885 0.00024026] [-0.06528218 0.02682884 0.00024023] [ 0.12594076 -0.0063267 -0.07956845] [-0.06476505 0.09795824 0.06698201] [ 0.0233254 0.04514688 0.00841548] [-0.12594076 0.00632672 -0.07956845] [ 0.06476504 -0.09795824 0.06698202] [-0.02332539 -0.04514689 0.00841549] [-0.05079112 0.01841131 -0.06690937] [ 0.05079112 -0.0184113 -0.06690935] [ 0.04204276 -0.05641204 0.07084006] [-0.04204276 0.05641204 0.07084006]] Final stress: [ 4.80759547e-03 5.06054614e-03 1.08161511e-02 -1.05881233e-11 -9.50230654e-12 -7.56804253e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-0.0652855 -0.02682682 -0.00024045] [ 0.0652855 0.02682682 -0.0002405 ] [ 0.12603409 0.00633355 0.07962067] [ 0.02332258 -0.04514404 -0.00842003] [-0.06481364 -0.09802954 -0.06702594] [-0.12603409 -0.00633352 0.07962068] [-0.02332263 0.04514401 -0.00842001] [ 0.06481368 0.09802951 -0.06702592] [ 0.04207672 0.05644016 -0.070877 ] [-0.04207671 -0.05644015 -0.07087695] [-0.05082048 -0.01843214 0.06694271] [ 0.05082048 0.01843215 0.06694272]] Final stress: [4.81138718e-03 5.06549516e-03 1.08233845e-02 2.07399800e-11 5.40939116e-12 7.56271685e-04] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-8.60833627e-11 4.53120406e-02 -2.75166467e-09] [ 2.70286998e-10 -4.53120406e-02 -8.11313813e-09] [-2.32433812e-02 -5.26303978e-09 2.16464435e-09] [-1.53438235e-02 3.00810469e-02 -4.64028504e-02] [-1.53438315e-02 -3.00810422e-02 4.64028543e-02] [ 2.32433812e-02 1.69981121e-09 6.23510226e-10] [ 1.53438266e-02 -3.00810451e-02 -4.64028519e-02] [ 1.53438280e-02 3.00810442e-02 4.64028526e-02] [ 1.81392084e-02 -2.09503412e-02 -3.66315779e-03] [-1.81392083e-02 2.09503411e-02 -3.66315765e-03] [ 1.81392085e-02 2.09503403e-02 3.66316200e-03] [-1.81392084e-02 -2.09503404e-02 3.66315699e-03]] Final stress: [ 1.28526319e-04 2.06003119e-03 2.21020735e-03 -7.49338706e-13 -1.98364937e-12 -3.41832654e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 6.55838328e-10 -9.26219161e-04 2.87521051e-09] [-1.84645965e-10 9.26219038e-04 -5.10981328e-08] [ 4.24380342e-04 -9.04064279e-09 4.06741760e-09] [ 6.75927117e-05 -1.09092125e-04 5.57355529e-04] [ 6.75322496e-05 1.09126459e-04 -5.57327894e-04] [-4.24380339e-04 -5.85738791e-09 -2.15358317e-09] [-6.75840992e-05 1.09096735e-04 5.57351265e-04] [-6.75552476e-05 -1.09112917e-04 -5.57338622e-04] [-1.62203085e-04 -9.08094173e-05 1.19585552e-05] [ 1.62209665e-04 9.08061204e-05 1.19729328e-05] [-1.62208294e-04 9.08309246e-05 -1.19445244e-05] [ 1.62215624e-04 -9.08307577e-05 -1.19809327e-05]] Final stress: [ 6.43448061e-05 4.49216769e-05 1.66022543e-04 -1.17123914e-11 -2.48262656e-12 9.57635446e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.50960150e-10 -3.05730792e-03 -8.77764494e-09] [ 2.83645996e-10 3.05730853e-03 2.00299365e-08] [ 1.81948618e-03 1.81163073e-09 -1.35491285e-09] [ 1.87270036e-05 1.08668485e-04 2.10808697e-03] [ 1.87422010e-05 -1.08677118e-04 -2.10809497e-03] [-1.81948589e-03 7.81697262e-09 3.11632350e-09] [-1.87599735e-05 -1.08687334e-04 2.10810224e-03] [-1.87264279e-05 1.08668199e-04 -2.10808727e-03] [-4.63702127e-04 -3.96147982e-05 -2.64977614e-04] [ 4.63712441e-04 3.96215392e-05 -2.64976814e-04] [-4.63704817e-04 3.96257545e-05 2.64953257e-04] [ 4.63710773e-04 -3.96149649e-05 2.64981182e-04]] Final stress: [ 1.20322520e-04 -1.14542786e-05 -7.86107730e-05 -1.39709740e-11 1.41690879e-11 9.21815832e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 9.37886213e-10 1.06565935e-02 -3.79846767e-08] [ 2.95980490e-10 -1.06565948e-02 4.62519426e-08] [-1.00558026e-02 -5.78168180e-10 -4.31324892e-10] [ 2.36843882e-03 -1.77431324e-03 -6.76731350e-03] [ 2.36836694e-03 1.77435381e-03 6.76734351e-03] [ 1.00558035e-02 2.43681039e-08 8.54812058e-09] [-2.36845176e-03 1.77430522e-03 -6.76730769e-03] [-2.36840884e-03 -1.77432997e-03 6.76732498e-03] [ 2.37178584e-03 4.14106163e-04 4.87482426e-04] [-2.37176430e-03 -4.14131869e-04 4.87440981e-04] [ 2.37178595e-03 -4.14105621e-04 -4.87512306e-04] [-2.37175482e-03 4.14093076e-04 -4.87474793e-04]] Final stress: [-6.89757306e-04 9.35265879e-05 6.18564695e-05 -4.07887713e-11 -3.39685691e-11 8.21905063e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.20463328e-09 4.13169806e-03 1.68398111e-08] [-7.00629041e-10 -4.13169890e-03 -1.14153024e-07] [-2.25888388e-03 -7.88289998e-08 3.23316145e-08] [-3.39688148e-05 3.89385862e-04 -2.65247518e-03] [-3.41157590e-05 -3.89301138e-04 2.65254444e-03] [ 2.25888270e-03 1.84016935e-09 -3.98531798e-10] [ 3.40898045e-05 -3.89316343e-04 -2.65253178e-03] [ 3.40614654e-05 3.89332270e-04 2.65251723e-03] [ 7.33730343e-04 -3.21144556e-04 -1.04272770e-03] [-7.33764924e-04 3.21141061e-04 -1.04272718e-03] [ 7.33734489e-04 3.21127315e-04 1.04279408e-03] [-7.33763518e-04 -3.21146648e-04 1.04267148e-03]] Final stress: [-1.87764403e-04 4.40228692e-05 -1.28243088e-04 5.18822767e-11 -2.23105178e-11 -2.42589284e-11] Minimization converged after 41 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.35597257e-03 1.18830737e-02 3.39521795e-04] [-6.35597256e-03 -1.18830737e-02 -3.39521004e-04] [ 1.63242692e-02 2.83034982e-10 -1.08895702e-10] [ 9.80512649e-04 -3.72991472e-03 1.73625863e-02] [ 9.80513009e-04 3.72991451e-03 -1.73625864e-02] [-2.31702953e-03 -3.36139868e-10 -1.36406682e-10] [ 9.18088147e-05 -3.65736500e-03 -4.64848729e-03] [ 9.18079885e-05 3.65736547e-03 4.64848692e-03] [-1.33107482e-03 -1.08986715e-03 8.58123914e-03] [-3.88893705e-04 9.00654860e-03 8.76174508e-03] [-1.33107478e-03 1.08986703e-03 -8.58123903e-03] [-3.88893687e-04 -9.00654867e-03 -8.76174521e-03]] Final stress: [ 1.31467127e-04 2.36541501e-04 -1.62802468e-05 -7.77906623e-04 -1.91297113e-13 -1.04633149e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.35597257e-03 1.18830737e-02 -3.39521401e-04] [ 6.35597257e-03 -1.18830737e-02 3.39521117e-04] [ 2.31702953e-03 -2.14216079e-11 -1.28652630e-12] [-9.18082357e-05 3.65736533e-03 -4.64848705e-03] [-9.18086022e-05 -3.65736513e-03 4.64848718e-03] [-1.63242692e-02 3.29351349e-10 1.29870148e-10] [-9.80513465e-04 3.72991426e-03 1.73625866e-02] [-9.80512517e-04 -3.72991479e-03 -1.73625862e-02] [ 3.88893882e-04 -9.00654858e-03 8.76174487e-03] [ 1.33107479e-03 1.08986700e-03 8.58123916e-03] [ 3.88893827e-04 9.00654878e-03 -8.76174529e-03] [ 1.33107484e-03 -1.08986718e-03 -8.58123915e-03]] Final stress: [ 1.31467126e-04 2.36541502e-04 -1.62802468e-05 7.77906623e-04 4.11597047e-14 7.65278453e-13] Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.29822400e-12 1.86858006e-02 -1.75585256e-10] [-3.24321717e-12 -6.15088023e-03 1.38567422e-09] [ 9.94785094e-03 5.75946942e-03 1.07869026e-02] [ 6.67461175e-04 -7.13108846e-03 -2.09524572e-03] [ 3.31449991e-04 -6.41156289e-03 -1.37597302e-02] [-9.94785094e-03 5.75946902e-03 -1.07869028e-02] [-3.31449375e-04 -6.41156253e-03 1.37597299e-02] [-6.67461529e-04 -7.13108827e-03 2.09524555e-03] [ 3.87728296e-03 -3.35864606e-03 5.62750507e-03] [ 4.02610020e-03 4.87436776e-03 1.16382963e-02] [-4.02610031e-03 4.87436766e-03 -1.16382973e-02] [-3.87728311e-03 -3.35864602e-03 -5.62750462e-03]] Final stress: [ 9.88845335e-05 2.69183082e-04 -1.58615634e-05 2.58890504e-13 -7.77803656e-04 -2.69784115e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.67924015e-12 6.15088021e-03 1.63824182e-10] [-2.41393913e-12 -1.86858006e-02 8.60391709e-10] [ 9.94785091e-03 -5.75946887e-03 -1.07869028e-02] [ 3.31449347e-04 6.41156250e-03 1.37597299e-02] [ 6.67461781e-04 7.13108809e-03 2.09524542e-03] [-9.94785091e-03 -5.75946911e-03 1.07869027e-02] [-6.67461378e-04 7.13108833e-03 -2.09524562e-03] [-3.31449549e-04 6.41156262e-03 -1.37597300e-02] [-4.02610031e-03 -4.87436768e-03 1.16382966e-02] [-3.87728306e-03 3.35864610e-03 5.62750470e-03] [ 3.87728296e-03 3.35864601e-03 -5.62750532e-03] [ 4.02610021e-03 -4.87436765e-03 -1.16382966e-02]] Final stress: [ 9.88845331e-05 2.69183082e-04 -1.58615635e-05 1.19844838e-13 7.77803655e-04 -2.53158493e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.84947546e-02 -9.17429935e-03 8.04091504e-05] [-1.84947539e-02 9.17429763e-03 8.03290438e-05] [ 1.44682157e-02 -5.08467076e-03 -1.33176757e-02] [-7.48370059e-03 1.31727212e-02 1.42115977e-02] [ 6.21512000e-03 -1.61268810e-05 -1.01221743e-03] [-1.44682156e-02 5.08463410e-03 -1.33176918e-02] [ 7.48373662e-03 -1.31727011e-02 1.42115801e-02] [-6.21519342e-03 1.61696225e-05 -1.01225178e-03] [-4.77564302e-03 -9.56621448e-04 -1.43025939e-02] [ 4.77565807e-03 9.56604598e-04 -1.43025918e-02] [ 9.77474395e-03 -7.13821653e-03 1.43405898e-02] [-9.77472246e-03 7.13820894e-03 1.43405165e-02]] Final stress: [ 7.44398797e-04 3.30526792e-04 7.49670492e-04 -2.41774492e-11 -2.11904929e-11 -5.17886125e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.84916940e-02 -9.17281571e-03 -8.04472341e-05] [ 1.84916947e-02 9.17281628e-03 -8.04759239e-05] [ 1.44702120e-02 5.08806407e-03 1.33102447e-02] [ 6.21683928e-03 1.43189463e-05 1.01287022e-03] [-7.48760357e-03 -1.31733417e-02 -1.42047235e-02] [-1.44702118e-02 -5.08806582e-03 1.33102442e-02] [-6.21685710e-03 -1.43294638e-05 1.01287823e-03] [ 7.48759607e-03 1.31733463e-02 -1.42047267e-02] [ 9.78388640e-03 7.13778342e-03 -1.43456396e-02] [-9.78387328e-03 -7.13778292e-03 -1.43456239e-02] [-4.78072553e-03 9.49432214e-04 1.43077053e-02] [ 4.78073683e-03 -9.49425646e-04 1.43076940e-02]] Final stress: [ 7.44370962e-04 3.30596288e-04 7.49725041e-04 -2.06307813e-11 7.79155544e-12 5.17784962e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 0.08032367 0.04790488 0.0004553 ] [-0.08032367 -0.04790488 0.00045525] [ 0.09807848 0.01758885 -0.08265431] [-0.03314677 0.05364845 -0.00392294] [-0.05644188 -0.05539029 0.08218325] [-0.09807848 -0.01758889 -0.08265433] [ 0.03314683 -0.05364842 -0.00392297] [ 0.05644185 0.05539031 0.08218324] [ 0.0815957 0.0065513 -0.02292716] [-0.08159571 -0.0065513 -0.02292717] [-0.04242866 -0.08476902 0.02686595] [ 0.04242865 0.08476901 0.02686589]] Final stress: [ 2.65002499e-03 9.27893146e-03 1.18972902e-02 4.23760139e-11 -3.44353435e-11 -5.28763140e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-0.08032352 0.04790481 -0.00045528] [ 0.08032352 -0.04790481 -0.00045536] [ 0.09807916 -0.017589 0.08265402] [-0.0564424 0.05539078 -0.082183 ] [-0.03314688 -0.05364847 0.00392301] [-0.09807916 0.01758908 0.08265405] [ 0.05644234 -0.05539082 -0.08218297] [ 0.03314694 0.05364844 0.00392304] [-0.04242874 0.08476898 -0.02686562] [ 0.04242874 -0.08476898 -0.02686553] [ 0.08159563 -0.00655142 0.02292682] [-0.08159562 0.00655141 0.02292683]] Final stress: [2.65005627e-03 9.27896691e-03 1.18973155e-02 4.40748822e-11 4.09196560e-11 5.28763449e-03] Minimization converged after 4 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.72976299e-02 -1.97935201e-03 -4.16359324e-05] [-1.72976299e-02 1.97935200e-03 4.16357679e-05] [ 5.96878575e-02 1.74882095e-12 -7.45323927e-12] [-5.21542993e-03 -5.00115346e-02 3.55793946e-02] [-5.21543021e-03 5.00115347e-02 -3.55793945e-02] [ 7.79691710e-02 -4.78917736e-12 -9.22936131e-12] [-1.10951470e-02 -3.89876604e-02 -3.06233030e-02] [-1.10951468e-02 3.89876603e-02 3.06233030e-02] [-1.93276592e-02 7.60047059e-03 -1.42096791e-02] [-1.58926482e-02 1.61233005e-02 -1.41342246e-02] [-1.93276592e-02 -7.60047048e-03 1.42096791e-02] [-1.58926482e-02 -1.61233006e-02 1.41342246e-02]] Final stress: [-3.06284693e-04 -6.10534553e-04 6.03320663e-04 -2.54302615e-03 -7.49384166e-14 5.82391143e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.72996604e-02 -1.97979870e-03 4.16511783e-05] [ 1.72996604e-02 1.97979870e-03 -4.16508634e-05] [-7.79821059e-02 4.93839223e-11 -3.20424813e-11] [ 1.10983335e-02 3.89961269e-02 -3.06259565e-02] [ 1.10983337e-02 -3.89961271e-02 3.06259564e-02] [-5.96989230e-02 1.05815261e-10 4.35164548e-11] [ 5.21862596e-03 5.00206480e-02 3.55832251e-02] [ 5.21862610e-03 -5.00206481e-02 -3.55832250e-02] [ 1.58939433e-02 -1.61242326e-02 -1.41394064e-02] [ 1.93299511e-02 -7.59937906e-03 -1.42148915e-02] [ 1.58939433e-02 1.61242325e-02 1.41394061e-02] [ 1.93299511e-02 7.59937914e-03 1.42148915e-02]] Final stress: [-3.06297933e-04 -6.10622313e-04 6.03494619e-04 2.54335871e-03 1.12854258e-13 -1.83264618e-13] Minimization converged after 42 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.49214005e-12 1.92563624e-02 9.76922964e-11] [-3.68138467e-12 1.53064728e-02 -2.42441579e-10] [-5.27804315e-03 3.37094459e-02 3.80865194e-02] [ 4.87302964e-02 -5.00613031e-02 -2.16774228e-02] [-4.02002362e-02 -3.61212295e-02 -1.67265510e-02] [ 5.27804314e-03 3.37094460e-02 -3.80865194e-02] [ 4.02002361e-02 -3.61212296e-02 1.67265511e-02] [-4.87302963e-02 -5.00613031e-02 2.16774229e-02] [ 1.35752241e-02 2.18443394e-02 -1.42516768e-02] [ 1.01499038e-02 1.33473297e-02 -1.40093607e-02] [-1.01499038e-02 1.33473297e-02 1.40093609e-02] [-1.35752241e-02 2.18443394e-02 1.42516767e-02]] Final stress: [-6.09815852e-04 -3.06195791e-04 6.01934106e-04 -1.35785441e-14 -2.54037185e-03 1.75514735e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.73801358e-12 -1.53112021e-02 -4.05454053e-11] [ 8.82618918e-12 -1.92637567e-02 1.30374796e-10] [-5.27823005e-03 -3.37340496e-02 -3.80975912e-02] [-4.02250379e-02 3.61403047e-02 1.67304920e-02] [ 4.87581026e-02 5.00836015e-02 2.16848827e-02] [ 5.27823007e-03 -3.37340497e-02 3.80975912e-02] [-4.87581025e-02 5.00836015e-02 -2.16848827e-02] [ 4.02250377e-02 3.61403048e-02 -1.67304921e-02] [-1.01481736e-02 -1.33496706e-02 -1.40247398e-02] [-1.35764686e-02 -2.18527066e-02 -1.42673092e-02] [ 1.35764686e-02 -2.18527066e-02 1.42673092e-02] [ 1.01481736e-02 -1.33496705e-02 1.40247399e-02]] Final stress: [-6.10078410e-04 -3.06235940e-04 6.02452958e-04 -1.35968784e-13 2.54136542e-03 -7.16854374e-14] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.67143846e-02 8.97360949e-04 5.24655214e-05] [-1.67143847e-02 -8.97360963e-04 5.24656767e-05] [-1.24132360e-02 5.41688742e-05 -9.19874672e-03] [-6.25976573e-04 -1.38587023e-02 1.60161941e-03] [ 2.68602378e-03 1.96583337e-02 7.49337995e-03] [ 1.24132360e-02 -5.41679688e-05 -9.19874637e-03] [ 6.25978063e-04 1.38587032e-02 1.60161876e-03] [-2.68602210e-03 -1.96583347e-02 7.49338068e-03] [-4.14240996e-03 1.81208862e-04 -1.17302239e-03] [ 4.14240830e-03 -1.81208854e-04 -1.17302220e-03] [-5.52928028e-03 -6.48097555e-03 1.22430369e-03] [ 5.52927884e-03 6.48097469e-03 1.22430399e-03]] Final stress: [-8.49376710e-04 -8.27008509e-04 -3.26703150e-04 2.67784247e-12 -4.76068326e-13 -5.74927927e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.67076551e-02 8.96826818e-04 -5.24465336e-05] [ 1.67076550e-02 -8.96826739e-04 -5.24464828e-05] [-1.24099193e-02 -5.42059976e-05 9.19713902e-03] [ 2.68431307e-03 -1.96529237e-02 -7.49206050e-03] [-6.27152268e-04 1.38541643e-02 -1.60143059e-03] [ 1.24099193e-02 5.42035727e-05 9.19713808e-03] [-2.68431351e-03 1.96529234e-02 -7.49206038e-03] [ 6.27153585e-04 -1.38541650e-02 -1.60143001e-03] [-5.52925514e-03 6.47888627e-03 -1.22362317e-03] [ 5.52925510e-03 -6.47888446e-03 -1.22362326e-03] [-4.14231537e-03 -1.80306795e-04 1.17242195e-03] [ 4.14231460e-03 1.80308366e-04 1.17242187e-03]] Final stress: [-8.49086432e-04 -8.26789380e-04 -3.26709501e-04 6.37625456e-13 2.43427910e-12 5.74695999e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.42481930e-02 -1.67119673e-02 -1.39088494e-03] [ 6.42481930e-02 1.67119673e-02 1.39088481e-03] [-1.74035070e-01 -3.31284544e-11 9.80720274e-12] [-1.88458581e-02 1.69037699e-02 -1.86142712e-02] [-1.88458581e-02 -1.69037699e-02 1.86142712e-02] [-4.42969342e-02 2.30098126e-11 1.30568287e-11] [-4.74180892e-02 6.71731815e-02 2.66421893e-02] [-4.74180891e-02 -6.71731815e-02 -2.66421893e-02] [ 3.99298765e-02 2.01480364e-01 -1.13393721e-02] [ 7.12518796e-02 2.72483859e-01 -1.21472248e-02] [ 3.99298765e-02 -2.01480364e-01 1.13393721e-02] [ 7.12518796e-02 -2.72483859e-01 1.21472249e-02]] Final stress: [-1.38858732e-03 -3.45702554e-03 1.91958905e-03 -4.71771437e-03 1.84061110e-14 4.25101792e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.42470274e-02 -1.67117514e-02 1.39085731e-03] [-6.42470274e-02 1.67117514e-02 -1.39085725e-03] [ 4.42958181e-02 -3.27329958e-11 1.24538877e-11] [ 4.74180959e-02 -6.71718984e-02 2.66412572e-02] [ 4.74180957e-02 6.71718986e-02 -2.66412570e-02] [ 1.74032500e-01 -6.68736794e-11 -3.03686114e-11] [ 1.88460708e-02 -1.69028460e-02 -1.86133950e-02] [ 1.88460707e-02 1.69028460e-02 1.86133950e-02] [-7.12514410e-02 -2.72484524e-01 -1.21470194e-02] [-3.99298575e-02 -2.01481902e-01 -1.13391667e-02] [-7.12514410e-02 2.72484524e-01 1.21470195e-02] [-3.99298575e-02 2.01481902e-01 1.13391665e-02]] Final stress: [-1.38857659e-03 -3.45698812e-03 1.91956399e-03 4.71767018e-03 -2.54342221e-14 3.16511696e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.16945307e-02 -1.69393842e-02 1.58408414e-04] [ 1.21872006e-02 -1.69421742e-02 -1.58410745e-04] [-1.37610723e-02 2.07770539e-02 4.10699538e-03] [ 2.60725006e-02 -6.42900012e-02 4.57204309e-03] [-1.48366574e-02 3.41550934e-02 -7.88409535e-03] [ 5.61661649e-02 2.50971070e-02 -1.08006985e-02] [-1.20145459e-02 6.00596913e-03 -1.22115861e-03] [-4.66821080e-02 -1.66899830e-02 1.12269209e-02] [ 3.83127417e-02 3.77328193e-02 5.90703265e-04] [ 1.91966339e-02 4.86028572e-02 -1.70054911e-04] [-5.27211948e-02 -3.42190090e-02 5.87783603e-05] [-3.36141939e-02 -2.32903484e-02 -4.79431347e-04]] Final stress: [-2.09250312e-03 -2.09238037e-03 -7.63761362e-05 -2.41032023e-03 -2.41032491e-03 -3.27842064e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.21871966e-02 1.69421820e-02 1.58411155e-04] [ 2.16945504e-02 1.69393920e-02 -1.58409575e-04] [-1.37611311e-02 -2.07771318e-02 -4.10698868e-03] [-1.48367324e-02 -3.41551652e-02 7.88409064e-03] [ 2.60724746e-02 6.42900077e-02 -4.57204747e-03] [ 5.61661577e-02 -2.50971760e-02 1.08007068e-02] [-4.66821925e-02 1.66899356e-02 -1.12269235e-02] [-1.20146135e-02 -6.00602812e-03 1.22115588e-03] [-5.27214146e-02 3.42193622e-02 -5.87718569e-05] [-3.36143628e-02 2.32906870e-02 4.79440469e-04] [ 3.83131129e-02 -3.77330066e-02 -5.90711802e-04] [ 1.91969547e-02 -4.86030587e-02 1.70047993e-04]] Final stress: [-2.09250461e-03 -2.09238186e-03 -7.63746510e-05 -2.41032151e-03 2.41032619e-03 3.27842779e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.16945386e-02 -1.69393873e-02 -1.58409929e-04] [-1.21871990e-02 -1.69421773e-02 1.58411753e-04] [-5.61661620e-02 2.50971345e-02 1.08007018e-02] [ 4.66821417e-02 -1.66899641e-02 -1.12269220e-02] [ 1.20145729e-02 6.00599271e-03 1.22115753e-03] [ 1.37610958e-02 2.07770848e-02 -4.10699278e-03] [ 1.48366875e-02 3.41551222e-02 7.88409339e-03] [-2.60724901e-02 -6.42900039e-02 -4.57204481e-03] [ 3.36142612e-02 -2.32904835e-02 4.79435552e-04] [ 5.27212826e-02 -3.42191500e-02 -5.87761657e-05] [-1.91967621e-02 4.86029377e-02 1.70051795e-04] [-3.83128899e-02 3.77328941e-02 -5.90706202e-04]] Final stress: [-2.09250372e-03 -2.09238096e-03 -7.63755431e-05 2.41032074e-03 -2.41032542e-03 3.27842350e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.21871957e-02 1.69421835e-02 -1.58412051e-04] [-2.16945544e-02 1.69393935e-02 1.58409228e-04] [-5.61661563e-02 -2.50971905e-02 -1.08007082e-02] [ 1.20146280e-02 -6.00603946e-03 -1.22115494e-03] [ 4.66822089e-02 1.66899263e-02 1.12269243e-02] [ 1.37611429e-02 -2.07771470e-02 4.10698746e-03] [-2.60724696e-02 6.42900089e-02 4.57204844e-03] [ 1.48367475e-02 -3.41551797e-02 -7.88408965e-03] [-1.91970190e-02 -4.86030992e-02 -1.70046320e-04] [-3.83131876e-02 -3.77330442e-02 5.90713391e-04] [ 3.36143968e-02 2.32907549e-02 -4.79442129e-04] [ 5.27214585e-02 3.42194330e-02 5.87705003e-05]] Final stress: [-2.09250491e-03 -2.09238216e-03 -7.63743534e-05 2.41032177e-03 2.41032644e-03 -3.27842923e-04] Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 67 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.55899696e-12 -4.75662302e-02 -1.40199713e-11] [-3.86745765e-12 -8.09359679e-02 -2.31993464e-10] [-1.70634676e-02 8.09163907e-03 -2.84803030e-02] [-1.57447356e-02 3.80152748e-02 6.71084044e-03] [ 6.88372427e-02 1.29328804e-01 1.46812589e-02] [ 1.70634676e-02 8.09163920e-03 2.84803030e-02] [-6.88372427e-02 1.29328804e-01 -1.46812589e-02] [ 1.57447358e-02 3.80152747e-02 -6.71084036e-03] [ 2.52481835e-01 -2.04410731e-02 -1.47094549e-02] [ 2.21471677e-01 -9.07435460e-02 -8.77602324e-03] [-2.21471677e-01 -9.07435460e-02 8.77602341e-03] [-2.52481835e-01 -2.04410731e-02 1.47094549e-02]] Final stress: [-3.45461026e-03 -1.39098993e-03 1.91959589e-03 9.28694148e-15 -4.71769514e-03 -8.57617985e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.26957181e-12 8.09345866e-02 -3.77049020e-11] [ 3.03597849e-12 4.75652797e-02 8.67647893e-11] [-1.70634301e-02 -8.09239574e-03 2.84792145e-02] [ 6.88358602e-02 -1.29327136e-01 -1.46807538e-02] [-1.57439048e-02 -3.80145624e-02 -6.71039088e-03] [ 1.70634301e-02 -8.09239572e-03 -2.84792145e-02] [ 1.57439049e-02 -3.80145624e-02 6.71039084e-03] [-6.88358602e-02 -1.29327137e-01 1.46807538e-02] [-2.21472986e-01 9.07428901e-02 -8.77587571e-03] [-2.52482732e-01 2.04412713e-02 -1.47091918e-02] [ 2.52482732e-01 2.04412713e-02 1.47091917e-02] [ 2.21472986e-01 9.07428902e-02 8.77587575e-03]] Final stress: [-3.45457290e-03 -1.39097914e-03 1.91957083e-03 -1.07264790e-13 4.71765095e-03 -4.50897805e-14] Minimization converged after 65 steps. Minimization converged after 67 steps. Minimization converged after 66 steps. Minimization converged after 65 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-0.00070552 0.00060284 -0.00025579] [ 0.00070552 -0.00060284 -0.00025579] [ 0.01684696 -0.00510284 0.00036328] [-0.01469006 0.01862402 -0.00048755] [-0.00268085 -0.00671076 0.00030375] [-0.01684696 0.00510284 0.00036328] [ 0.01469006 -0.01862402 -0.00048755] [ 0.00268085 0.00671076 0.00030375] [-0.00085633 0.0031645 0.01163336] [ 0.00085634 -0.0031645 0.01163336] [ 0.00063157 0.00011479 -0.01155705] [-0.00063157 -0.00011479 -0.01155705]] Final stress: [ 9.63379727e-04 1.05693190e-03 4.44461138e-04 1.69848697e-12 1.20948437e-12 -4.04665068e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 0.00070078 0.00059706 0.00025489] [-0.00070078 -0.00059706 0.00025489] [ 0.01678463 0.00508487 -0.00036229] [-0.00261605 0.00671958 -0.00027837] [-0.01458786 -0.0185977 0.0004618 ] [-0.01678463 -0.00508487 -0.00036229] [ 0.00261605 -0.00671958 -0.00027837] [ 0.01458786 0.0185977 0.0004618 ] [ 0.0006796 -0.00013009 0.01152327] [-0.0006796 0.00013009 0.01152327] [-0.00080448 -0.0031369 -0.01159929] [ 0.00080448 0.0031369 -0.01159929]] Final stress: [9.59785739e-04 1.05363444e-03 4.42504133e-04 9.17950559e-13 4.20389138e-13 4.03206702e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.24972543e-09 4.91722997e-03 -1.64647922e-08] [ 1.34670317e-09 -4.91722886e-03 -2.37782344e-07] [-1.37279988e-03 -1.97293053e-08 8.09035028e-09] [-7.08983957e-04 1.79843607e-03 -3.16902401e-03] [-7.09032563e-04 -1.79840810e-03 3.16904643e-03] [ 1.37279968e-03 8.75797253e-08 3.72028014e-08] [ 7.08869073e-04 -1.79850321e-03 -3.16897015e-03] [ 7.09090980e-04 1.79837592e-03 3.16907519e-03] [ 8.70961945e-04 -5.45553621e-04 -1.04618439e-03] [-8.70931219e-04 5.45562043e-04 -1.04602167e-03] [ 8.70952556e-04 5.45592045e-04 1.04616662e-03] [-8.70929207e-04 -5.45570106e-04 1.04612093e-03]] Final stress: [-5.07440793e-05 2.24444682e-04 8.84812614e-05 -4.68510551e-11 2.92195538e-11 9.78801200e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 5.11513609e-11 -5.49971142e-03 -5.38375300e-09] [-6.01928396e-10 5.49970881e-03 -2.79188167e-07] [ 1.34987749e-03 -1.37097643e-08 6.37343101e-09] [ 6.38251326e-04 -1.70799112e-03 3.47498931e-03] [ 6.38183019e-04 1.70802988e-03 -3.47495707e-03] [-1.34987820e-03 1.44342220e-07 5.90400111e-08] [-6.38302436e-04 1.70795959e-03 3.47501520e-03] [-6.38141469e-04 -1.70805355e-03 -3.47493607e-03] [-1.20781698e-03 2.73196979e-04 9.34258890e-04] [ 1.20781338e-03 -2.73234739e-04 9.34439867e-04] [-1.20780490e-03 -2.73245582e-04 -9.34257157e-04] [ 1.20781932e-03 2.73210507e-04 -9.34333820e-04]] Final stress: [ 9.64880681e-05 -2.30752045e-04 -2.93753068e-05 -6.59203186e-12 -6.34126471e-11 -5.12689302e-11] Minimization converged after 2 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-8.44345927e-10 1.81612522e-03 1.21749282e-08] [-8.95709971e-10 -1.81612468e-03 1.35384011e-07] [-5.01252706e-04 3.54565348e-08 -1.56031879e-08] [-1.68503979e-04 5.39082265e-04 -1.15764175e-03] [-1.68421465e-04 -5.39129640e-04 1.15760132e-03] [ 5.01252601e-04 -1.54529280e-08 -6.90106845e-09] [ 1.68496130e-04 -5.39085828e-04 -1.15763738e-03] [ 1.68476187e-04 5.39097445e-04 1.15762657e-03] [ 4.26223087e-04 1.28805562e-04 1.70878046e-04] [-4.26243709e-04 -1.28792306e-04 1.70840104e-04] [ 4.26222176e-04 -1.28801868e-04 -1.70934989e-04] [-4.26246581e-04 1.28803821e-04 -1.70856981e-04]] Final stress: [-4.38852759e-06 9.84417903e-05 1.11794513e-04 3.83109509e-11 1.33526914e-11 -1.64451584e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 6.81494861e-10 1.69887022e-03 -9.59915436e-09] [-7.22569365e-11 -1.69887002e-03 1.22500311e-07] [-2.72661276e-04 2.53230692e-08 -1.03889747e-08] [-6.62371662e-05 8.75606489e-04 -1.12172747e-03] [-6.62202268e-05 -8.75616591e-04 1.12171838e-03] [ 2.72661923e-04 -4.81565900e-08 -1.97832898e-08] [ 6.62406028e-05 -8.75604049e-04 -1.12172975e-03] [ 6.61939605e-05 8.75631429e-04 1.12170619e-03] [ 6.60613507e-04 1.77591884e-04 -1.14253501e-03] [-6.60602061e-04 -1.77591821e-04 -1.14260963e-03] [ 6.60608708e-04 -1.77571644e-04 1.14252245e-03] [-6.60598581e-04 1.77576944e-04 1.14257211e-03]] Final stress: [-1.13166113e-05 7.99159028e-05 -2.90389948e-05 -1.73661104e-11 4.28609151e-12 7.33813886e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.51599427e-10 -3.89500603e-03 8.70700001e-09] [ 1.39347478e-10 3.89500609e-03 2.79386342e-08] [-3.01170750e-03 1.01349842e-08 -4.30087535e-09] [ 2.63311262e-03 -4.25048061e-03 2.46440617e-03] [ 2.63313901e-03 4.25046549e-03 -2.46441863e-03] [ 3.01170746e-03 -4.55546290e-09 -1.93828934e-09] [-2.63311795e-03 4.25047765e-03 2.46440873e-03] [-2.63313180e-03 -4.25046974e-03 -2.46441520e-03] [-8.14695990e-04 -1.29386994e-04 3.10386363e-04] [ 8.14695241e-04 1.29387971e-04 3.10381636e-04] [-8.14695208e-04 1.29383701e-04 -3.10396476e-04] [ 8.14694118e-04 -1.29383106e-04 -3.10383005e-04]] Final stress: [-9.25713448e-05 -4.15619879e-04 -2.60102033e-05 1.34477525e-12 9.03731975e-13 -1.68428026e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.36970213e-10 -1.10443732e-03 2.15732772e-08] [-1.51813007e-11 1.10443550e-03 2.61974546e-07] [ 2.67819318e-04 5.76978046e-08 -2.30508995e-08] [ 6.04692975e-05 -3.60727910e-04 6.46384049e-04] [ 6.05024950e-05 3.60707910e-04 -6.46400996e-04] [-2.67818560e-04 -1.01660977e-07 -4.27567740e-08] [-6.03840488e-05 3.60777475e-04 6.46343500e-04] [-6.05872604e-05 -3.60660532e-04 -6.46440922e-04] [-3.22925715e-04 -3.94134951e-05 -5.58468388e-05] [ 3.22918625e-04 3.93880887e-05 -5.60124633e-05] [-3.22921951e-04 3.93988044e-05 5.58476642e-05] [ 3.22927678e-04 -3.94245630e-05 5.59082665e-05]] Final stress: [-4.29386613e-06 -5.62764647e-05 -8.57227200e-05 7.07773304e-13 -4.24176051e-11 4.55159356e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-5.72489431e-03 1.44364872e-02 -4.68556511e-04] [-5.72489431e-03 -1.44364872e-02 4.68556225e-04] [ 3.23869602e-02 -8.15432212e-11 3.58451478e-11] [-1.95197552e-03 -1.87090560e-02 1.86739869e-02] [-1.95197564e-03 1.87090560e-02 -1.86739868e-02] [ 4.11410768e-04 5.42375959e-11 2.13598943e-11] [-3.00126762e-03 -2.83126558e-03 -4.53323228e-03] [-3.00126761e-03 2.83126557e-03 4.53323228e-03] [-4.77840675e-04 -5.83538480e-03 -1.27492587e-02] [-5.24320730e-03 -6.38115701e-03 -1.33555607e-02] [-4.77840658e-04 5.83538476e-03 1.27492589e-02] [-5.24320729e-03 6.38115701e-03 1.33555607e-02]] Final stress: [-9.69026355e-05 1.22802838e-04 3.38290120e-04 -1.20066610e-03 -3.08573897e-14 -9.40011581e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 5.72517582e-03 1.44372167e-02 4.68587687e-04] [ 5.72517582e-03 -1.44372167e-02 -4.68587678e-04] [-4.11336145e-04 1.15702542e-10 -4.21637529e-11] [ 3.00136509e-03 2.83141532e-03 -4.53345376e-03] [ 3.00136519e-03 -2.83141537e-03 4.53345372e-03] [-3.23893189e-02 -7.45981773e-11 -3.25123297e-11] [ 1.95209650e-03 1.87103240e-02 1.86748459e-02] [ 1.95209683e-03 -1.87103242e-02 -1.86748457e-02] [ 5.24390073e-03 6.38168984e-03 -1.33563597e-02] [ 4.77789209e-04 5.83590615e-03 -1.27500137e-02] [ 5.24390068e-03 -6.38168958e-03 1.33563596e-02] [ 4.77789225e-04 -5.83590621e-03 1.27500138e-02]] Final stress: [-9.69046339e-05 1.22809699e-04 3.38312551e-04 1.20072128e-03 1.38357764e-13 6.95396767e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.02018294e-14 2.09713571e-02 -1.69980584e-10] [-1.20522187e-12 -9.75498770e-03 -1.72715227e-10] [ 1.69137262e-02 7.46130282e-03 1.34272823e-02] [ 1.24866012e-02 -1.75522366e-02 9.29229148e-05] [-1.05060405e-02 -1.14185534e-03 -1.23156452e-02] [-1.69137262e-02 7.46130286e-03 -1.34272823e-02] [ 1.05060403e-02 -1.14185548e-03 1.23156453e-02] [-1.24866010e-02 -1.75522367e-02 -9.29227822e-05] [-2.80830481e-03 4.84944468e-03 -1.29359623e-02] [-9.39031409e-03 7.75159846e-04 -1.31031043e-02] [ 9.39031403e-03 7.75159972e-04 1.31031043e-02] [ 2.80830483e-03 4.84944455e-03 1.29359624e-02]] Final stress: [-1.60783101e-04 1.86589931e-04 3.37361627e-04 -6.45806869e-15 -1.20440220e-03 5.24682305e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.15453335e-12 9.75179558e-03 2.04778484e-10] [ 3.75733352e-12 -2.09657536e-02 -2.24862047e-10] [ 1.69064346e-02 -7.45876591e-03 -1.34247226e-02] [-1.05025772e-02 1.14267596e-03 1.23136017e-02] [ 1.24830962e-02 1.75444884e-02 -9.35214811e-05] [-1.69064345e-02 -7.45876601e-03 1.34247226e-02] [-1.24830962e-02 1.75444884e-02 9.35215188e-05] [ 1.05025770e-02 1.14267604e-03 -1.23136017e-02] [ 9.38631099e-03 -7.72856688e-04 -1.31019381e-02] [ 2.81046084e-03 -4.84856274e-03 -1.29342533e-02] [-2.81046074e-03 -4.84856268e-03 1.29342536e-02] [-9.38631088e-03 -7.72856695e-04 1.31019379e-02]] Final stress: [-1.60749200e-04 1.86572668e-04 3.37311783e-04 -1.63800096e-13 1.20419688e-03 1.18808579e-13] Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.36802291e-02 -6.31239278e-03 -8.74286948e-05] [-1.36802284e-02 6.31240397e-03 -8.64021661e-05] [-1.24499050e-03 4.61083767e-03 -1.24015703e-02] [-7.49758649e-03 -5.77634196e-03 6.37836258e-03] [-5.56264990e-03 1.88502909e-02 6.12720915e-03] [ 1.24499219e-03 -4.61091219e-03 -1.24015985e-02] [ 7.49765453e-03 5.77638579e-03 6.37832924e-03] [ 5.56269170e-03 -1.88503204e-02 6.12722730e-03] [-1.20271951e-02 6.32290940e-03 7.43016940e-03] [ 1.20271451e-02 -6.32287116e-03 7.42966358e-03] [-8.16086185e-03 -1.73841617e-03 -7.44721099e-03] [ 8.16079966e-03 1.73842688e-03 -7.44675064e-03]] Final stress: [-6.65674442e-07 -5.68057365e-04 -1.12641892e-04 8.93596532e-11 7.35583200e-11 -3.95582295e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.36713110e-02 -6.30801904e-03 8.73969230e-05] [ 1.36713038e-02 6.30801776e-03 8.67262570e-05] [-1.24608995e-03 -4.61905076e-03 1.24030384e-02] [-5.56882631e-03 -1.88385984e-02 -6.12690486e-03] [-7.48914481e-03 5.77367908e-03 -6.38009867e-03] [ 1.24608689e-03 4.61886785e-03 1.24029575e-02] [ 5.56924613e-03 1.88388363e-02 -6.12710079e-03] [ 7.48886243e-03 -5.77351700e-03 -6.38023566e-03] [-8.16290910e-03 1.73977271e-03 7.46746863e-03] [ 8.16281905e-03 -1.73986375e-03 7.46756693e-03] [-1.20261809e-02 -6.31937252e-03 -7.45014123e-03] [ 1.20261438e-02 6.31924781e-03 -7.45067337e-03]] Final stress: [-5.03353100e-07 -5.67688304e-04 -1.12934579e-04 9.28756343e-11 -1.43604872e-10 3.95380531e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 7.38136496e-11 -5.12200297e-03 -3.50916728e-08] [ 5.59957691e-10 5.12200191e-03 -1.09771820e-07] [ 2.84788249e-03 -4.69161134e-08 1.86038686e-08] [-1.43081833e-04 -2.64969931e-04 3.26936410e-03] [-1.43137967e-04 2.65002621e-04 -3.26933777e-03] [-2.84788244e-03 8.54267117e-08 3.39190188e-08] [ 1.43063097e-04 2.64958318e-04 3.26937316e-03] [ 1.43131279e-04 -2.64998652e-04 -3.26934012e-03] [-1.06163593e-03 2.79520152e-04 -1.07196477e-03] [ 1.06164460e-03 -2.79538127e-04 -1.07191812e-03] [-1.06162520e-03 -2.79563885e-04 1.07196971e-03] [ 1.06164127e-03 2.79552054e-04 1.07194615e-03]] Final stress: [ 2.38383816e-04 -6.16330011e-05 9.00434242e-05 -2.04752485e-11 -2.53360308e-11 -1.19703226e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.14171050e-09 5.25476093e-03 4.83405744e-08] [-9.00768973e-10 -5.25475803e-03 -6.07981865e-08] [-3.06779911e-03 8.65503249e-08 -3.73277499e-08] [ 7.47788740e-05 5.31509538e-04 -3.37102038e-03] [ 7.50128773e-05 -5.31643613e-04 3.37090896e-03] [ 3.06779794e-03 1.01144001e-07 4.31038767e-08] [-7.49789764e-05 -5.31624089e-04 -3.37092367e-03] [-7.47412226e-05 5.31487613e-04 3.37103726e-03] [ 9.79402904e-04 -5.41518058e-04 9.19311485e-04] [-9.79427368e-04 5.41566549e-04 9.19522747e-04] [ 9.79394649e-04 5.41552087e-04 -9.19469236e-04] [-9.79438526e-04 -5.41520619e-04 -9.19360487e-04]] Final stress: [-2.16492513e-04 8.30782003e-05 -2.93475577e-05 5.55209987e-11 7.79026854e-11 -2.47035217e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.17155285e-10 -1.83408607e-03 -1.00808917e-10] [ 2.68172817e-10 1.83408568e-03 8.60734981e-08] [ 8.64497614e-04 2.55191273e-08 -1.14639578e-08] [-4.50289198e-05 -1.77135908e-04 1.16031003e-03] [-4.49912181e-05 1.77114069e-04 -1.16033009e-03] [-8.64497272e-04 1.60081766e-08 5.57757047e-09] [ 4.49979105e-05 1.77118153e-04 1.16032484e-03] [ 4.50129046e-05 -1.77127028e-04 -1.16031924e-03] [-4.63976435e-04 -1.69524715e-04 1.73907699e-04] [ 4.63979454e-04 1.69518421e-04 1.73889444e-04] [-4.63974703e-04 1.69517807e-04 -1.73962838e-04] [ 4.63980279e-04 -1.69521939e-04 -1.73899932e-04]] Final stress: [ 9.99208424e-05 -5.78219777e-06 1.11756243e-04 -7.54647466e-12 -9.21120067e-12 -6.74725115e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.38357717e-10 -2.48772369e-03 3.90001430e-08] [ 3.19874627e-10 2.48772396e-03 1.40945009e-07] [ 1.68193993e-03 4.54038930e-08 -1.91990339e-08] [-6.39164122e-04 -1.76050786e-04 1.70156463e-03] [-6.39058481e-04 1.75990132e-04 -1.70161478e-03] [-1.68193968e-03 -3.42802409e-08 -1.43788541e-08] [ 6.39149541e-04 1.76042901e-04 1.70157151e-03] [ 6.39077027e-04 -1.76001192e-04 -1.70160597e-03] [-1.07039232e-03 -2.87788962e-04 -2.04164208e-03] [ 1.07039118e-03 2.87793323e-04 -2.04167932e-03] [-1.07039068e-03 2.87781652e-04 2.04160049e-03] [ 1.07038762e-03 -2.87778455e-04 2.04165916e-03]] Final stress: [ 1.14187270e-04 -2.35770985e-05 -6.87047129e-06 3.43879409e-12 6.11815580e-12 -4.60154488e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.22581961e-11 3.50655690e-03 -2.14688245e-09] [-4.64434186e-11 -3.50655689e-03 2.68310518e-08] [-5.55147750e-03 3.89746568e-09 -1.60800909e-09] [ 1.58572881e-03 -2.89255327e-03 -2.25350866e-03] [ 1.58573676e-03 2.89254872e-03 2.25350495e-03] [ 5.55147760e-03 -9.10425138e-09 -3.74661808e-09] [-1.58572545e-03 2.89255536e-03 -2.25351033e-03] [-1.58574175e-03 -2.89254585e-03 2.25350255e-03] [ 5.82608635e-04 -1.54101789e-04 3.08489860e-04] [-5.82607848e-04 1.54101745e-04 3.08472914e-04] [ 5.82608774e-04 1.54101408e-04 -3.08490511e-04] [-5.82608018e-04 -1.54101114e-04 -3.08480090e-04]] Final stress: [-3.77207211e-04 -9.74013260e-05 -2.00430206e-05 -9.63023063e-13 5.41105619e-14 -1.95802103e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 7.88878074e-10 1.07199407e-03 -3.06352825e-08] [ 1.40232863e-09 -1.07199075e-03 4.23447560e-07] [-6.14771040e-04 9.08516053e-08 -4.10131198e-08] [ 1.67804335e-04 2.19981557e-04 -5.93883457e-04] [ 1.68095562e-04 -2.20148035e-04 5.93742976e-04] [ 6.14773389e-04 -2.89646430e-08 -1.27751075e-08] [-1.67981943e-04 -2.20081764e-04 -5.93801078e-04] [-1.67994113e-04 2.20089270e-04 5.93792258e-04] [ 3.56863127e-04 5.80390369e-05 -9.83423778e-05] [-3.56815653e-04 -5.80010601e-05 -9.84722726e-05] [ 3.56857867e-04 -5.80185024e-05 9.81637822e-05] [-3.56833722e-04 5.80742895e-05 9.84611452e-05]] Final stress: [-5.67899359e-05 -3.43768882e-06 -8.48932021e-05 -5.91328053e-11 8.04739419e-11 -1.10160591e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-5.59999306e-03 -1.53642019e-02 4.55964495e-04] [-5.59999306e-03 1.53642019e-02 -4.55964479e-04] [ 1.29932366e-04 -8.27738622e-11 3.77599870e-11] [-3.87665942e-03 -1.46640825e-03 5.10124638e-03] [-3.87665966e-03 1.46640839e-03 -5.10124626e-03] [ 3.16494498e-02 -1.54368326e-10 -5.88140351e-11] [-9.01385846e-04 -1.99106339e-02 -1.73977199e-02] [-9.01385971e-04 1.99106340e-02 1.73977199e-02] [-5.99407706e-03 -8.15550351e-03 -1.33058207e-02] [ 4.82424470e-04 -4.03180394e-03 -1.26855507e-02] [-5.99407709e-03 8.15550359e-03 1.33058208e-02] [ 4.82424487e-04 4.03180389e-03 1.26855505e-02]] Final stress: [ 1.85969512e-04 -1.60429613e-04 3.36755165e-04 -1.20347983e-03 1.64840955e-14 2.57751740e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 5.59968847e-03 -1.53625813e-02 -4.55971176e-04] [ 5.59968848e-03 1.53625813e-02 4.55970701e-04] [-3.16443208e-02 1.52581853e-10 -6.21426739e-11] [ 9.00843934e-04 1.99078442e-02 -1.73972129e-02] [ 9.00844307e-04 -1.99078444e-02 1.73972128e-02] [-1.31608987e-04 4.38369504e-10 1.83195977e-10] [ 3.87683501e-03 1.46694405e-03 5.10065282e-03] [ 3.87683567e-03 -1.46694444e-03 -5.10065251e-03] [-4.81485484e-04 4.03139998e-03 -1.26865018e-02] [ 5.99208243e-03 8.15730226e-03 -1.33067666e-02] [-4.81485478e-04 -4.03140002e-03 1.26865015e-02] [ 5.99208242e-03 -8.15730220e-03 1.33067671e-02]] Final stress: [ 1.85989571e-04 -1.60420930e-04 3.36774939e-04 1.20345605e-03 -8.09013617e-15 -2.37015720e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-6.98689300e-12 -8.75770505e-03 -1.40928196e-10] [ 1.30828769e-12 2.01914136e-02 -7.71369842e-11] [-1.48323957e-02 9.78759136e-03 1.29356283e-02] [ 8.93622223e-03 -1.60867560e-03 -1.41209138e-02] [-1.10107195e-02 -1.95036294e-02 -8.19994146e-05] [ 1.48323957e-02 9.78759179e-03 -1.29356282e-02] [ 1.10107193e-02 -1.95036295e-02 8.19995012e-05] [-8.93622207e-03 -1.60867569e-03 1.41209139e-02] [-8.45837930e-03 2.51783049e-03 -1.31432808e-02] [-3.76626824e-03 3.09002872e-03 -1.29290328e-02] [ 3.76626830e-03 3.09002863e-03 1.29290327e-02] [ 8.45837930e-03 2.51783060e-03 1.31432808e-02]] Final stress: [ 1.22374396e-04 -9.67827358e-05 3.37789012e-04 -1.41716740e-14 -1.19968021e-03 -4.13999981e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.43473561e-13 -2.01932009e-02 -2.96668040e-10] [ 6.72992290e-13 8.75891290e-03 -4.83523473e-11] [-1.48356042e-02 -9.78830632e-03 -1.29362825e-02] [-1.10114823e-02 1.95062031e-02 8.22792953e-05] [ 8.93771689e-03 1.60812393e-03 1.41211653e-02] [ 1.48356042e-02 -9.78830586e-03 1.29362827e-02] [-8.93771717e-03 1.60812377e-03 -1.41211652e-02] [ 1.10114827e-02 1.95062028e-02 -8.22791189e-05] [ 3.76419972e-03 -3.08939269e-03 -1.29281849e-02] [ 8.45904804e-03 -2.51948403e-03 -1.31421960e-02] [-8.45904809e-03 -2.51948407e-03 1.31421958e-02] [-3.76419979e-03 -3.08939268e-03 1.29281850e-02]] Final stress: [ 1.22351908e-04 -9.67882676e-05 3.37768479e-04 1.03602884e-13 1.19969896e-03 -7.18357138e-14] Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.49337950e-02 8.03133213e-03 -8.72727537e-05] [-1.49337891e-02 -8.03132252e-03 -8.62888220e-05] [-7.46392962e-03 -7.74421838e-03 -8.25854744e-03] [-1.24606915e-02 -7.21371329e-03 -4.72058744e-03] [-1.47440293e-03 1.11906257e-02 1.30705383e-02] [ 7.46393678e-03 7.74428515e-03 -8.25851785e-03] [ 1.24604619e-02 7.21358113e-03 -4.72048389e-03] [ 1.47432134e-03 -1.11905805e-02 1.30705043e-02] [-8.57673775e-03 -6.35666256e-03 7.72206691e-03] [ 8.57688800e-03 6.35663058e-03 7.72165603e-03] [-5.35709357e-03 -1.09967658e-02 -7.72679098e-03] [ 5.35724146e-03 1.09968083e-02 -7.72627632e-03]] Final stress: [-4.96058432e-04 -8.66134446e-05 -1.12649237e-04 -2.40673022e-10 2.70419398e-11 -5.75339837e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.49396541e-02 8.03439657e-03 8.69935805e-05] [ 1.49396584e-02 -8.03438948e-03 8.62741934e-05] [-7.48480832e-03 7.77762010e-03 8.26033995e-03] [-1.43439956e-03 -1.11988214e-02 -1.30723792e-02] [-1.24931383e-02 7.16252849e-03 4.72050004e-03] [ 7.48480577e-03 -7.77737138e-03 8.26044512e-03] [ 1.43415673e-03 1.11986778e-02 -1.30722633e-02] [ 1.24933477e-02 -7.16264738e-03 4.72060100e-03] [-5.35017340e-03 1.09761339e-02 7.69250148e-03] [ 5.35018941e-03 -1.09761350e-02 7.69300894e-03] [-8.59808771e-03 6.34957740e-03 -7.68792590e-03] [ 8.59810339e-03 -6.34956964e-03 -7.68809584e-03]] Final stress: [-4.96036744e-04 -8.63362378e-05 -1.11911923e-04 -7.80640855e-12 3.90272404e-11 5.75588956e-04] Minimization converged after 5 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.31837026e-04 -8.42949850e-06 1.86584168e-08] [-9.31837027e-04 8.42949815e-06 -1.87280022e-08] [ 3.31128324e-03 3.47609584e-12 3.37359739e-13] [-3.92850739e-04 -3.84253067e-03 2.26649955e-03] [-3.92850834e-04 3.84253073e-03 -2.26649950e-03] [ 5.29622616e-03 -9.92919759e-12 -5.17745522e-12] [-1.40068050e-03 -2.16253818e-03 -2.23245427e-03] [-1.40068050e-03 2.16253819e-03 2.23245427e-03] [-7.82616536e-04 1.06462378e-03 -7.55363744e-04] [-7.95769857e-04 1.10551131e-03 -7.55345789e-04] [-7.82616536e-04 -1.06462377e-03 7.55363789e-04] [-7.95769843e-04 -1.10551137e-03 7.55345778e-04]] Final stress: [-4.30361353e-05 -4.41180035e-05 8.25782827e-05 -1.40155819e-04 -4.41395984e-14 1.37683839e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.31950659e-04 -8.43105974e-06 -1.87035480e-08] [ 9.31950659e-04 8.43105973e-06 1.87323206e-08] [-5.29672483e-03 -4.76179576e-12 1.66426293e-12] [ 1.40082270e-03 2.16265666e-03 -2.23265091e-03] [ 1.40082272e-03 -2.16265668e-03 2.23265090e-03] [-3.31148831e-03 -2.54732322e-11 -1.11070059e-11] [ 3.92847185e-04 3.84289856e-03 2.26670060e-03] [ 3.92847094e-04 -3.84289851e-03 -2.26670064e-03] [ 7.95819088e-04 -1.10576921e-03 -7.55595437e-04] [ 7.82666968e-04 -1.06487475e-03 -7.55613471e-04] [ 7.95819096e-04 1.10576919e-03 7.55595478e-04] [ 7.82666961e-04 1.06487477e-03 7.55613462e-04]] Final stress: [-4.30454830e-05 -4.41275775e-05 8.25786304e-05 1.40170119e-04 -1.47311768e-15 -8.28271535e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.68342885e-03 -3.56737764e-05 -2.03071765e-07] [ 2.68342885e-03 3.56737780e-05 2.03153287e-07] [ 8.95351366e-03 1.51572043e-11 -5.83321326e-12] [-3.24907376e-03 2.76740122e-03 7.67997420e-04] [-3.24907375e-03 -2.76740122e-03 -7.67997421e-04] [-2.30052233e-03 -1.55738689e-11 -9.11913678e-12] [ 2.53632220e-03 -7.02027229e-03 -7.45166504e-04] [ 2.53632221e-03 7.02027228e-03 7.45166503e-04] [-2.72305767e-03 6.35345941e-04 3.38685510e-03] [-2.57411529e-03 7.44587351e-04 3.38710216e-03] [-2.72305768e-03 -6.35345922e-04 -3.38685513e-03] [-2.57411529e-03 -7.44587370e-04 -3.38710219e-03]] Final stress: [ 3.45038174e-04 3.39331531e-04 3.82494878e-05 -3.18004639e-04 2.34610953e-14 7.04307578e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.68316646e-03 -3.56712493e-05 2.03105766e-07] [-2.68316646e-03 3.56712510e-05 -2.03183491e-07] [ 2.30017686e-03 1.30700657e-11 -3.91646555e-12] [-2.53463081e-03 7.02094760e-03 -7.44736351e-04] [-2.53463079e-03 -7.02094761e-03 7.44736341e-04] [-8.95328935e-03 1.74870566e-11 7.91093661e-12] [ 3.25046787e-03 -2.76622516e-03 7.67565133e-04] [ 3.25046800e-03 2.76622508e-03 -7.67565074e-04] [ 2.57247742e-03 -7.45078113e-04 3.38792242e-03] [ 2.72140816e-03 -6.35848805e-04 3.38767549e-03] [ 2.57247740e-03 7.45078169e-04 -3.38792245e-03] [ 2.72140817e-03 6.35848807e-04 -3.38767544e-03]] Final stress: [3.45023594e-04 3.39317423e-04 3.82278946e-05 3.17993119e-04 3.54764171e-14 9.26162441e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.02530476e-12 9.40890560e-04 5.58582691e-12] [-9.27708075e-13 9.24018587e-04 9.68246874e-11] [-9.76909724e-04 2.63061199e-03 2.59861879e-03] [ 3.48371815e-03 -3.43602668e-03 -1.31636831e-03] [-2.52214977e-03 -1.70493764e-03 -1.28231289e-03] [ 9.76909723e-04 2.63061191e-03 -2.59861882e-03] [ 2.52214989e-03 -1.70493756e-03 1.28231283e-03] [-3.48371822e-03 -3.43602665e-03 1.31636828e-03] [ 1.08262113e-03 8.09404788e-04 -7.59822147e-04] [ 1.09575667e-03 7.68492962e-04 -7.59793923e-04] [-1.09575670e-03 7.68492938e-04 7.59793887e-04] [-1.08262116e-03 8.09404798e-04 7.59822195e-04]] Final stress: [-4.42434882e-05 -4.31605916e-05 8.26002208e-05 4.96624475e-14 -1.40192074e-04 -6.90467940e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.07122671e-12 -9.24250157e-04 -2.15994289e-11] [ 1.30889945e-12 -9.41129168e-04 8.20103498e-11] [-9.77050773e-04 -2.63115745e-03 -2.59910566e-03] [-2.52272255e-03 1.70537832e-03 1.28255069e-03] [ 3.48443220e-03 3.43672383e-03 1.31661743e-03] [ 9.77050776e-04 -2.63115747e-03 2.59910565e-03] [-3.48443221e-03 3.43672383e-03 -1.31661743e-03] [ 2.52272250e-03 1.70537835e-03 -1.28255071e-03] [-1.09588106e-03 -7.68663532e-04 -7.59856539e-04] [-1.08274637e-03 -8.09591514e-04 -7.59884968e-04] [ 1.08274639e-03 -8.09591506e-04 7.59884907e-04] [ 1.09588108e-03 -7.68663527e-04 7.59856569e-04]] Final stress: [-4.42525322e-05 -4.31691368e-05 8.25980003e-05 -4.50888334e-14 1.40227741e-04 6.21341787e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.63095568e-13 -2.64749545e-03 4.35733770e-11] [ 9.62383346e-13 -2.71883748e-03 -2.51562995e-11] [ 5.70341526e-03 1.58607702e-03 8.72839492e-04] [-6.45162821e-04 2.82021256e-03 -4.48266337e-04] [-4.89988498e-03 -7.01700870e-03 -4.25437634e-04] [-5.70341526e-03 1.58607700e-03 -8.72839497e-04] [ 4.89988499e-03 -7.01700870e-03 4.25437631e-04] [ 6.45162758e-04 2.82021260e-03 4.48266311e-04] [ 7.64929666e-04 2.70155583e-03 3.38744187e-03] [ 6.15997314e-04 2.59232974e-03 3.38815604e-03] [-6.15997291e-04 2.59232973e-03 -3.38815600e-03] [-7.64929639e-04 2.70155584e-03 -3.38744189e-03]] Final stress: [ 3.39317419e-04 3.45023598e-04 3.82278946e-05 -4.45208274e-14 -3.17993119e-04 -7.11237796e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.16418193e-13 2.71883748e-03 3.13473884e-11] [-1.19403919e-12 2.64749545e-03 -9.22348420e-11] [ 5.70341526e-03 -1.58607696e-03 -8.72839518e-04] [-4.89988498e-03 7.01700870e-03 4.25437634e-04] [-6.45162759e-04 -2.82021260e-03 4.48266310e-04] [-5.70341526e-03 -1.58607697e-03 8.72839514e-04] [ 6.45162744e-04 -2.82021261e-03 -4.48266303e-04] [ 4.89988506e-03 7.01700866e-03 -4.25437601e-04] [-6.15997316e-04 -2.59232972e-03 3.38815598e-03] [-7.64929679e-04 -2.70155584e-03 3.38744195e-03] [ 7.64929638e-04 -2.70155582e-03 -3.38744187e-03] [ 6.15997297e-04 -2.59232976e-03 -3.38815602e-03]] Final stress: [3.39317419e-04 3.45023598e-04 3.82278946e-05 4.62426100e-14 3.17993119e-04 1.00412814e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[ 0.05776217 0.02456067 0.00135099] [-0.05776217 -0.02456067 0.00135096] [ 0.14764091 -0.00677254 -0.06743527] [-0.08543303 0.05856871 -0.0088549 ] [-0.06634567 -0.02676019 0.0595214 ] [-0.14764091 0.00677253 -0.06743527] [ 0.08543304 -0.05856871 -0.0088549 ] [ 0.06634572 0.02676016 0.05952142] [ 0.01393407 0.01738401 -0.0765863 ] [-0.01393409 -0.01738399 -0.07658628] [-0.04528647 -0.09451968 0.09200408] [ 0.04528644 0.09451969 0.09200408]] Final stress: [ 4.82377376e-03 8.34278141e-03 1.03812102e-02 4.33746488e-11 3.23611007e-11 -2.94761998e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-0.05776257 0.02455826 -0.00135117] [ 0.05776257 -0.02455826 -0.00135114] [ 0.14761685 0.00678104 0.06742197] [-0.06630716 0.02674667 -0.05950444] [-0.08541523 -0.05857322 0.00884947] [-0.14761685 -0.00678107 0.06742195] [ 0.0663072 -0.02674665 -0.05950446] [ 0.08541521 0.05857324 0.00884946] [-0.04521654 0.0945045 -0.09199086] [ 0.04521653 -0.0945045 -0.0919909 ] [ 0.01389761 -0.01738234 0.07657506] [-0.01389762 0.01738233 0.07657505]] Final stress: [ 4.82261908e-03 8.34161720e-03 1.03800012e-02 -1.10431418e-11 -1.11799446e-11 2.94707181e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.66646224e-04 -9.14445367e-06 1.94312219e-06] [-1.66646232e-04 9.14445077e-06 1.94394491e-06] [-2.72647560e-04 1.53181386e-04 -5.80954785e-05] [ 4.16294802e-04 7.49242280e-06 1.38276858e-04] [ 3.50995355e-04 1.74233104e-04 -8.24130396e-05] [ 2.72647556e-04 -1.53181528e-04 -5.80955376e-05] [-4.16294538e-04 -7.49226690e-06 1.38276735e-04] [-3.50995386e-04 -1.74233096e-04 -8.24130585e-05] [ 5.59929979e-04 2.52773208e-05 -4.60351496e-05] [-5.59930093e-04 -2.52773037e-05 -4.60356451e-05] [-7.78578280e-05 1.38806777e-04 4.63234837e-05] [ 7.78577206e-05 -1.38806814e-04 4.63237651e-05]] Final stress: [-2.29232506e-05 -1.88598773e-05 -7.90434443e-05 1.89740431e-13 -2.80895667e-14 1.99859043e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.66547741e-04 -9.14272119e-06 -1.94276627e-06] [ 1.66547727e-04 9.14271140e-06 -1.94397757e-06] [-2.72581838e-04 -1.53133247e-04 5.79924185e-05] [ 3.50894701e-04 -1.74123301e-04 8.24431927e-05] [ 4.16232930e-04 -7.43764748e-06 -1.38203648e-04] [ 2.72581828e-04 1.53132315e-04 5.79920216e-05] [-3.50893450e-04 1.74124013e-04 8.24426026e-05] [-4.16233779e-04 7.43813416e-06 -1.38204062e-04] [-7.78332335e-05 -1.38727816e-04 -4.61926242e-05] [ 7.78330112e-05 1.38727734e-04 -4.61927903e-05] [ 5.59810829e-04 -2.52194951e-05 4.59054672e-05] [-5.59810985e-04 2.52193194e-05 4.59041661e-05]] Final stress: [-2.29185556e-05 -1.88560003e-05 -7.90438033e-05 3.18255439e-13 -2.28454710e-13 -1.99902161e-05] Minimization converged after 42 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.00953484 -0.00364697 0.00020852] [-0.00223558 -0.00365189 -0.00020853] [ 0.04155159 0.05078399 0.01802902] [ 0.05561505 -0.13918947 0.012669 ] [-0.06061431 0.03757414 -0.02953355] [ 0.11448837 0.05688191 -0.03146152] [ 0.01618413 -0.06477929 -0.00593907] [-0.09412003 -0.01437737 0.03623616] [ 0.01557169 0.03595916 -0.00182711] [-0.01018355 0.04983406 -0.00304537] [-0.05577092 -0.00968046 0.00276375] [-0.03002128 0.00429218 0.00210869]] Final stress: [-0.00222796 -0.00222781 0.00028636 -0.00308563 -0.00308564 -0.00045856] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.00223558 0.00365189 0.00020852] [ 0.00953484 0.00364697 -0.00020852] [ 0.04155159 -0.05078399 -0.01802901] [-0.06061431 -0.03757414 0.02953355] [ 0.05561504 0.13918947 -0.012669 ] [ 0.11448837 -0.05688191 0.03146152] [-0.09412003 0.01437737 -0.03623616] [ 0.01618413 0.06477929 0.00593907] [-0.05577092 0.00968046 -0.00276375] [-0.03002128 -0.00429218 -0.00210869] [ 0.01557169 -0.03595916 0.00182711] [-0.01018355 -0.04983406 0.00304537]] Final stress: [-0.00222796 -0.00222781 0.00028636 -0.00308563 0.00308564 0.00045856] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.00953496 -0.003647 -0.00020853] [ 0.00223563 -0.00365192 0.00020853] [-0.11448815 0.05688101 0.03146193] [ 0.09411903 -0.01437811 -0.03623667] [-0.01618367 -0.06477784 0.00593919] [-0.04155044 0.05078309 -0.01802935] [ 0.06061292 0.03757408 0.02953402] [-0.05561513 -0.13918896 -0.01266916] [ 0.03002318 0.00429056 -0.00210852] [ 0.0557731 -0.00968221 -0.0027636 ] [ 0.010182 0.04983616 0.00304522] [-0.01557352 0.03596115 0.00182694]] Final stress: [-0.00222799 -0.00222784 0.00028636 0.00308563 -0.00308564 0.00045857] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.0022356 0.0036519 -0.00020853] [-0.00953488 0.00364698 0.00020852] [-0.1144883 -0.05688161 -0.03146166] [-0.01618398 0.06477881 -0.00593911] [ 0.0941197 0.01437762 0.03623633] [-0.04155121 -0.05078369 0.01802913] [-0.05561507 0.1391893 0.01266905] [ 0.06061385 -0.03757412 -0.02953371] [ 0.01018303 -0.04983476 -0.00304532] [-0.0155723 -0.03595983 -0.00182705] [ 0.03002191 -0.00429164 0.00210864] [ 0.05577165 0.00968104 0.0027637 ]] Final stress: [-0.00222797 -0.00222782 0.00028636 0.00308563 0.00308564 -0.00045856] Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 64 steps. Minimization converged after 65 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 65 steps. Minimization converged after 68 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.86932080e-03 2.59898081e-04 -1.20575490e-04] [-3.86932079e-03 -2.59898118e-04 -1.20570700e-04] [ 7.84086413e-03 -4.75969069e-05 -2.82915344e-03] [-9.67522275e-03 4.20294635e-03 -9.56789526e-04] [-8.90000742e-03 -2.26900520e-03 3.91822063e-03] [-7.84086412e-03 4.75988562e-05 -2.82915265e-03] [ 9.67522166e-03 -4.20294698e-03 -9.56789023e-04] [ 8.90000755e-03 2.26900509e-03 3.91822073e-03] [-4.36046167e-03 2.44612645e-04 5.83465503e-03] [ 4.36046204e-03 -2.44613356e-04 5.83465348e-03] [-6.06657575e-03 -2.86772222e-03 -5.84636101e-03] [ 6.06657633e-03 2.86772176e-03 -5.84635803e-03]] Final stress: [ 5.13476789e-04 4.43717928e-04 1.58202157e-04 -8.44894594e-13 -8.49764377e-13 -1.69227428e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.87106782e-03 2.60336709e-04 1.20606872e-04] [ 3.87106789e-03 -2.60336709e-04 1.20610041e-04] [ 7.84775234e-03 4.88027651e-05 2.82916627e-03] [-8.90957388e-03 2.26845642e-03 -3.92170805e-03] [-9.68749328e-03 -4.20500656e-03 9.60204674e-04] [-7.84775226e-03 -4.88053324e-05 2.82916523e-03] [ 8.90957472e-03 -2.26845592e-03 -3.92170852e-03] [ 9.68749039e-03 4.20500831e-03 9.60203323e-04] [-6.07411981e-03 2.86953323e-03 5.84871119e-03] [ 6.07412081e-03 -2.86953330e-03 5.84870820e-03] [-4.36738560e-03 -2.47252820e-04 -5.83697962e-03] [ 4.36738650e-03 2.47253210e-04 -5.83697961e-03]] Final stress: [ 5.13915199e-04 4.44062597e-04 1.58390929e-04 -1.76484672e-12 3.25612599e-13 1.69422323e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 8.75973072e-10 1.33190629e-03 -9.49276033e-08] [ 1.67214342e-09 -1.33190297e-03 2.18068820e-07] [-3.55280602e-04 -7.37971988e-08 2.75993036e-08] [-7.25529715e-05 4.50932276e-04 -7.88776758e-04] [-7.25471518e-05 -4.50934026e-04 7.88773597e-04] [ 3.55282553e-04 -5.53721081e-08 -2.39106453e-08] [ 7.25359484e-05 -4.50940368e-04 -7.88771876e-04] [ 7.24790022e-05 4.50973757e-04 7.88741206e-04] [ 3.79410347e-04 5.86062048e-05 -1.25881608e-04] [-3.79358293e-04 -5.85691130e-05 -1.26070226e-04] [ 3.79404897e-04 -5.85851893e-05 1.25876487e-04] [-3.79376277e-04 5.86423056e-05 1.25982349e-04]] Final stress: [ 5.59293276e-06 6.84896400e-05 3.35158707e-05 -6.66461715e-11 7.90034740e-11 -1.08964490e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.26687613e-10 -3.49870799e-03 -3.40078828e-08] [-7.97725774e-11 3.49870657e-03 -1.75494962e-07] [ 7.61739357e-04 -4.81240758e-08 2.09199243e-08] [ 5.00665603e-04 -1.22764415e-03 2.22796280e-03] [ 5.00555930e-04 1.22770708e-03 -2.22790943e-03] [-7.61739643e-04 4.86126670e-08 2.00895607e-08] [-5.00635444e-04 1.22766044e-03 2.22794877e-03] [-5.00598604e-04 -1.22768227e-03 -2.22792930e-03] [-7.34033514e-04 2.48983153e-04 6.61139146e-04] [ 7.34034830e-04 -2.49004792e-04 6.61187518e-04] [-7.34027032e-04 -2.49009000e-04 -6.61073121e-04] [ 7.34038369e-04 2.48990481e-04 -6.61157886e-04]] Final stress: [ 5.50342956e-05 -1.52812557e-04 -2.31507649e-05 -9.85312920e-12 -3.27720511e-11 -2.42770506e-11] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.52267540e-10 3.32465669e-03 -1.57443638e-08] [-3.90294394e-10 -3.32465870e-03 7.57407943e-08] [ 1.15377726e-03 -3.05803682e-08 1.34980029e-08] [-1.78269805e-03 1.87336642e-03 -2.58292705e-03] [-1.78279913e-03 -1.87330877e-03 2.58297508e-03] [-1.15377704e-03 -6.02597037e-08 -2.58826798e-08] [ 1.78283356e-03 -1.87328844e-03 -2.58299134e-03] [ 1.78267509e-03 1.87337934e-03 2.58291591e-03] [ 5.78744939e-04 2.18187367e-03 -2.36289334e-03] [-5.78757260e-04 -2.18190015e-03 -2.36302169e-03] [ 5.78752086e-04 -2.18190324e-03 2.36296852e-03] [-5.78750818e-04 2.18187402e-03 2.36292630e-03]] Final stress: [-2.73942824e-05 2.71043722e-04 1.20257825e-04 9.87692014e-12 -5.18459634e-11 -7.42224226e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.09397793e-10 -3.44748816e-03 2.19465154e-08] [ 9.70751535e-10 3.44748736e-03 1.19313785e-07] [ 2.77091232e-03 2.82410590e-08 -1.16721993e-08] [-2.99100760e-04 1.82402586e-03 2.63424869e-03] [-2.99026022e-04 -1.82406863e-03 -2.63428321e-03] [-2.77091193e-03 -2.45325960e-08 -1.07196996e-08] [ 2.99113874e-04 -1.82401819e-03 2.63424241e-03] [ 2.99004056e-04 1.82408074e-03 -2.63429318e-03] [-7.36440379e-04 -2.42025262e-03 -2.37960416e-03] [ 7.36441508e-04 2.42024026e-03 -2.37965802e-03] [-7.36431415e-04 2.42021560e-03 2.37959540e-03] [ 7.36438182e-04 -2.42022594e-03 2.37963320e-03]] Final stress: [ 2.80870010e-04 -3.54622373e-05 1.21062618e-04 -7.72484270e-12 -1.83404484e-11 -1.06154951e-10] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-8.34046165e-10 2.64299308e-04 1.66550178e-08] [-1.08489485e-09 -2.64300123e-04 1.83536761e-07] [-8.14654837e-05 1.92212988e-08 -6.80959059e-09] [ 2.16471080e-04 1.28358749e-04 -7.31177614e-05] [ 2.16473967e-04 -1.28360650e-04 7.31174448e-05] [ 8.14654277e-05 -1.11258764e-07 -4.60072742e-08] [-2.16341941e-04 -1.28283380e-04 -7.31788370e-05] [-2.16547654e-04 1.28402005e-04 7.30811169e-05] [ 3.23507855e-04 1.45581870e-04 3.35469919e-05] [-3.23537406e-04 -1.45587096e-04 3.33967480e-05] [ 3.23509677e-04 -1.45588942e-04 -3.34999384e-05] [-3.23533601e-04 1.45570296e-04 -3.34931399e-05]] Final stress: [ 1.64528099e-05 2.83776247e-05 7.00404301e-05 4.53049457e-11 -1.97281210e-11 2.07425819e-11] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.70598260e-10 -1.61781353e-04 2.03093453e-09] [-6.23946950e-10 1.61781035e-04 -8.38938127e-08] [ 4.33861780e-04 -2.76181911e-09 1.88498811e-09] [-1.91901143e-04 2.72402724e-04 5.27487799e-05] [-1.91923535e-04 -2.72390071e-04 -5.27373339e-05] [-4.33862507e-04 1.47882888e-08 6.68200939e-09] [ 1.91912407e-04 -2.72396518e-04 5.27440992e-05] [ 1.91940669e-04 2.72380049e-04 -5.27295645e-05] [-6.96370675e-05 -3.57457569e-06 -6.85903273e-05] [ 6.96225560e-05 3.57420337e-06 -6.85457977e-05] [-6.96370390e-05 3.57627511e-06 6.86098782e-05] [ 6.96248737e-05 -3.58379599e-06 6.85735621e-05]] Final stress: [ 2.49955031e-05 2.29874265e-05 6.87277049e-05 2.37331248e-11 -7.58420375e-12 2.41859199e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 4.97951264e-10 -2.98374153e-03 -5.92830204e-08] [-4.51688964e-10 2.98374129e-03 -2.94408462e-07] [ 6.52722895e-04 -5.49990622e-08 2.34121358e-08] [ 2.81180485e-04 -1.04217171e-03 1.91982331e-03] [ 2.81065209e-04 1.04223797e-03 -1.91976778e-03] [-6.52723492e-04 1.06174137e-07 4.46054845e-08] [-2.81224811e-04 1.04214504e-03 1.91984476e-03] [-2.81033111e-04 -1.04225556e-03 -1.91975219e-03] [-7.59566970e-04 7.87277826e-05 -3.41234818e-04] [ 7.59572538e-04 -7.87327163e-05 -3.41093674e-04] [-7.59567942e-04 -7.87234180e-05 3.41273091e-04] [ 7.59575153e-04 7.87216745e-05 3.41192977e-04]] Final stress: [ 5.13031865e-05 -1.32086004e-04 -5.12479996e-05 -9.73485047e-12 -6.54385638e-12 3.13523648e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.39210572e-03 2.39793305e-03 3.78408846e-05] [-1.39210571e-03 -2.39793304e-03 -3.78409375e-05] [ 4.93084775e-03 2.56006138e-11 -8.72933738e-12] [ 6.23728970e-04 -2.74863941e-03 3.99090920e-03] [ 6.23729463e-04 2.74863913e-03 -3.99090941e-03] [ 9.61300148e-04 -6.85269571e-11 -1.92792245e-11] [ 5.27284013e-04 1.37020501e-05 -1.56781060e-03] [ 5.27283928e-04 -1.37020007e-05 1.56781058e-03] [-1.50353403e-03 -1.12942847e-03 -5.74238198e-03] [-1.20144735e-03 -1.37821894e-03 -5.71551552e-03] [-1.50353404e-03 1.12942849e-03 5.74238205e-03] [-1.20144741e-03 1.37821918e-03 5.71551577e-03]] Final stress: [-2.47958786e-05 1.70992234e-06 1.09649461e-04 -1.81476198e-04 2.39303318e-13 -4.85615085e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.41194557e-03 2.42557361e-03 -3.82390485e-05] [ 1.41194557e-03 -2.42557360e-03 3.82398691e-05] [-9.79976497e-04 4.02832840e-10 -1.68537682e-10] [-5.37811236e-04 -1.11302748e-05 -1.58700862e-03] [-5.37810105e-04 1.11296278e-05 1.58700809e-03] [-4.99679403e-03 2.82066392e-11 1.34348737e-11] [-6.34541184e-04 2.78253052e-03 4.04182678e-03] [-6.34541103e-04 -2.78253057e-03 -4.04182674e-03] [ 1.21922465e-03 1.41434725e-03 -5.80695643e-03] [ 1.52956689e-03 1.14858534e-03 -5.83400202e-03] [ 1.21922465e-03 -1.41434723e-03 5.80695595e-03] [ 1.52956683e-03 -1.14858510e-03 5.83400231e-03]] Final stress: [-2.55327758e-05 1.68358373e-06 1.11158009e-04 1.84108941e-04 2.03983015e-13 -4.70157256e-13] Minimization converged after 39 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.09810892e-12 3.84429827e-03 1.52073560e-10] [ 6.46429385e-12 -1.04341077e-03 9.33751262e-10] [ 2.02457501e-03 5.71767293e-04 3.07312056e-03] [ 1.12735932e-03 -3.73622324e-03 -5.63173423e-04] [-1.01066797e-03 -9.30158270e-04 -2.95044943e-03] [-2.02457500e-03 5.71766710e-04 -3.07312080e-03] [ 1.01066833e-03 -9.30158063e-04 2.95044925e-03] [-1.12735997e-03 -3.73622285e-03 5.63173116e-04] [-1.37420510e-03 1.51403751e-03 -6.00084249e-03] [-1.11619676e-03 1.18013291e-03 -5.50733291e-03] [ 1.11619689e-03 1.18013295e-03 5.50733236e-03] [ 1.37420525e-03 1.51403755e-03 6.00084267e-03]] Final stress: [-2.69387719e-05 3.35864297e-06 1.10015973e-04 -2.57979615e-13 -1.82988546e-04 -2.91139019e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 6.72656163e-12 1.04756108e-03 1.50116207e-10] [ 9.48206960e-12 -3.87213026e-03 1.05807946e-09] [ 2.03684795e-03 -5.73759525e-04 -3.09589659e-03] [-1.01772813e-03 9.41886400e-04 2.97294991e-03] [ 1.13494474e-03 3.76379696e-03 5.67213595e-04] [-2.03684793e-03 -5.73760154e-04 3.09589633e-03] [-1.13494438e-03 3.76379717e-03 -5.67213775e-04] [ 1.01772729e-03 9.41886888e-04 -2.97295030e-03] [ 1.12954640e-03 -1.18627117e-03 -5.56160280e-03] [ 1.39455442e-03 -1.53336817e-03 -6.05953122e-03] [-1.39455420e-03 -1.53336814e-03 6.05953060e-03] [-1.12954617e-03 -1.18627108e-03 5.56160304e-03]] Final stress: [-2.74106447e-05 3.38046311e-06 1.10950881e-04 -4.18074760e-13 1.84567483e-04 -1.75531997e-13] Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.71034467e-04 3.77989798e-04 -4.70222430e-06] [-7.71034404e-04 -3.77989788e-04 -4.69568189e-06] [ 5.45284689e-05 7.54446061e-05 -5.44269688e-04] [ 1.09605691e-05 6.06656271e-04 1.53077056e-04] [ 1.80305906e-04 -1.35992937e-04 3.96334994e-04] [-5.45284286e-05 -7.54552730e-05 -5.44274124e-04] [-1.09528791e-05 -6.06651823e-04 1.53073289e-04] [-1.80315541e-04 1.35998476e-04 3.96330377e-04] [ 3.96237625e-04 -1.09364516e-04 -3.96948670e-05] [-3.96236607e-04 1.09364647e-04 -3.97046661e-05] [ 2.04919577e-04 -8.00237975e-05 3.92645919e-05] [-2.04918753e-04 8.00243373e-05 3.92609431e-05]] Final stress: [ 2.12657087e-05 3.60932013e-05 2.55063980e-05 -1.37492129e-12 5.38516274e-13 -1.06089050e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.68725855e-04 3.76924771e-04 4.66347242e-06] [ 7.68725901e-04 -3.76924648e-04 4.66370745e-06] [ 5.12827340e-05 -7.20926259e-05 5.46847759e-04] [ 1.82345087e-04 1.32668102e-04 -3.99883493e-04] [ 5.84781571e-06 -6.08898419e-04 -1.52082298e-04] [-5.12827954e-05 7.20963757e-05 5.46849370e-04] [-1.82352729e-04 -1.32672442e-04 -3.99879966e-04] [-5.84248016e-06 6.08895338e-04 -1.52079764e-04] [ 2.04393376e-04 8.11043322e-05 -3.86649571e-05] [-2.04391753e-04 -8.11027525e-05 -3.86611014e-05] [ 3.92858870e-04 1.10635865e-04 3.91115990e-05] [-3.92858171e-04 -1.10633898e-04 3.91156713e-05]] Final stress: [ 2.12437128e-05 3.60147823e-05 2.54725275e-05 -1.40496038e-12 3.08939272e-12 1.05946551e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 9.41915609e-03 -4.54265342e-03 9.00708211e-06] [-9.41915663e-03 4.54265367e-03 9.00274492e-06] [-4.58517848e-03 5.56933857e-04 -7.35773601e-03] [ 2.23866345e-04 -4.97777406e-03 5.78373161e-03] [ 3.63029154e-03 1.19655699e-02 1.56407808e-03] [ 4.58517830e-03 -5.56932372e-04 -7.35773514e-03] [-2.23867533e-04 4.97777346e-03 5.78373243e-03] [-3.63027446e-03 -1.19655799e-02 1.56408591e-03] [-2.27264792e-03 -2.01129030e-04 1.81046229e-03] [ 2.27264123e-03 2.01135401e-04 1.81046932e-03] [-2.86275776e-03 -1.39169490e-03 -1.80955062e-03] [ 2.86274928e-03 1.39169733e-03 -1.80954769e-03]] Final stress: [-2.12799562e-04 -5.98618978e-04 -1.22937364e-04 1.29926421e-11 6.30994352e-12 -3.60483315e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-9.34799306e-03 -4.50704219e-03 -8.96279303e-06] [ 9.34799305e-03 4.50704111e-03 -8.96405233e-06] [-4.59244730e-03 -5.06384273e-04 7.33468829e-03] [ 3.68280891e-03 -1.20497182e-02 -1.56238781e-03] [ 1.83623710e-04 5.00201730e-03 -5.76244786e-03] [ 4.59244728e-03 5.06420776e-04 7.33470276e-03] [-3.68281456e-03 1.20497145e-02 -1.56238474e-03] [-1.83619066e-04 -5.00202046e-03 -5.76244519e-03] [-2.82194450e-03 1.40794308e-03 1.77701656e-03] [ 2.82194133e-03 -1.40795740e-03 1.77702761e-03] [-2.30985746e-03 1.78404877e-04 -1.77792640e-03] [ 2.30986167e-03 -1.78419143e-04 -1.77791638e-03]] Final stress: [-2.15342545e-04 -6.00486427e-04 -1.23394919e-04 2.05944205e-12 -2.50324728e-11 3.59810048e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-6.42568374e-10 -1.37885366e-03 -2.57536698e-08] [-4.59397298e-10 1.37885069e-03 2.85894879e-07] [ 6.48587565e-04 9.91868720e-09 -5.17395310e-09] [ 6.12640364e-05 -4.86254998e-05 8.66030593e-04] [ 6.12000021e-05 4.86614439e-05 -8.66005419e-04] [-6.48586993e-04 -4.99937705e-08 -2.40884700e-08] [-6.11322674e-05 4.87020779e-05 8.65968851e-04] [-6.12919840e-05 -4.86107782e-05 -8.66049027e-04] [-2.54759386e-04 -9.94503663e-05 -1.35834945e-04] [ 2.54729241e-04 9.94131174e-05 -1.36046679e-04] [-2.54749501e-04 9.94104526e-05 1.35812115e-04] [ 2.54740388e-04 -9.94573992e-05 1.35893632e-04]] Final stress: [ 6.84069253e-05 5.79534391e-06 3.37432584e-05 3.22748450e-11 -6.96249055e-11 9.17213678e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.92917682e-10 3.43256692e-03 7.78573575e-08] [ 6.82602599e-10 -3.43256883e-03 -3.38669560e-08] [-2.08718233e-03 5.93686440e-08 -2.42075966e-08] [ 1.10379115e-04 2.55604195e-04 -2.17268809e-03] [ 1.10463322e-04 -2.55653013e-04 2.17264790e-03] [ 2.08718213e-03 5.00912848e-08 2.00965851e-08] [-1.10433282e-04 -2.55636607e-04 -2.17266146e-03] [-1.10427799e-04 2.55632434e-04 2.17266618e-03] [ 6.39293571e-04 -4.26330824e-04 5.89910461e-04] [-6.39291432e-04 4.26301313e-04 5.90009777e-04] [ 6.39304583e-04 4.26286327e-04 -5.89959390e-04] [-6.39288753e-04 -4.26311380e-04 -5.89965256e-04]] Final stress: [-1.45026901e-04 5.11250534e-05 -2.10913379e-05 -1.56156685e-11 -4.47576386e-11 -7.20260402e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.30544042e-10 -2.94450916e-04 9.96476568e-09] [ 7.11555148e-10 2.94451798e-04 2.50727850e-07] [ 1.83541407e-04 8.47157887e-08 -3.45545872e-08] [ 3.04407930e-04 7.33219782e-05 2.77747607e-04] [ 3.04601492e-04 -7.34331408e-05 -2.77837115e-04] [-1.83540184e-04 -7.76611475e-08 -3.10024555e-08] [-3.04451342e-04 -7.33461866e-05 2.77767375e-04] [-3.04584040e-04 7.34225400e-05 -2.77828488e-04] [ 2.53478149e-04 -3.79358558e-05 -1.67598019e-05] [-2.53463043e-04 3.79460768e-05 -1.68564582e-05] [ 2.53478134e-04 3.79370466e-05 1.67209219e-05] [-2.53469445e-04 -3.79203947e-05 1.68508228e-05]] Final stress: [ 2.38218496e-05 2.38986281e-05 7.16230606e-05 -2.14332475e-11 2.17519867e-11 -5.03096767e-11] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.77658110e-10 1.74434623e-04 1.01187922e-08] [-2.66850736e-10 -1.74435120e-04 -8.22854242e-08] [ 3.00451370e-04 -1.04217459e-08 4.95536420e-09] [-2.10789193e-04 3.37800460e-04 -6.91108125e-05] [-2.10824626e-04 -3.37780353e-04 6.91282933e-05] [-3.00451836e-04 1.07651591e-08 4.72090865e-09] [ 2.10808192e-04 -3.37790046e-04 -6.91194322e-05] [ 2.10820017e-04 3.37783016e-04 6.91258927e-05] [ 3.20474161e-05 2.15115589e-05 -5.08643468e-05] [-3.20559983e-05 -2.15163347e-05 -5.08268380e-05] [ 3.20485640e-05 -2.15151246e-05 5.08895647e-05] [-3.20534620e-05 2.15069762e-05 5.08401691e-05]] Final stress: [ 2.31450455e-05 2.49081522e-05 6.84288523e-05 1.12967173e-11 -1.20201010e-11 1.21344625e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.28736594e-10 2.93952754e-03 4.36012590e-08] [ 1.30555060e-10 -2.93952798e-03 -2.30368840e-07] [-1.68096821e-03 3.79262777e-09 -1.44586076e-09] [ 1.90143634e-04 2.57563116e-04 -1.90204020e-03] [ 1.90143385e-04 -2.57563019e-04 1.90204033e-03] [ 1.68096702e-03 9.90802584e-08 4.11813035e-08] [-1.90210788e-04 -2.57602924e-04 -1.90200708e-03] [-1.90055968e-04 2.57513305e-04 1.90208213e-03] [ 7.03844808e-04 -1.62248103e-04 -3.38681908e-04] [-7.03855889e-04 1.62243966e-04 -3.38491431e-04] [ 7.03847067e-04 1.62238880e-04 3.38656251e-04] [-7.03854867e-04 -1.62247653e-04 3.38588951e-04]] Final stress: [-1.28900880e-04 4.84848706e-05 -5.12086311e-05 1.43582441e-11 -9.03718154e-12 -1.12782438e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.42087645e-03 -2.47053291e-03 -3.85101747e-05] [-1.42087645e-03 2.47053291e-03 3.85096813e-05] [ 6.30822947e-04 2.64908742e-10 -1.04042102e-10] [ 6.87081735e-04 -2.40632161e-04 1.61723338e-03] [ 6.87081930e-04 2.40632044e-04 -1.61723348e-03] [ 5.35107757e-03 2.50084453e-10 1.12068937e-10] [ 5.45431839e-04 -2.50401810e-03 -4.05510454e-03] [ 5.45432487e-04 2.50401773e-03 4.05510485e-03] [-1.29583994e-03 -1.43918267e-03 -5.83053690e-03] [-1.50674787e-03 -1.09585110e-03 -5.85757295e-03] [-1.29583997e-03 1.43918278e-03 5.83053670e-03] [-1.50674783e-03 1.09585095e-03 5.85757342e-03]] Final stress: [ 3.53101466e-06 -2.79925595e-05 1.11463978e-04 -1.85413970e-04 -2.62800334e-14 5.33373742e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.41602768e-03 -2.46363186e-03 3.84148230e-05] [ 1.41602768e-03 2.46363186e-03 -3.84142363e-05] [-5.33452927e-03 2.82745262e-10 -1.19647602e-10] [-5.42828186e-04 2.49647873e-03 -4.04273392e-03] [-5.42827645e-04 -2.49647904e-03 4.04273366e-03] [-6.27003165e-04 6.34611315e-11 2.41111441e-11] [-6.84270530e-04 2.39519273e-04 1.61242554e-03] [-6.84270537e-04 -2.39519277e-04 -1.61242554e-03] [ 1.50047011e-03 1.09155161e-03 -5.83506429e-03] [ 1.29136687e-03 1.42999833e-03 -5.80806764e-03] [ 1.50047013e-03 -1.09155167e-03 5.83506396e-03] [ 1.29136687e-03 -1.42999830e-03 5.80806773e-03]] Final stress: [ 3.52486380e-06 -2.77984728e-05 1.11093199e-04 1.84764044e-04 -5.11478616e-14 -1.90775008e-13] Minimization converged after 42 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.05088023e-12 -1.02539449e-03 -5.50250789e-11] [-7.97699470e-12 3.91968221e-03 -9.86185492e-11] [-2.35477214e-03 -1.94007366e-04 3.48376075e-03] [ 1.78677710e-03 -9.25674905e-04 -2.77856680e-03] [-1.62333103e-03 -3.20550114e-03 -2.53160914e-04] [ 2.35477214e-03 -1.94007442e-04 -3.48376077e-03] [ 1.62333107e-03 -3.20550112e-03 2.53160897e-04] [-1.78677686e-03 -9.25675035e-04 2.77856691e-03] [-1.16753071e-03 1.30711206e-03 -5.70097295e-03] [-1.44259145e-03 1.57092761e-03 -6.20826301e-03] [ 1.44259130e-03 1.57092768e-03 6.20826308e-03] [ 1.16753060e-03 1.30711195e-03 5.70097297e-03]] Final stress: [ 1.87146142e-06 -2.67366467e-05 1.13400830e-04 1.86110066e-13 -1.88140211e-04 3.72334986e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-2.11079211e-12 -3.87903696e-03 3.70382663e-10] [ 4.84446330e-13 1.01601750e-03 5.22158722e-10] [-2.32638235e-03 1.93048825e-04 -3.44993536e-03] [-1.60433681e-03 3.16567607e-03 2.50806995e-04] [ 1.76534060e-03 9.14758880e-04 2.75156297e-03] [ 2.32638234e-03 1.93048460e-04 3.44993521e-03] [-1.76534009e-03 9.14759171e-04 -2.75156320e-03] [ 1.60433634e-03 3.16567634e-03 -2.50807217e-04] [ 1.42312285e-03 -1.54851765e-03 -6.13929614e-03] [ 1.14623458e-03 -1.29345649e-03 -5.63736862e-03] [-1.14623457e-03 -1.29345660e-03 5.63736840e-03] [-1.42312289e-03 -1.54851756e-03 6.13929607e-03]] Final stress: [ 1.92125681e-06 -2.61567043e-05 1.12320843e-04 3.11900625e-14 1.86029507e-04 -3.85749791e-13] Minimization converged after 37 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.55153283e-04 -3.84991284e-04 -4.67490844e-06] [-7.55153302e-04 3.84991310e-04 -4.68498247e-06] [ 3.31503693e-04 -1.97993671e-04 -4.35314475e-04] [-7.82617727e-05 3.83650141e-04 5.23189651e-04] [ 3.34358505e-04 -3.85185950e-05 -8.27365357e-05] [-3.31503799e-04 1.97971849e-04 -4.35323594e-04] [ 7.82800344e-05 -3.83639550e-04 5.23180804e-04] [-3.34376687e-04 3.85291434e-05 -8.27453502e-05] [ 1.70494172e-04 -3.76229613e-04 -6.67416342e-05] [-1.70493987e-04 3.76230074e-04 -6.67509612e-05] [ 4.76994797e-05 -1.90878964e-04 6.63103869e-05] [-4.76996186e-05 1.90879160e-04 6.62915991e-05]] Final stress: [ 3.18492547e-05 2.40212151e-05 2.56326122e-05 7.41682555e-13 9.75659460e-13 -1.20143795e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.51405230e-04 -3.82999516e-04 4.64491035e-06] [ 7.51405257e-04 3.82999667e-04 4.64168520e-06] [ 3.34052879e-04 2.02722941e-04 4.36265982e-04] [ 3.33122358e-04 3.32654986e-05 8.11544303e-05] [-8.70935660e-05 -3.81886100e-04 -5.22515399e-04] [-3.34052880e-04 -2.02740689e-04 4.36258668e-04] [-3.33111005e-04 -3.32588724e-05 8.11488723e-05] [ 8.70813488e-05 3.81893253e-04 -5.22521344e-04] [ 3.91403065e-05 1.91647307e-04 -5.78055747e-05] [-3.91393436e-05 -1.91645519e-04 -5.78139078e-05] [ 1.70289650e-04 3.79548440e-04 5.82765288e-05] [-1.70289776e-04 -3.79546411e-04 5.82651480e-05]] Final stress: [ 3.19576165e-05 2.40300939e-05 2.55091484e-05 -8.70898902e-13 3.59692065e-12 1.20579005e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.01218699e-02 5.23132886e-03 9.22579064e-06] [-1.01218706e-02 -5.23132913e-03 9.23789621e-06] [-8.49946240e-03 -1.74593461e-03 -6.71020700e-03] [-5.84066108e-04 -4.71588168e-03 -6.05210278e-04] [ 3.66109183e-03 8.54202797e-03 7.30359844e-03] [ 8.49946211e-03 1.74596974e-03 -6.71019260e-03] [ 5.84056933e-04 4.71587646e-03 -6.05205197e-04] [-3.66106096e-03 -8.54204618e-03 7.30361315e-03] [ 1.18411191e-03 -2.26663706e-03 1.81696618e-03] [-1.18412359e-03 2.26663411e-03 1.81697848e-03] [-1.68478513e-03 -5.17378699e-03 -1.81441427e-03] [ 1.68477618e-03 5.17377850e-03 -1.81439058e-03]] Final stress: [-6.18123696e-04 -2.07192306e-04 -1.24609675e-04 1.52471423e-11 -7.35826265e-12 -4.34145113e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.01956002e-02 5.26803230e-03 -9.24173845e-06] [ 1.01956003e-02 -5.26803202e-03 -9.24883602e-06] [-8.42579468e-03 1.69306105e-03 6.73761308e-03] [ 3.57969182e-03 -8.49374039e-03 -7.32819021e-03] [-5.56598354e-04 4.75054140e-03 6.02425915e-04] [ 8.42579468e-03 -1.69307289e-03 6.73760844e-03] [-3.57968794e-03 8.49374273e-03 -7.32819211e-03] [ 5.56592637e-04 -4.75053788e-03 6.02423230e-04] [-1.69912057e-03 5.20479723e-03 1.83564223e-03] [ 1.69912223e-03 -5.20479464e-03 1.83564095e-03] [ 1.22166490e-03 2.27297147e-03 -1.83823646e-03] [-1.22166479e-03 -2.27296836e-03 -1.83824448e-03]] Final stress: [-6.16107080e-04 -2.04683152e-04 -1.23960217e-04 -2.56721645e-12 5.20810867e-12 4.34603260e-04] Minimization converged after 2 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.05960687e-03 -1.41619518e-04 -6.81305939e-07] [-5.05960686e-03 1.41619516e-04 6.81463206e-07] [ 1.31520468e-02 -1.28412328e-10 5.44921408e-11] [-3.23248592e-04 -1.24850460e-02 9.52123488e-03] [-3.23248917e-04 1.24850462e-02 -9.52123473e-03] [ 1.88629507e-02 -1.36312992e-10 -5.58543239e-11] [-2.99529954e-03 -7.91693010e-03 -9.16607924e-03] [-2.99529976e-03 7.91693024e-03 9.16607913e-03] [-3.91406315e-03 6.04174625e-03 -3.51850718e-03] [-3.71528031e-03 6.65194613e-03 -3.51747227e-03] [-3.91406316e-03 -6.04174625e-03 3.51850728e-03] [-3.71528028e-03 -6.65194619e-03 3.51747198e-03]] Final stress: [-1.49505394e-04 -1.70385253e-04 7.56616734e-05 -6.39258821e-04 -5.24009991e-14 8.53178253e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.09146071e-03 -1.43374860e-04 6.95311389e-07] [ 5.09146071e-03 1.43374870e-04 -6.94330634e-07] [-1.89739887e-02 2.89860857e-10 -1.12051178e-10] [ 3.01348385e-03 7.96954593e-03 -9.21934789e-03] [ 3.01348447e-03 -7.96954628e-03 9.21934761e-03] [-1.32342572e-02 -3.38639812e-10 -1.32328389e-10] [ 3.29734257e-04 1.25582852e-02 9.57866275e-03] [ 3.29733632e-04 -1.25582849e-02 -9.57866302e-03] [ 3.73389421e-03 -6.69278765e-03 -3.53943449e-03] [ 3.93554996e-03 -6.07520159e-03 -3.54049034e-03] [ 3.73389422e-03 6.69278762e-03 3.53943441e-03] [ 3.93554994e-03 6.07520165e-03 3.54049024e-03]] Final stress: [-1.50205449e-04 -1.71345073e-04 7.60336438e-05 6.43304491e-04 5.67507884e-14 -1.44896143e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.05697237e-01 -1.26189339e-02 -9.27932497e-04] [ 1.05697237e-01 1.26189339e-02 9.27932150e-04] [-1.13161319e-01 -9.90787142e-11 5.57896475e-11] [ 5.29522990e-02 9.25507140e-02 -3.06200631e-02] [ 5.29522990e-02 -9.25507140e-02 3.06200631e-02] [-7.06536740e-02 7.84262659e-11 3.32986219e-11] [ 6.17475503e-02 7.89776369e-02 3.97921031e-02] [ 6.17475507e-02 -7.89776371e-02 -3.97921030e-02] [-7.66212922e-02 -3.62564972e-02 3.94779909e-02] [-5.18682977e-02 1.55874813e-02 4.02823814e-02] [-7.66212922e-02 3.62564974e-02 -3.94779909e-02] [-5.18682977e-02 -1.55874812e-02 -4.02823813e-02]] Final stress: [ 8.45838074e-04 -7.44300269e-04 1.09805229e-03 -5.63261717e-03 4.51565100e-14 5.29740690e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.05697895e-01 -1.26190816e-02 9.27948642e-04] [-1.05697895e-01 1.26190816e-02 -9.27949139e-04] [ 7.06544584e-02 -2.34869787e-11 1.47342056e-11] [-6.17483407e-02 -7.89782336e-02 3.97924073e-02] [-6.17483407e-02 7.89782337e-02 -3.97924072e-02] [ 1.13162228e-01 1.01528327e-10 5.29264294e-11] [-5.29528037e-02 -9.25518283e-02 -3.06202748e-02] [-5.29528035e-02 9.25518282e-02 3.06202749e-02] [ 5.18687080e-02 -1.55878118e-02 4.02826382e-02] [ 7.66219875e-02 3.62567816e-02 3.94782351e-02] [ 5.18687080e-02 1.55878117e-02 -4.02826382e-02] [ 7.66219874e-02 -3.62567817e-02 -3.94782349e-02]] Final stress: [ 8.45859207e-04 -7.44297832e-04 1.09807378e-03 5.63264811e-03 -5.95425270e-15 2.27171827e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.71749894e-12 5.23423428e-03 8.10799450e-11] [-2.53578781e-12 4.94752595e-03 3.26793464e-10] [-2.58667847e-03 7.59960572e-03 1.08488991e-02] [ 1.16520744e-02 -1.26084819e-02 -5.60715309e-03] [-8.87934690e-03 -7.74623977e-03 -5.24783986e-03] [ 2.58667847e-03 7.59960552e-03 -1.08488992e-02] [ 8.87934706e-03 -7.74623967e-03 5.24783978e-03] [-1.16520744e-02 -1.26084820e-02 5.60715309e-03] [ 6.48242876e-03 4.14085756e-03 -3.54082375e-03] [ 6.28084394e-03 3.52337839e-03 -3.53628267e-03] [-6.28084404e-03 3.52337842e-03 3.53628243e-03] [-6.48242884e-03 4.14085748e-03 3.54082374e-03]] Final stress: [-1.71302607e-04 -1.50166019e-04 7.60251891e-05 1.80862014e-13 -6.43288575e-04 2.66548850e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.91364240e-12 -4.90919699e-03 -7.17311567e-11] [ 1.26927822e-12 -5.19141073e-03 4.31021883e-10] [-2.57298059e-03 -7.53413923e-03 -1.07683058e-02] [-8.80577514e-03 7.68416213e-03 5.21014174e-03] [ 1.15613533e-02 1.25171041e-02 5.56411650e-03] [ 2.57298059e-03 -7.53413939e-03 1.07683058e-02] [-1.15613533e-02 1.25171041e-02 -5.56411652e-03] [ 8.80577493e-03 7.68416225e-03 -5.21014183e-03] [-6.23673044e-03 -3.50440230e-03 -3.50917912e-03] [-6.43466254e-03 -4.11242087e-03 -3.51361433e-03] [ 6.43466263e-03 -4.11242084e-03 3.51361399e-03] [ 6.23673052e-03 -3.50440228e-03 3.50917927e-03]] Final stress: [-1.70100093e-04 -1.49295666e-04 7.55534448e-05 -1.60851388e-13 6.38087491e-04 6.13666445e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.71320179e-13 -9.30875004e-02 -3.00638317e-11] [-1.31355415e-11 -1.18310044e-01 -4.76528859e-10] [ 1.77761115e-02 -1.06783328e-01 -4.23003269e-02] [-7.99562877e-02 3.23010950e-02 1.40438940e-02] [ 9.21230867e-02 5.16927456e-02 2.32932530e-02] [-1.77761115e-02 -1.06783328e-01 4.23003270e-02] [-9.21230869e-02 5.16927454e-02 -2.32932529e-02] [ 7.99562879e-02 3.23010949e-02 -1.40438939e-02] [ 1.97907233e-03 8.99436571e-02 3.76802528e-02] [-2.26419149e-02 3.85446031e-02 4.20808951e-02] [ 2.26419149e-02 3.85446032e-02 -4.20808947e-02] [-1.97907228e-03 8.99436571e-02 -3.76802529e-02]] Final stress: [-7.42774519e-04 8.44345883e-04 1.09806262e-03 -3.07734857e-13 -5.63254560e-03 8.78183480e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-9.86702441e-12 1.18309239e-01 9.41520272e-11] [-2.12201520e-12 9.30869902e-02 -3.46487845e-10] [ 1.77756983e-02 1.06782191e-01 4.22999996e-02] [ 9.21222577e-02 -5.16924487e-02 -2.32930867e-02] [-7.99553910e-02 -3.23007033e-02 -1.40438219e-02] [-1.77756983e-02 1.06782191e-01 -4.22999996e-02] [ 7.99553910e-02 -3.23007033e-02 1.40438219e-02] [-9.21222577e-02 -5.16924487e-02 2.32930867e-02] [ 2.26417971e-02 -3.85443522e-02 4.20806044e-02] [-1.97890827e-03 -8.99428017e-02 3.76800422e-02] [ 1.97890825e-03 -8.99428017e-02 -3.76800419e-02] [-2.26417971e-02 -3.85443523e-02 -4.20806045e-02]] Final stress: [-7.42776997e-04 8.44324775e-04 1.09804112e-03 2.55537490e-13 5.63251465e-03 7.42172368e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.14936225e-03 4.09066442e-05 1.39925677e-05] [-2.14936226e-03 -4.09066304e-05 1.40138640e-05] [ 7.15926340e-04 -1.86287426e-04 -1.63391942e-03] [-1.69399836e-03 5.78454080e-04 4.05183098e-04] [-8.12905161e-04 5.12524704e-04 1.21632091e-03] [-7.15926230e-04 1.86285358e-04 -1.63392028e-03] [ 1.69400069e-03 -5.78452701e-04 4.05181990e-04] [ 8.12903785e-04 -5.12523978e-04 1.21632023e-03] [-7.81588861e-04 -3.14224605e-04 1.81178770e-04] [ 7.81588330e-04 3.14224658e-04 1.81167369e-04] [-9.57829456e-04 -7.69096741e-04 -1.82763878e-04] [ 9.57828946e-04 7.69096638e-04 -1.82755223e-04]] Final stress: [ 6.07792787e-05 4.72947452e-05 8.21921247e-05 6.17101272e-13 -1.25422589e-14 -4.91209994e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.15228170e-03 4.09321601e-05 -1.39856711e-05] [ 2.15228166e-03 -4.09322135e-05 -1.39929758e-05] [ 7.14907674e-04 1.83548141e-04 1.63445449e-03] [-8.17552380e-04 -5.09127067e-04 -1.21695914e-03] [-1.68993428e-03 -5.72320126e-04 -4.05096011e-04] [-7.14907693e-04 -1.83534835e-04 1.63446000e-03] [ 8.17543348e-04 5.09121827e-04 -1.21695472e-03] [ 1.68994463e-03 5.72314190e-04 -4.05091021e-04] [-9.61674305e-04 7.73139475e-04 1.78792859e-04] [ 9.61673466e-04 -7.73140374e-04 1.78804117e-04] [-7.79305982e-04 3.17881810e-04 -1.77218155e-04] [ 7.79305555e-04 -3.17882986e-04 -1.77213768e-04]] Final stress: [ 6.07108272e-05 4.72136125e-05 8.22277260e-05 1.13646335e-12 -1.48145087e-12 4.91653337e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.96490836e-05 -2.04476852e-04 1.16977937e-05] [ 2.96490437e-05 2.04477410e-04 1.16580783e-05] [ 2.80107373e-03 2.84600762e-04 1.28462948e-03] [ 8.11359410e-03 7.64877459e-03 3.39835573e-03] [ 7.78063304e-03 -7.72166065e-03 -4.71346060e-03] [-2.80107374e-03 -2.84592946e-04 1.28463321e-03] [-8.11361931e-03 -7.64878914e-03 3.39836763e-03] [-7.78060766e-03 7.72164631e-03 -4.71344859e-03] [ 1.00240111e-02 -1.97975631e-03 4.12629429e-04] [-1.00240087e-02 1.97976653e-03 4.12662688e-04] [ 8.27882632e-03 1.66875456e-03 -3.93860287e-04] [-8.27882879e-03 -1.66874426e-03 -3.93864569e-04]] Final stress: [ 8.16746333e-05 2.52404863e-04 6.17190236e-05 -9.50919419e-13 1.61254354e-11 -2.01588304e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 4.91174927e-05 -2.04465416e-04 -1.16869930e-05] [-4.91174663e-05 2.04466144e-04 -1.17099917e-05] [ 2.80361859e-03 -2.74336756e-04 -1.28799104e-03] [ 7.79500882e-03 7.71159742e-03 4.71607854e-03] [ 8.10083126e-03 -7.66525912e-03 -3.39761396e-03] [-2.80361862e-03 2.74325949e-04 -1.28799506e-03] [-7.79501594e-03 -7.71160137e-03 4.71608174e-03] [-8.10082289e-03 7.66525448e-03 -3.39761030e-03] [ 8.26321294e-03 -1.67905878e-03 4.10321349e-04] [-8.26321115e-03 1.67906826e-03 4.10333871e-04] [ 1.00437060e-02 1.97025326e-03 -4.29099257e-04] [-1.00437090e-02 -1.97024407e-03 -4.29108897e-04]] Final stress: [8.18605167e-05 2.52628234e-04 6.15311834e-05 6.57426125e-13 1.63839693e-11 2.01710221e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.39557717e-03 -2.05962554e-03 -6.57403491e-05] [-2.39557717e-03 2.05962551e-03 6.57385394e-05] [ 3.68770872e-02 -8.00638881e-10 3.33619265e-10] [-1.34177916e-02 -7.11633985e-02 2.11527856e-02] [-1.34177932e-02 7.11633994e-02 -2.11527848e-02] [ 8.98337558e-02 -8.83082531e-11 -3.32571584e-11] [-3.40065747e-02 -2.95184768e-02 -1.75109307e-02] [-3.40065748e-02 2.95184769e-02 1.75109306e-02] [-9.67036861e-03 2.22157884e-02 1.53893955e-03] [-3.86510853e-03 3.07961862e-02 1.61732585e-03] [-9.67036862e-03 -2.22157884e-02 -1.53893850e-03] [-3.86510853e-03 -3.07961863e-02 -1.61732609e-03]] Final stress: [-1.28467174e-03 -1.61039295e-03 -2.38976929e-04 -2.54075981e-03 1.61042887e-13 2.47295369e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.39540761e-03 -2.05960324e-03 6.57383617e-05] [ 2.39540761e-03 2.05960323e-03 -6.57392029e-05] [-8.98329892e-02 1.32436940e-10 -4.06975618e-11] [ 3.40083926e-02 2.95189944e-02 -1.75099312e-02] [ 3.40083928e-02 -2.95189945e-02 1.75099311e-02] [-3.68762348e-02 -1.99793604e-10 -5.73148488e-11] [ 1.34195598e-02 7.11640147e-02 2.11517170e-02] [ 1.34195597e-02 -7.11640146e-02 -2.11517170e-02] [ 3.86300280e-03 -3.07954169e-02 1.61725220e-03] [ 9.66824916e-03 -2.22150867e-02 1.53886650e-03] [ 3.86300273e-03 3.07954170e-02 -1.61725168e-03] [ 9.66824916e-03 2.22150867e-02 -1.53886599e-03]] Final stress: [-1.28467705e-03 -1.61039454e-03 -2.38980368e-04 2.54075271e-03 -7.13402975e-14 2.06515582e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-0.01553091 0.02663784 0.00045348] [-0.03772136 0.02661625 -0.00045351] [ 0.08037852 0.05376662 0.03814654] [ 0.05123067 -0.13386913 0.02605935] [-0.08100931 0.00836422 -0.06135899] [ 0.09960149 0.05944655 -0.06463363] [ 0.03430851 -0.09886365 -0.01276897] [-0.08334426 0.00998464 0.07455595] [ 0.05654448 0.0466823 -0.02067173] [ 0.01011986 0.06789933 -0.02341861] [-0.08047641 -0.04409259 0.0228769 ] [-0.03410128 -0.02257238 0.02121324]] Final stress: [-0.00065837 -0.00065784 0.0024419 -0.0040034 -0.00400343 -0.00082746] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-0.03772279 -0.02661721 0.00045354] [-0.01553139 -0.0266388 -0.00045351] [ 0.08038297 -0.05376807 -0.03814726] [-0.08101231 -0.00836309 0.0613604 ] [ 0.05123248 0.13387371 -0.02606023] [ 0.09960461 -0.05944837 0.06463568] [-0.08334633 -0.00998547 -0.07455802] [ 0.03431072 0.09886855 0.01276919] [-0.08047977 0.04409309 -0.02287803] [-0.03410247 0.02257182 -0.02121426] [ 0.05654554 -0.04668406 0.02067271] [ 0.01011874 -0.06790212 0.02341979]] Final stress: [-0.00065833 -0.00065781 0.00244204 -0.00400349 0.00400353 0.0008275 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 0.01569268 0.02695381 -0.00046306] [ 0.03819087 0.02693162 0.00046309] [-0.10002332 0.05991885 0.06513466] [ 0.08378661 0.01036701 -0.07503491] [-0.03464271 -0.09973274 0.0128068 ] [-0.08122076 0.05415384 -0.03828345] [ 0.08176082 0.00812651 0.06165716] [-0.05145455 -0.1346327 -0.02628051] [ 0.03419816 -0.02284278 -0.02158805] [ 0.08122582 -0.04467147 -0.02328718] [-0.01021754 0.06847247 0.02383985] [-0.05729608 0.04695558 0.02103559]] Final stress: [-0.00064728 -0.00064675 0.00248731 0.00403054 -0.00403058 0.0008392 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 0.03785298 -0.02670463 -0.00045619] [ 0.01557621 -0.02672639 0.00045616] [-0.0997213 -0.05957946 -0.06477472] [-0.03440288 0.09910878 -0.01277974] [ 0.08346919 -0.01009159 0.07469104] [-0.08061578 -0.05387562 0.03818539] [-0.05129431 0.13408508 0.02612158] [ 0.08122071 -0.00829764 -0.06144332] [-0.0101466 -0.06806083 -0.02353664] [-0.0567547 -0.04675964 -0.02077369] [ 0.03412914 0.02264758 0.02131827] [ 0.08068736 0.04425436 0.02299185]] Final stress: [-0.00065527 -0.00065475 0.00245463 0.00401103 0.00401107 -0.00083076] Minimization converged after 68 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.63967302e-11 4.45445196e-03 -2.67865256e-10] [ 4.40365311e-11 3.36319604e-04 -6.94834812e-10] [-2.20815739e-02 5.26783811e-02 2.22127629e-02] [ 6.43786123e-02 -5.55319439e-02 -1.30912292e-02] [-3.64058835e-02 -1.30730271e-02 -9.44736196e-03] [ 2.20815740e-02 5.26783813e-02 -2.22127628e-02] [ 3.64058821e-02 -1.30730279e-02 9.44736255e-03] [-6.43786130e-02 -5.55319435e-02 1.30912289e-02] [ 2.94082985e-02 1.10499214e-02 1.44780680e-03] [ 2.36022400e-02 2.48128262e-03 1.70831464e-03] [-2.36022391e-02 2.48128292e-03 -1.70831413e-03] [-2.94082975e-02 1.10499215e-02 -1.44780674e-03]] Final stress: [-1.61038579e-03 -1.28468575e-03 -2.38980376e-04 -1.65625546e-12 -2.54075161e-03 3.74592877e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 8.47443837e-12 -3.36216296e-04 -3.21972622e-10] [-1.53019677e-12 -4.45438277e-03 -4.70965307e-10] [-2.20819658e-02 -5.26752408e-02 -2.22137725e-02] [-3.64040971e-02 1.30730815e-02 9.44786328e-03] [ 6.43772525e-02 5.55327359e-02 1.30917442e-02] [ 2.20819658e-02 -5.26752404e-02 2.22137726e-02] [-6.43772530e-02 5.55327357e-02 -1.30917441e-02] [ 3.64040977e-02 1.30730811e-02 -9.44786302e-03] [-2.36032226e-02 -2.48327950e-03 1.70845690e-03] [-2.94093150e-02 -1.10519975e-02 1.44794388e-03] [ 2.94093149e-02 -1.10519975e-02 -1.44794368e-03] [ 2.36032225e-02 -2.48327963e-03 -1.70845687e-03]] Final stress: [-1.61041104e-03 -1.28470828e-03 -2.38993981e-04 2.24071721e-13 2.54074664e-03 5.20145082e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 0.00447556 -0.00327806 -0.00143342] [-0.00078028 0.00364416 0.00252588] [ 0.00367039 -0.00470398 -0.00238434] [-0.00192599 -0.00277559 -0.00381231] [-0.00243554 0.00144424 -0.00173497] [-0.00118346 0.00376624 -0.00447454] [-0.00282734 0.00031303 -0.00067349] [ 0.00717655 -0.00223626 -0.00046248] [-0.00396573 0.00329551 0.00662077] [-0.00028179 0.0014199 0.00129704] [-0.00109594 -0.00193706 0.00995142] [-0.00082643 0.00104786 -0.00541955]] Final stress: [ 5.56713967e-03 2.82394405e-03 3.26791726e-02 6.72838694e-05 -8.64567848e-03 3.44964864e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 54 steps. Final forces: [[-0.01478881 -0.01358485 0.00732464] [ 0.00165686 0.00767678 -0.07930689] [-0.03300809 -0.07797881 0.07549506] [-0.00116569 0.01903273 0.01334787] [-0.05606359 0.08827568 0.07312559] [-0.01102482 -0.05729029 0.00326 ] [ 0.01633334 0.01971857 0.0045931 ] [-0.0019904 0.01549319 -0.00646281] [ 0.01348927 0.01615859 0.06760649] [ 0.06885619 -0.02886488 -0.08886758] [-0.01243025 -0.00749214 0.05020341] [ 0.03013599 0.01885541 -0.12031887]] Final stress: [ 0.00574087 0.00159096 0.03288504 -0.00029392 -0.00828343 -0.00247965] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 53 steps. Final forces: [[ 1.07608453e-03 -4.31145120e-03 6.49852241e-03] [-5.50475851e-03 2.67818441e-03 -2.29503911e-03] [-6.51944858e-05 -1.20334013e-02 -4.87116972e-03] [ 7.77130459e-03 3.69117973e-03 -1.02489563e-04] [-7.91201678e-03 1.57873742e-03 -3.36762518e-03] [-3.21220684e-03 -2.44703451e-03 -4.53397554e-03] [ 1.00359655e-03 3.22958994e-03 -5.95326929e-03] [-4.09175761e-03 3.76006885e-04 -7.61180642e-03] [ 2.97896600e-03 -2.43836152e-03 3.00490250e-03] [ 2.04332870e-03 -3.62358205e-03 1.24553968e-02] [ 4.29998485e-03 8.69004499e-03 2.79047313e-03] [ 1.61266900e-03 4.61008722e-03 3.98607999e-03]] Final stress: [ 5.63803663e-03 2.70931230e-03 3.28157116e-02 -2.84365685e-05 8.62920706e-03 3.33836693e-03] Minimization converged after 69 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.80121950e-10 8.54841491e-04 -3.70199991e-08] [-4.40434106e-10 -8.54843390e-04 1.98215612e-07] [-2.58533321e-04 8.37979821e-08 -3.52937318e-08] [ 1.62091919e-04 3.71481205e-04 -4.11743255e-04] [ 1.62139312e-04 -3.71509820e-04 4.11715301e-04] [ 2.58534223e-04 2.39820089e-08 8.31882734e-09] [-1.62140330e-04 -3.71508927e-04 -4.11719432e-04] [-1.62099607e-04 3.71485445e-04 4.11735581e-04] [ 4.22464705e-04 -5.00890121e-05 -6.89270790e-05] [-4.22467567e-04 5.00611239e-05 -6.89918260e-05] [ 4.22464932e-04 5.00887760e-05 6.88199390e-05] [-4.22454406e-04 -5.01146727e-05 6.89765498e-05]] Final stress: [ 2.61920452e-06 4.48334733e-05 2.40529116e-05 -6.24668632e-12 -4.49636706e-11 1.10805022e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-7.91670896e-10 -2.35795238e-03 4.50819541e-08] [-3.81467136e-10 2.35795248e-03 9.93991155e-08] [ 2.95062445e-04 1.91709936e-08 -7.42038328e-09] [ 3.54573952e-04 -9.65506112e-04 1.48880925e-03] [ 3.54617812e-04 9.65481060e-04 -1.48882869e-03] [-2.95062695e-04 -7.09202037e-08 -2.89888643e-08] [-3.54513093e-04 9.65541770e-04 1.48878051e-03] [-3.54642418e-04 -9.65467239e-04 -1.48884128e-03] [-5.76064946e-04 -1.79348162e-04 1.73540178e-04] [ 5.76047858e-04 1.79353540e-04 1.73481681e-04] [-5.76064082e-04 1.79344597e-04 -1.73521155e-04] [ 5.76046340e-04 -1.79347799e-04 -1.73528563e-04]] Final stress: [ 3.55413727e-05 -1.16272614e-04 -1.26205391e-05 2.92819496e-11 2.99573006e-12 -1.90427286e-11] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 9.70934444e-11 2.69634784e-03 3.37489350e-08] [-5.11811149e-11 -2.69634838e-03 -7.11842600e-08] [-1.28078186e-04 5.94446010e-08 -2.42324904e-08] [-9.70567738e-04 1.27956235e-03 -1.83115454e-03] [-9.70491012e-04 -1.27960688e-03 1.83111755e-03] [ 1.28077797e-04 6.15469762e-08 2.58865716e-08] [ 9.70480046e-04 -1.27961350e-03 -1.83111186e-03] [ 9.70583676e-04 1.27955363e-03 1.83116231e-03] [ 2.00133977e-04 -3.66966016e-04 -6.61246027e-04] [-2.00138269e-04 3.66958593e-04 -6.61124621e-04] [ 2.00134397e-04 3.66964438e-04 6.61185147e-04] [-2.00134734e-04 -3.66973067e-04 6.61207828e-04]] Final stress: [-1.37936318e-05 1.43695909e-04 5.54977437e-05 3.33378688e-12 -1.11185062e-11 2.68496997e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.22462565e-09 -2.73480604e-03 1.14164473e-07] [ 3.23538918e-10 2.73480671e-03 1.37182639e-07] [ 2.08808517e-03 3.14771055e-08 -1.31403081e-08] [-5.45343805e-05 5.27926699e-04 1.84264242e-03] [-5.44093573e-05 -5.27997879e-04 -1.84269938e-03] [-2.08808540e-03 -8.75231816e-08 -3.60755792e-08] [ 5.45798118e-05 -5.27899977e-04 1.84262076e-03] [ 5.43919751e-05 5.28007872e-04 -1.84270860e-03] [-2.54754083e-04 2.82447868e-04 -6.59852693e-04] [ 2.54742909e-04 -2.82435134e-04 -6.59891665e-04] [-2.54749304e-04 -2.82467878e-04 6.59852213e-04] [ 2.54733557e-04 2.82473800e-04 6.59834812e-04]] Final stress: [ 1.46491857e-04 -1.66649529e-05 5.54393650e-05 2.29791340e-11 1.63936001e-11 -1.21618731e-10] Minimization converged after 3 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.49775747e-10 2.77994852e-03 -7.09569736e-09] [-6.57681055e-10 -2.77994792e-03 -4.51098143e-08] [ 6.66361774e-04 2.45243819e-08 -9.18006290e-09] [-5.70094845e-03 -1.03559232e-03 -3.86135076e-03] [-5.70093798e-03 1.03558555e-03 3.86134623e-03] [-6.66362270e-04 -8.87827462e-09 -1.87871297e-09] [ 5.70092396e-03 1.03557789e-03 -3.86133863e-03] [ 5.70097856e-03 -1.03560939e-03 3.86136549e-03] [-3.86782381e-03 8.76380007e-04 1.60542804e-04] [ 3.86781796e-03 -8.76366766e-04 1.60581140e-04] [-3.86783233e-03 -8.76340637e-04 -1.60542848e-04] [ 3.86782309e-03 8.76349422e-04 -1.60540173e-04]] Final stress: [3.37562208e-05 1.66559115e-04 3.02796723e-05 1.39133988e-11 1.46373908e-11 1.17771528e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-2.38050406e-09 -2.95971774e-04 7.20177119e-08] [-3.73655495e-09 2.95973220e-04 6.68084276e-07] [ 1.69901346e-04 1.56293061e-07 -6.74569955e-08] [ 5.03570158e-05 6.29140493e-05 1.73267524e-04] [ 5.05924446e-05 -6.30508770e-05 -1.73387243e-04] [-1.69901258e-04 -1.88097090e-07 -7.90567430e-08] [-5.02781926e-05 -6.28652424e-05 1.73232709e-04] [-5.04859863e-05 6.29859120e-05 -1.73339255e-04] [ 1.39719320e-05 -8.07446527e-05 -1.51528172e-05] [-1.40568809e-05 8.07901028e-05 -1.54318426e-05] [ 1.39574252e-05 8.08102379e-05 1.49677462e-05] [-1.40517293e-05 -8.08091714e-05 1.52495911e-05]] Final stress: [1.49111546e-05 1.84138563e-06 4.26659064e-05 1.50055477e-10 3.39323646e-11 1.77615227e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 8.24810775e-10 -2.69835206e-04 -1.34360935e-07] [ 7.37400585e-10 2.69836655e-04 1.01658282e-06] [ 1.36312466e-04 1.44107798e-07 -6.28637732e-08] [ 9.06344433e-05 -6.16957018e-05 1.77468606e-04] [ 9.08999887e-05 6.15424526e-05 -1.77601396e-04] [-1.36307908e-04 -2.27689174e-07 -9.67498668e-08] [-9.06191223e-05 6.17091586e-05 1.77458896e-04] [-9.09556194e-05 -6.15137230e-05 -1.77627228e-04] [ 3.82321445e-05 -1.29680159e-04 -1.02482411e-04] [-3.82097457e-05 1.29695103e-04 -1.03060400e-04] [ 3.82234557e-05 1.29711332e-04 1.02308056e-04] [-3.82116651e-05 -1.29686330e-04 1.02813270e-04]] Final stress: [ 6.44375997e-07 -1.33113141e-05 -2.43262991e-05 -3.30860323e-11 3.52595994e-11 4.50676872e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.66444135e-03 1.04378847e-02 -2.02835573e-04] [-3.66444136e-03 -1.04378847e-02 2.02833925e-04] [ 1.46842711e-02 -1.24676467e-09 5.17357944e-10] [-1.88795396e-04 -1.38288387e-02 1.15176070e-02] [-1.88798676e-04 1.38288406e-02 -1.15176055e-02] [ 2.37078251e-03 -6.08025350e-10 -2.48107757e-10] [-2.58172673e-03 2.49540536e-03 -3.52829938e-03] [-2.58172697e-03 -2.49540521e-03 3.52829924e-03] [-8.28622532e-04 -1.74928409e-03 -5.74892451e-03] [-1.26393906e-03 6.30778482e-04 -6.00436433e-03] [-8.28622641e-04 1.74928453e-03 5.74892580e-03] [-1.26393891e-03 -6.30779093e-04 6.00436304e-03]] Final stress: [-2.55755550e-04 -1.20897138e-04 6.28895464e-05 -7.59210601e-04 -1.42671145e-13 2.19377687e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.66388567e-03 1.04358819e-02 2.02808675e-04] [ 3.66388568e-03 -1.04358819e-02 -2.02810043e-04] [-2.37088205e-03 -6.07421840e-10 2.55258827e-10] [ 2.58136794e-03 -2.49449541e-03 -3.52757448e-03] [ 2.58136735e-03 2.49449576e-03 3.52757478e-03] [-1.46790511e-02 -5.77665174e-11 -7.83088771e-12] [ 1.88820307e-04 1.38248220e-02 1.15160558e-02] [ 1.88820665e-04 -1.38248222e-02 -1.15160556e-02] [ 1.26185705e-03 -6.30546708e-04 -6.00359117e-03] [ 8.29035766e-04 1.74834177e-03 -5.74819424e-03] [ 1.26185698e-03 6.30546961e-04 6.00359171e-03] [ 8.29035717e-04 -1.74834153e-03 5.74819434e-03]] Final stress: [-2.55713505e-04 -1.20862710e-04 6.28859562e-05 7.59119868e-04 3.78668617e-13 -3.04666234e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.46843705e-03 -5.47995520e-03 -6.95379403e-08] [-2.46843706e-03 5.47995520e-03 6.91093232e-08] [-1.24960224e-03 -2.18273051e-11 6.76579782e-12] [-9.48079830e-04 7.12020718e-04 1.93672778e-03] [-9.48079951e-04 -7.12020648e-04 -1.93672773e-03] [ 6.48078439e-03 2.07130027e-11 1.41481553e-11] [ 5.04681903e-05 -4.26845528e-03 -5.66700540e-03] [ 5.04685688e-05 4.26845506e-03 5.66700557e-03] [-3.82551167e-04 7.71108595e-03 1.38251845e-03] [ 1.13300867e-03 -1.11960187e-04 1.39634320e-03] [-3.82551200e-04 -7.71108576e-03 -1.38251843e-03] [ 1.13300868e-03 1.11960140e-04 -1.39634304e-03]] Final stress: [ 2.86685560e-05 1.76708909e-05 -8.04795197e-07 -2.50526369e-04 9.52234043e-14 5.35744569e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.46694914e-03 -5.47889954e-03 8.53984479e-08] [ 2.46694915e-03 5.47889954e-03 -8.54158911e-08] [-6.47621685e-03 -2.10144354e-10 8.33619056e-11] [-5.19962815e-05 4.26558097e-03 -5.66535059e-03] [-5.19965083e-05 -4.26558084e-03 5.66535069e-03] [ 1.24722078e-03 2.51655529e-11 4.95618285e-12] [ 9.48465140e-04 -7.11077549e-04 1.93553330e-03] [ 9.48464853e-04 7.11077712e-04 -1.93553343e-03] [-1.13139182e-03 1.12058899e-04 1.39676819e-03] [ 3.82472092e-04 -7.70325879e-03 1.38295765e-03] [-1.13139179e-03 -1.12059082e-04 -1.39676805e-03] [ 3.82472094e-04 7.70325887e-03 -1.38295783e-03]] Final stress: [ 2.87381994e-05 1.76484695e-05 -8.03337760e-07 2.50505137e-04 -1.12018806e-13 -6.01430205e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-2.03245938e-11 1.44534299e-02 -1.16988271e-10] [-1.69098137e-11 -7.21281471e-03 -1.45533854e-09] [ 6.54607148e-03 4.20871070e-03 8.67780542e-03] [ 7.28015936e-03 -1.32284162e-02 -4.83479947e-04] [-4.51017281e-03 3.34755724e-03 -7.77153259e-03] [-6.54607150e-03 4.20871195e-03 -8.67780492e-03] [ 4.51017219e-03 3.34755689e-03 7.77153287e-03] [-7.28015758e-03 -1.32284172e-02 4.83480748e-04] [ 3.39355159e-05 5.97141512e-04 -5.91353948e-03] [-1.14377220e-03 1.45469932e-03 -5.84074542e-03] [ 1.14377163e-03 1.45469924e-03 5.84074604e-03] [-3.39360618e-05 5.97141302e-04 5.91353883e-03]] Final stress: [-2.83050666e-04 -9.43599950e-05 6.26398517e-05 9.41263496e-13 -7.61060551e-04 3.09928535e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 2.34991872e-11 7.21461004e-03 3.95680257e-10] [ 2.45298379e-11 -1.44564803e-02 -7.35199758e-10] [ 6.54923862e-03 -4.20991899e-03 -8.67925871e-03] [-4.51166542e-03 -3.34858571e-03 7.77264930e-03] [ 7.28219552e-03 1.32331789e-02 4.83853694e-04] [-6.54923861e-03 -4.20991899e-03 8.67925871e-03] [-7.28219601e-03 1.32331786e-02 -4.83853461e-04] [ 4.51166454e-03 -3.34858520e-03 -7.77264967e-03] [ 1.14569613e-03 -1.45614612e-03 -5.84148162e-03] [-3.50962231e-05 -5.97593222e-04 -5.91448194e-03] [ 3.50968978e-05 -5.97593169e-04 5.91448273e-03] [-1.14569550e-03 -1.45614586e-03 5.84148130e-03]] Final stress: [-2.83106859e-04 -9.43936540e-05 6.26431066e-05 -1.04991594e-12 7.61165956e-04 -4.79188237e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.84706943e-12 -2.94669619e-03 1.84956269e-10] [-5.85802980e-12 7.90565693e-03 -1.96422526e-10] [-3.80773603e-03 1.42391571e-03 4.43501349e-03] [ 1.36257130e-03 8.92192395e-04 -4.09492111e-03] [-2.31839665e-03 -4.04734755e-03 -2.67270072e-04] [ 3.80773603e-03 1.42391571e-03 -4.43501349e-03] [ 2.31839695e-03 -4.04734739e-03 2.67269938e-04] [-1.36257129e-03 8.92192389e-04 4.09492112e-03] [ 3.09706115e-03 3.64914667e-03 1.47740819e-03] [ 4.51165300e-03 -4.39738762e-03 1.30581511e-03] [-4.51165311e-03 -4.39738774e-03 -1.30581486e-03] [-3.09706132e-03 3.64914670e-03 -1.47740830e-03]] Final stress: [ 2.48157400e-05 2.15691844e-05 -8.32243277e-07 2.52427910e-13 -2.50143514e-04 -2.60730734e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.56764227e-12 -7.90492367e-03 -3.32142366e-10] [-5.17943061e-14 2.94683393e-03 4.88109082e-10] [-3.80675503e-03 -1.42375425e-03 -4.43448792e-03] [-2.31863825e-03 4.04653540e-03 2.67003048e-04] [ 1.36195266e-03 -8.91750988e-04 4.09465332e-03] [ 3.80675504e-03 -1.42375412e-03 4.43448795e-03] [-1.36195288e-03 -8.91751114e-04 -4.09465324e-03] [ 2.31863838e-03 4.04653533e-03 -2.67003007e-04] [-4.51038268e-03 4.39618284e-03 1.30594698e-03] [-3.09596085e-03 -3.64816812e-03 1.47754303e-03] [ 3.09596089e-03 -3.64816807e-03 -1.47754357e-03] [ 4.51038272e-03 4.39618283e-03 -1.30594675e-03]] Final stress: [ 2.48375229e-05 2.15611128e-05 -8.31924774e-07 -1.25296039e-13 2.50138542e-04 1.82699260e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 4.28512017e-03 1.74165349e-03 1.69543745e-05] [-4.28510455e-03 -1.74165446e-03 1.67080125e-05] [ 2.48841202e-04 6.65418701e-03 -5.58395463e-03] [ 1.13175829e-02 9.51591031e-03 5.71542122e-03] [ 6.65020387e-03 -4.38671953e-03 -1.57326557e-04] [-2.48837340e-04 -6.65356180e-03 -5.58369387e-03] [-1.13183392e-02 -9.51635001e-03 5.71577714e-03] [-6.64989647e-03 4.38654606e-03 -1.57169262e-04] [ 1.11612891e-02 1.71107656e-03 -9.88090926e-04] [-1.11610748e-02 -1.71113436e-03 -9.87569059e-04] [ 8.48812400e-03 5.99758112e-03 9.96327279e-04] [-8.48790880e-03 -5.99753438e-03 9.96616289e-04]] Final stress: [-7.74371675e-05 2.30561137e-04 7.81162812e-05 -3.76608414e-10 -1.26551751e-12 -1.11578632e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.30277301e-03 1.74972200e-03 -1.64888476e-05] [ 4.30279591e-03 -1.74971414e-03 -1.77799367e-05] [ 2.37241638e-04 -6.67333764e-03 5.59999817e-03] [ 6.66337127e-03 4.38200867e-03 1.52571947e-04] [ 1.13503301e-02 -9.51787957e-03 -5.72710646e-03] [-2.37239493e-04 6.67304449e-03 5.59987953e-03] [-6.66354000e-03 -4.38211398e-03 1.52639587e-04] [-1.13507845e-02 9.51815120e-03 -5.72731556e-03] [ 8.50229170e-03 -6.00825144e-03 -9.62876942e-04] [-8.50197818e-03 6.00823741e-03 -9.62404728e-04] [ 1.11855565e-02 -1.71587107e-03 9.54813823e-04] [-1.11852719e-02 1.71600405e-03 9.54069410e-04]] Final stress: [-7.83828731e-05 2.30284406e-04 7.72814306e-05 -5.09413882e-10 1.14155626e-10 1.11861661e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.07766680e-05 -1.27325691e-05 2.78153351e-07] [-1.07766050e-05 1.27326680e-05 2.93223423e-07] [-2.42339892e-04 -1.38811540e-04 1.08331348e-04] [ 2.21691962e-04 -1.48832155e-04 -7.46216075e-06] [ 3.09150574e-04 2.05182543e-05 -1.01287900e-04] [ 2.42339960e-04 1.38811254e-04 1.08331295e-04] [-2.21695072e-04 1.48830436e-04 -7.46074902e-06] [-3.09149466e-04 -2.05189120e-05 -1.01287346e-04] [ 2.50350348e-04 -2.89201157e-04 -3.45294105e-05] [-2.50349095e-04 2.89202206e-04 -3.45354963e-05] [-1.31792703e-05 -5.90597625e-05 3.46604732e-05] [ 1.31798873e-05 5.90612772e-05 3.46685699e-05]] Final stress: [-1.59837375e-05 -1.09893658e-05 1.88977893e-06 -1.57550374e-12 2.17019557e-12 1.55428003e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.08138248e-05 -1.27515125e-05 -2.87831264e-07] [ 1.08139517e-05 1.27516449e-05 -2.79581004e-07] [-2.42334391e-04 1.38748199e-04 -1.08298179e-04] [ 3.09183890e-04 -2.05607435e-05 1.01290151e-04] [ 2.21744367e-04 1.48790268e-04 7.42845207e-06] [ 2.42334459e-04 -1.38755030e-04 -1.08300934e-04] [-3.09183286e-04 2.05611521e-05 1.01289722e-04] [-2.21748759e-04 -1.48787692e-04 7.42636132e-06] [-1.30396708e-05 5.90346819e-05 -3.48233708e-05] [ 1.30419355e-05 -5.90332729e-05 -3.48300014e-05] [ 2.50301947e-04 2.89087447e-04 3.46920429e-05] [-2.50300619e-04 -2.89085141e-04 3.46931686e-05]] Final stress: [-1.59856945e-05 -1.09899976e-05 1.89204103e-06 -3.04901832e-12 3.16954638e-12 -1.55544443e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.08078693e-11 -8.57542572e-04 1.61987699e-08] [ 8.04885492e-10 8.57544715e-04 2.31436672e-07] [ 4.34011838e-04 4.13627381e-08 -1.87343316e-08] [-1.62218527e-04 -1.88928587e-04 4.49231731e-04] [-1.62056595e-04 1.88836238e-04 -4.49308607e-04] [-4.34010935e-04 -5.04059037e-08 -2.09446122e-08] [ 1.62160468e-04 1.88896475e-04 4.49258218e-04] [ 1.62093901e-04 -1.88857809e-04 -4.49290937e-04] [-3.37556420e-04 3.24359810e-05 -4.44674434e-05] [ 3.37573474e-04 -3.24080672e-05 -4.45467454e-05] [-3.37559326e-04 -3.24248356e-05 4.43962779e-05] [ 3.37561337e-04 3.24575054e-05 4.45195489e-05]] Final stress: [ 4.54600914e-05 3.98465216e-06 2.40919238e-05 -1.64293597e-11 5.05772602e-11 -7.94634177e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.58985508e-10 2.34679864e-03 4.01238309e-08] [-4.25076779e-11 -2.34679926e-03 8.80813954e-08] [-1.51633460e-03 4.65754619e-08 -1.89998454e-08] [ 2.19562938e-04 -2.37050934e-06 -1.49320299e-03] [ 2.19616330e-04 2.33935267e-06 1.49317690e-03] [ 1.51633490e-03 -2.78484732e-08 -1.16106835e-08] [-2.19568407e-04 2.36728546e-06 -1.49320031e-03] [-2.19622213e-04 -2.33622058e-06 1.49317460e-03] [ 5.41132408e-04 1.15975279e-04 1.77200527e-04] [-5.41129185e-04 -1.15985604e-04 1.77182082e-04] [ 5.41133052e-04 -1.15978305e-04 -1.77227533e-04] [-5.41125535e-04 1.15970624e-04 -1.77200869e-04]] Final stress: [-1.14685481e-04 3.36700114e-05 -1.27187436e-05 -8.76002211e-12 -1.47559428e-11 2.44509603e-11] Minimization converged after 7 steps. Minimization converged after 8 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.35530306e-09 2.54169588e-04 4.10588006e-07] [ 1.21999752e-09 -2.54168606e-04 5.12949683e-07] [-7.60453134e-05 3.80119339e-07 -1.59407369e-07] [-1.10330597e-04 1.37813531e-04 -1.62080267e-04] [-1.09697779e-04 -1.38178987e-04 1.61772540e-04] [ 7.60470027e-05 -8.88733512e-08 -3.66680076e-08] [ 1.10002521e-04 -1.38002666e-04 -1.61924201e-04] [ 1.09920635e-04 1.38051355e-04 1.61882166e-04] [-2.38063739e-05 8.93425203e-06 -8.49075322e-05] [ 2.38600955e-05 -8.93471641e-06 -8.47516528e-05] [-2.38168608e-05 -8.89523189e-06 8.45146645e-05] [ 2.38630959e-05 8.92023602e-06 8.47668196e-05]] Final stress: [ 3.25288523e-06 1.47881980e-05 4.42084765e-05 -8.55035619e-11 2.47993884e-11 1.10248497e-10] Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.61918806e-03 -1.08442122e-02 1.99510705e-04] [-3.61918807e-03 1.08442121e-02 -1.99510503e-04] [-4.36519804e-03 4.41674853e-10 -1.63305437e-10] [ 3.65432295e-04 -2.63949114e-03 3.76020457e-03] [ 3.65431879e-04 2.63949138e-03 -3.76020436e-03] [ 2.09904313e-02 -2.79821426e-10 -1.11843075e-10] [-3.03989507e-03 -8.62085968e-03 -1.10119051e-02] [-3.03989601e-03 8.62086022e-03 1.10119047e-02] [-1.58478489e-03 -1.40806111e-04 -6.00800767e-03] [-4.34180360e-04 -9.79150372e-04 -5.74895366e-03] [-1.58478481e-03 1.40805868e-04 6.00800812e-03] [-4.34180195e-04 9.79149714e-04 5.74895350e-03]] Final stress: [-9.45895873e-05 -2.83083948e-04 6.26108906e-05 -7.61180410e-04 -7.93422961e-13 9.06779615e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.61932811e-03 -1.08447640e-02 -1.99516794e-04] [ 3.61932811e-03 1.08447640e-02 1.99515035e-04] [-2.09921098e-02 1.72122261e-10 -4.95911157e-11] [ 3.04004942e-03 8.62159666e-03 -1.10122631e-02] [ 3.04004929e-03 -8.62159660e-03 1.10122632e-02] [ 4.36563092e-03 5.17426723e-10 2.23847919e-10] [-3.65516908e-04 2.63952493e-03 3.76041091e-03] [-3.65516416e-04 -2.63952522e-03 -3.76041063e-03] [ 4.34043484e-04 9.79329626e-04 -5.74908652e-03] [ 1.58533510e-03 1.40707034e-04 -6.00815055e-03] [ 4.34043562e-04 -9.79329842e-04 5.74908689e-03] [ 1.58533515e-03 -1.40707256e-04 6.00815140e-03]] Final stress: [-9.45990904e-05 -2.83097844e-04 6.26098871e-05 7.61202903e-04 -4.88539389e-13 1.15015858e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.47732841e-03 5.42159707e-03 -6.34609429e-08] [-2.47732841e-03 -5.42159708e-03 6.35995097e-08] [ 7.07997583e-03 6.31332576e-11 -1.39656869e-11] [-2.98433922e-04 -3.70315579e-03 5.73119270e-03] [-2.98434180e-04 3.70315593e-03 -5.73119257e-03] [-1.79197548e-03 -3.25522541e-10 -1.34360037e-10] [-6.20870271e-04 1.36947562e-04 -1.90173447e-03] [-6.20870774e-04 -1.36947271e-04 1.90173423e-03] [ 1.07910094e-03 -2.20215376e-04 1.39936704e-03] [-3.26468155e-04 7.81572653e-03 1.38566580e-03] [ 1.07910092e-03 2.20215412e-04 -1.39936672e-03] [-3.26468089e-04 -7.81572673e-03 -1.38566600e-03]] Final stress: [ 2.15454468e-05 2.48921980e-05 -8.38296926e-07 -2.50127386e-04 -1.62444322e-13 4.39532741e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.47549773e-03 5.42030858e-03 4.49223554e-08] [ 2.47549774e-03 -5.42030858e-03 -4.41569248e-08] [ 1.79001803e-03 4.71964949e-10 -2.03396423e-10] [ 6.20361483e-04 -1.35311968e-04 -1.90050574e-03] [ 6.20362737e-04 1.35311240e-04 1.90050514e-03] [-7.07522031e-03 1.68526491e-10 7.57873595e-11] [ 2.97074805e-04 3.69883777e-03 5.72908254e-03] [ 2.97074903e-04 -3.69883783e-03 -5.72908247e-03] [ 3.26299734e-04 -7.80607712e-03 1.38618956e-03] [-1.07663328e-03 2.20154110e-04 1.39987331e-03] [ 3.26299751e-04 7.80607701e-03 -1.38619012e-03] [-1.07663332e-03 -2.20153861e-04 -1.39987285e-03]] Final stress: [ 2.15186845e-05 2.49765579e-05 -8.36385948e-07 2.50099334e-04 9.69800079e-14 -7.82025648e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.58568208e-11 -6.79576680e-03 -3.87807351e-10] [-4.24010340e-12 1.41226427e-02 2.45728454e-09] [-1.22746766e-02 5.03399697e-03 8.53035647e-03] [ 7.28598901e-03 -2.50534097e-03 -8.46311801e-03] [-3.52039881e-03 -8.25017899e-03 -5.07618241e-04] [ 1.22746766e-02 5.03399607e-03 -8.53035687e-03] [ 3.52039992e-03 -8.25017834e-03 5.07617700e-04] [-7.28598966e-03 -2.50534061e-03 8.46311769e-03] [-7.71177534e-04 2.21439301e-03 -5.84799719e-03] [-3.58813367e-04 -1.56307956e-04 -5.90809361e-03] [ 3.58813134e-04 -1.56308062e-04 5.90809188e-03] [ 7.71177308e-04 2.21439302e-03 5.84799811e-03]] Final stress: [-1.21097687e-04 -2.55780498e-04 6.28654236e-05 4.20316867e-13 -7.59276269e-04 -2.83075833e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.70704593e-11 -1.41221420e-02 9.89675272e-11] [-3.35657985e-12 6.79550139e-03 -1.20646332e-09] [-1.22739876e-02 -5.03373348e-03 -8.53007192e-03] [-3.52003250e-03 8.24940758e-03 5.07589267e-04] [ 7.28561011e-03 2.50533279e-03 8.46286316e-03] [ 1.22739876e-02 -5.03373267e-03 8.53007226e-03] [-7.28560980e-03 2.50533296e-03 -8.46286327e-03] [ 3.52003295e-03 8.24940732e-03 -5.07589045e-04] [ 3.58840645e-04 1.56483623e-04 -5.90773730e-03] [ 7.70672821e-04 -2.21417049e-03 -5.84767403e-03] [-7.70673105e-04 -2.21417092e-03 5.84767496e-03] [-3.58841079e-04 1.56483887e-04 5.90773702e-03]] Final stress: [-1.21097658e-04 -2.55776817e-04 6.28582853e-05 6.21589149e-13 7.59253387e-04 -1.49716347e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.39210175e-12 7.93382981e-03 -1.88532474e-10] [ 3.98719056e-12 -3.01102423e-03 -4.61186134e-11] [ 4.48361016e-03 1.53551702e-03 4.35632888e-03] [ 1.90047886e-03 -3.55725990e-03 -3.50440585e-04] [-1.53331104e-03 3.08481858e-04 -4.07979087e-03] [-4.48361015e-03 1.53551716e-03 -4.35632882e-03] [ 1.53331082e-03 3.08481726e-04 4.07979097e-03] [-1.90047880e-03 -3.55725994e-03 3.50440614e-04] [ 4.52914653e-03 -4.26752590e-03 1.30558419e-03] [ 3.03069162e-03 3.51938412e-03 1.47787255e-03] [-3.03069156e-03 3.51938416e-03 -1.47787259e-03] [-4.52914645e-03 -4.26752589e-03 -1.30558409e-03]] Final stress: [ 1.75824955e-05 2.89651600e-05 -8.06151575e-07 -1.49182888e-13 -2.50424340e-04 5.82468010e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.01699836e-13 3.00991553e-03 2.15076173e-10] [ 2.58415661e-12 -7.94055514e-03 3.82499767e-11] [ 4.49090696e-03 -1.53941389e-03 -4.36040953e-03] [-1.53704647e-03 -3.13537732e-04 4.08280897e-03] [ 1.90288625e-03 3.56482488e-03 3.51427194e-04] [-4.49090696e-03 -1.53941422e-03 4.36040940e-03] [-1.90288596e-03 3.56482504e-03 -3.51427320e-04] [ 1.53704602e-03 -3.13537463e-04 -4.08280916e-03] [-3.03782029e-03 -3.52714648e-03 1.47677628e-03] [-4.54252283e-03 4.28059297e-03 1.30449993e-03] [ 4.54252291e-03 4.28059292e-03 -1.30449976e-03] [ 3.03782037e-03 -3.52714641e-03 -1.47677625e-03]] Final stress: [ 1.76347567e-05 2.87885948e-05 -8.10612399e-07 -9.06815652e-14 2.50486810e-04 -2.40260927e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[ 0.12179505 -0.06136739 0.00240978] [-0.12179564 0.06136616 0.00239206] [ 0.11315005 -0.29422713 0.00163598] [ 0.24069 0.28810059 0.2265508 ] [ 0.57287465 -0.31223543 -0.23477602] [-0.11314986 0.29419316 0.00162077] [-0.24065464 -0.28808009 0.22653402] [-0.57291558 0.3122592 -0.23479536] [ 0.33375578 -0.2994071 -0.05179475] [-0.33375432 0.29940187 -0.05181275] [ 0.4939461 -0.14484585 0.05603545] [-0.4939416 0.14484202 0.05600002]] Final stress: [ 3.75194140e-03 1.30935383e-02 2.18360346e-02 4.13813362e-08 9.51695876e-09 -2.02422244e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 16 steps. Final forces: [[-0.11936995 -0.06020006 -0.00240454] [ 0.11937064 0.06019944 -0.00238888] [ 0.11355955 0.29489671 -0.00097482] [ 0.57321475 0.31305194 0.23497874] [ 0.24047148 -0.28844235 -0.2273859 ] [-0.11355963 -0.29492694 -0.00098782] [-0.5731971 -0.31304134 0.23497016] [-0.24049106 0.28845394 -0.22739515] [ 0.49084132 0.14472854 -0.05443806] [-0.49083981 -0.14472438 -0.05446132] [ 0.33640798 0.30245268 0.0502482 ] [-0.33640818 -0.30244817 0.05023939]] Final stress: [ 3.78281781e-03 1.31134416e-02 2.17932150e-02 -3.61031974e-08 1.64042799e-08 2.04249899e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.70889754e-05 1.20005474e-06 2.76487841e-07] [-1.70888426e-05 -1.20008243e-06 2.96261949e-07] [-2.00742343e-04 9.02093348e-05 2.17313017e-05] [ 3.51836956e-04 -1.02916869e-04 9.21999691e-05] [ 2.36378004e-04 8.11820982e-05 -1.14349948e-04] [ 2.00742460e-04 -9.02066889e-05 2.17323951e-05] [-3.51840530e-04 1.02914853e-04 9.22016103e-05] [-2.36378415e-04 -8.11819161e-05 -1.14350042e-04] [ 3.83774278e-04 2.64304257e-05 -3.47510931e-05] [-3.83772510e-04 -2.64312873e-05 -3.47590041e-05] [ 3.80297751e-05 -4.81209205e-05 3.48806878e-05] [-3.80278087e-05 4.81209977e-05 3.48913731e-05]] Final stress: [-1.37615479e-05 -1.32076021e-05 1.89466781e-06 -3.17249219e-12 -6.56653259e-13 2.88082281e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.70909134e-05 1.20104545e-06 -2.80317185e-07] [ 1.70910920e-05 -1.20112666e-06 -2.83931601e-07] [-2.00721614e-04 -9.02337514e-05 -2.17177439e-05] [ 2.36347858e-04 -8.11713118e-05 1.14337893e-04] [ 3.51852525e-04 1.02942941e-04 -9.22005267e-05] [ 2.00721654e-04 9.02312387e-05 -2.17188505e-05] [-2.36346319e-04 8.11721340e-05 1.14337073e-04] [-3.51859468e-04 -1.02938908e-04 -9.22037376e-05] [ 3.80402011e-05 4.81349645e-05 -3.48342979e-05] [-3.80378866e-05 -4.81367368e-05 -3.48352889e-05] [ 3.83781862e-04 -2.64142796e-05 3.47020565e-05] [-3.83778991e-04 2.64137906e-05 3.46976710e-05]] Final stress: [-1.37609723e-05 -1.32072282e-05 1.89394369e-06 -4.34690319e-12 -1.89030040e-12 -2.88103664e-06] Minimization converged after 5 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.42188867e-02 -3.01802123e-03 -8.43346479e-05] [-2.42188868e-02 3.01802121e-03 8.43347680e-05] [ 7.13540120e-02 -2.40831046e-10 1.00817986e-10] [ 5.07379073e-03 -5.04891593e-02 5.02023324e-02] [ 5.07378984e-03 5.04891598e-02 -5.02023320e-02] [ 9.11354943e-02 -1.54230456e-10 -4.23255489e-11] [ 8.19515653e-04 -4.01133005e-02 -4.29650409e-02] [ 8.19516390e-04 4.01133001e-02 4.29650412e-02] [-3.44184989e-02 3.72375812e-03 1.33516855e-02] [-2.85006738e-02 1.65271157e-02 1.35010311e-02] [-3.44184989e-02 -3.72375753e-03 -1.33516857e-02] [-2.85006738e-02 -1.65271160e-02 -1.35010317e-02]] Final stress: [-1.32135489e-04 -6.01717411e-04 2.57573545e-04 -3.15000298e-03 -2.30381845e-13 2.23947006e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.42188868e-02 -3.01802125e-03 8.43344514e-05] [ 2.42188869e-02 3.01802129e-03 -8.43345642e-05] [-9.11354947e-02 2.17121047e-10 -1.25625589e-10] [-8.19516002e-04 4.01133006e-02 -4.29650412e-02] [-8.19515487e-04 -4.01133009e-02 4.29650409e-02] [-7.13540123e-02 -3.64275486e-12 -3.06619477e-11] [-5.07379092e-03 5.04891594e-02 5.02023328e-02] [-5.07379000e-03 -5.04891600e-02 -5.02023323e-02] [ 2.85006742e-02 -1.65271157e-02 1.35010313e-02] [ 3.44184989e-02 -3.72375770e-03 1.33516859e-02] [ 2.85006739e-02 1.65271163e-02 -1.35010316e-02] [ 3.44184988e-02 3.72375779e-03 -1.33516854e-02]] Final stress: [-1.32135489e-04 -6.01717412e-04 2.57573550e-04 3.15000300e-03 8.22117884e-13 1.05180098e-12] Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.75787132e-11 2.72350424e-02 -2.53408781e-10] [ 3.01340407e-11 2.12026293e-02 5.63170595e-10] [-4.11361813e-03 2.30940525e-02 5.35899888e-02] [ 5.02265806e-02 -6.20532394e-02 -3.07186399e-02] [-4.04778715e-02 -4.81787473e-02 -2.34725112e-02] [ 4.11361819e-03 2.30940527e-02 -5.35899888e-02] [ 4.04778720e-02 -4.81787470e-02 2.34725110e-02] [-5.02265801e-02 -6.20532397e-02 3.07186400e-02] [ 1.30832556e-02 3.78496466e-02 1.31942331e-02] [ 7.16781510e-03 2.50694517e-02 1.36584906e-02] [-7.16781563e-03 2.50694515e-02 -1.36584909e-02] [-1.30832561e-02 3.78496466e-02 -1.31942329e-02]] Final stress: [-6.01677718e-04 -1.32174971e-04 2.57573502e-04 7.30021648e-13 -3.15000061e-03 -3.78905171e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.30941220e-12 -2.12026294e-02 -1.44451929e-10] [ 3.51696660e-11 -2.72350427e-02 -7.29068151e-10] [-4.11361810e-03 -2.30940524e-02 -5.35899892e-02] [-4.04778725e-02 4.81787473e-02 2.34725111e-02] [ 5.02265806e-02 6.20532400e-02 3.07186403e-02] [ 4.11361815e-03 -2.30940525e-02 5.35899892e-02] [-5.02265798e-02 6.20532404e-02 -3.07186406e-02] [ 4.04778720e-02 4.81787476e-02 -2.34725113e-02] [-7.16781593e-03 -2.50694520e-02 1.36584909e-02] [-1.30832558e-02 -3.78496471e-02 1.31942334e-02] [ 1.30832557e-02 -3.78496475e-02 -1.31942323e-02] [ 7.16781564e-03 -2.50694518e-02 -1.36584906e-02]] Final stress: [-6.01677718e-04 -1.32174971e-04 2.57573511e-04 7.46074904e-13 3.15000063e-03 -7.25003785e-13] Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 4.65976983e-03 -6.47831921e-05 1.08249102e-05] [-4.65976884e-03 6.47832747e-05 1.08530622e-05] [ 4.19985912e-03 -2.74322581e-04 -3.29734285e-03] [ 2.33707550e-03 7.66429188e-03 3.89961051e-03] [ 4.02563833e-03 -5.33792510e-03 -6.21398054e-04] [-4.19985825e-03 2.74343213e-04 -3.29733449e-03] [-2.33710569e-03 -7.66430969e-03 3.89962434e-03] [-4.02563490e-03 5.33792340e-03 -6.21396099e-04] [ 5.58601249e-03 -2.20611897e-03 -9.35985155e-04] [-5.58600038e-03 2.20611423e-03 -9.35986042e-04] [ 4.76974884e-03 -1.95236702e-04 9.44252112e-04] [-4.76973605e-03 1.95240232e-04 9.44277749e-04]] Final stress: [ 1.94502775e-04 2.94054772e-04 1.32898941e-04 -2.65349500e-11 -1.90824646e-12 -2.11611753e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.66451577e-03 -6.47669755e-05 -1.07957323e-05] [ 4.66451598e-03 6.47664381e-05 -1.07869590e-05] [ 4.19523781e-03 2.89216273e-04 3.29742490e-03] [ 4.04390491e-03 5.32366442e-03 6.21844275e-04] [ 2.32577366e-03 -7.67178496e-03 -3.90020681e-03] [-4.19523803e-03 -2.89157367e-04 3.29744908e-03] [-4.04394824e-03 -5.32368940e-03 6.21865056e-04] [-2.32573939e-03 7.67176486e-03 -3.90018996e-03] [ 4.76780086e-03 1.90099583e-04 -9.31757746e-04] [-4.76779774e-03 -1.90106790e-04 -9.31729706e-04] [ 5.59022774e-03 2.20142099e-03 9.23423602e-04] [-5.59022176e-03 -2.20142707e-03 9.23460002e-04]] Final stress: [ 1.94258964e-04 2.93832983e-04 1.32567533e-04 -2.23864700e-12 -1.03248151e-11 2.11810798e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.20868403e-04 -3.26202909e-06 3.69469995e-09] [-3.20868403e-04 3.26202735e-06 -3.66228391e-09] [ 9.57298338e-04 2.05376084e-11 -8.89270504e-12] [-2.47881868e-04 -2.63357609e-03 1.17016452e-03] [-2.47881875e-04 2.63357609e-03 -1.17016452e-03] [ 3.20130687e-03 2.21641166e-12 1.29447787e-12] [-1.37517509e-03 -7.04474956e-04 -1.15826632e-03] [-1.37517512e-03 7.04474970e-04 1.15826631e-03] [-6.53377572e-05 1.47908314e-03 3.87253147e-04] [-7.00394719e-05 1.49334139e-03 3.87256136e-04] [-6.53377493e-05 -1.47908316e-03 -3.87253155e-04] [-7.00394627e-05 -1.49334141e-03 -3.87256144e-04]] Final stress: [-5.86276183e-05 -5.90402211e-05 -2.50357643e-05 -7.83037930e-05 -4.78370916e-14 1.73953686e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.20996641e-04 -3.26125279e-06 -3.63470500e-09] [ 3.20996641e-04 3.26125269e-06 3.69972622e-09] [-3.20062454e-03 -4.68220250e-12 1.79286890e-12] [ 1.37506638e-03 7.05086631e-04 -1.15819398e-03] [ 1.37506640e-03 -7.05086644e-04 1.15819397e-03] [-9.57851607e-04 -3.88332520e-11 -1.65499359e-11] [ 2.48388100e-04 2.63311940e-03 1.17009117e-03] [ 2.48388036e-04 -2.63311937e-03 -1.17009120e-03] [ 6.97457674e-05 -1.49327722e-03 3.87134549e-04] [ 6.50412133e-05 -1.47902207e-03 3.87131549e-04] [ 6.97457652e-05 1.49327722e-03 -3.87134529e-04] [ 6.50412101e-05 1.47902209e-03 -3.87131578e-04]] Final stress: [-5.85914949e-05 -5.90039682e-05 -2.50166989e-05 7.82920997e-05 1.49763908e-14 -3.62011642e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.54123778e-02 1.83490062e-02 5.62874368e-05] [-2.12838523e-02 1.83472896e-02 -5.62871315e-05] [ 5.79114318e-02 1.63104326e-02 3.26684037e-02] [ 2.95055078e-02 -6.43823807e-02 1.54584231e-02] [-3.29619934e-02 -1.16456386e-02 -4.77278538e-02] [ 4.86755195e-02 1.77435063e-02 -4.05541409e-02] [ 3.23246859e-02 -6.78311955e-02 -1.15116979e-02] [-2.65471809e-02 8.97152718e-04 5.16668702e-02] [ 2.63285165e-03 2.99038071e-02 -1.09788601e-02] [-9.52482544e-03 3.54161150e-02 -1.13733234e-02] [-3.87373045e-02 6.79293291e-04 1.12851269e-02] [-2.65824622e-02 6.21261206e-03 1.10670518e-02]] Final stress: [ 0.00024058 0.00024061 0.00093129 -0.00213387 -0.00213388 -0.00022339] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.12838523e-02 -1.83472896e-02 5.62876667e-05] [-1.54123778e-02 -1.83490061e-02 -5.62866232e-05] [ 5.79114318e-02 -1.63104329e-02 -3.26684036e-02] [-3.29619932e-02 1.16456388e-02 4.77278539e-02] [ 2.95055078e-02 6.43823807e-02 -1.54584232e-02] [ 4.86755195e-02 -1.77435073e-02 4.05541404e-02] [-2.65471801e-02 -8.97152265e-04 -5.16668706e-02] [ 3.23246852e-02 6.78311959e-02 1.15116975e-02] [-3.87373045e-02 -6.79293253e-04 -1.12851266e-02] [-2.65824623e-02 -6.21261198e-03 -1.10670523e-02] [ 2.63285156e-03 -2.99038070e-02 1.09788603e-02] [-9.52482561e-03 -3.54161150e-02 1.13733231e-02]] Final stress: [ 0.00024058 0.00024061 0.00093129 -0.00213387 0.00213388 0.00022339] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.54123778e-02 1.83490062e-02 -5.62873705e-05] [ 2.12838523e-02 1.83472896e-02 5.62882954e-05] [-4.86755195e-02 1.77435064e-02 4.05541408e-02] [ 2.65471807e-02 8.97152644e-04 -5.16668703e-02] [-3.23246857e-02 -6.78311957e-02 1.15116977e-02] [-5.79114318e-02 1.63104324e-02 -3.26684039e-02] [ 3.29619937e-02 -1.16456385e-02 4.77278537e-02] [-2.95055082e-02 -6.43823805e-02 -1.54584233e-02] [ 2.65824623e-02 6.21261201e-03 -1.10670516e-02] [ 3.87373045e-02 6.79293395e-04 -1.12851273e-02] [ 9.52482553e-03 3.54161150e-02 1.13733231e-02] [-2.63285168e-03 2.99038071e-02 1.09788602e-02]] Final stress: [ 0.00024058 0.00024061 0.00093129 0.00213387 -0.00213388 0.00022339] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.12838523e-02 -1.83472896e-02 -5.62877905e-05] [ 1.54123778e-02 -1.83490061e-02 5.62872957e-05] [-4.86755194e-02 -1.77435072e-02 -4.05541405e-02] [-3.23246855e-02 6.78311957e-02 -1.15116977e-02] [ 2.65471801e-02 -8.97152245e-04 5.16668706e-02] [-5.79114318e-02 -1.63104330e-02 3.26684036e-02] [-2.95055080e-02 6.43823806e-02 1.54584232e-02] [ 3.29619934e-02 1.16456386e-02 -4.77278538e-02] [ 9.52482561e-03 -3.54161148e-02 -1.13733230e-02] [-2.63285149e-03 -2.99038070e-02 -1.09788605e-02] [ 2.65824623e-02 -6.21261178e-03 1.10670519e-02] [ 3.87373046e-02 -6.79293201e-04 1.12851267e-02]] Final stress: [ 0.00024058 0.00024061 0.00093129 0.00213387 0.00213388 -0.00022339] Minimization converged after 71 steps. Minimization converged after 71 steps. Minimization converged after 71 steps. Minimization converged after 71 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.95220719e-13 3.23783426e-04 -7.94130277e-12] [-3.70367099e-13 3.17255157e-04 8.94645779e-12] [-1.11720666e-03 1.77446239e-03 1.34454567e-03] [ 2.22478921e-03 -2.09064811e-03 -6.78228509e-04] [-1.11286370e-03 -1.41317579e-04 -6.66327578e-04] [ 1.11720666e-03 1.77446238e-03 -1.34454567e-03] [ 1.11286368e-03 -1.41317589e-04 6.66327587e-04] [-2.22478920e-03 -2.09064811e-03 6.78228513e-04] [ 1.48403575e-03 7.56253762e-05 3.87585029e-04] [ 1.48872974e-03 6.13586463e-05 3.87586281e-04] [-1.48872974e-03 6.13586571e-05 -3.87586294e-04] [-1.48403574e-03 7.56253648e-05 -3.87585026e-04]] Final stress: [-5.91389140e-05 -5.87259588e-05 -2.50876666e-05 -1.67959960e-15 -7.83356261e-05 4.90649890e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.91820012e-13 -3.17864420e-04 3.04823974e-12] [-4.65497586e-13 -3.24385364e-04 1.59091764e-11] [-1.11429824e-03 -1.77561215e-03 -1.34414848e-03] [-1.11469059e-03 1.43324322e-04 6.66131322e-04] [ 2.22369406e-03 2.08760942e-03 6.78027559e-04] [ 1.11429824e-03 -1.77561218e-03 1.34414847e-03] [-2.22369405e-03 2.08760943e-03 -6.78027565e-04] [ 1.11469059e-03 1.43324322e-04 -6.66131322e-04] [-1.48844074e-03 -5.99723236e-05 3.87012085e-04] [-1.48373331e-03 -7.42243660e-05 3.87010813e-04] [ 1.48373329e-03 -7.42243533e-05 -3.87010818e-04] [ 1.48844074e-03 -5.99723368e-05 -3.87012079e-04]] Final stress: [-5.89677114e-05 -5.85553677e-05 -2.49976316e-05 6.20893229e-15 7.82804053e-05 4.56750731e-14] Minimization converged after 70 steps. Minimization converged after 71 steps. Minimization converged after 70 steps. Minimization converged after 71 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.06011755e-09 1.76431555e-02 3.85162105e-07] [-7.06448854e-09 -1.76431523e-02 5.16971369e-07] [-5.35910802e-03 1.11008669e-07 -4.97190590e-08] [ 1.58410482e-04 8.83453563e-03 -1.14321257e-02] [ 1.58823694e-04 -8.83477217e-03 1.14319294e-02] [ 5.35910657e-03 -2.23344721e-07 -9.43129090e-08] [-1.58290362e-04 -8.83446350e-03 -1.14321806e-02] [-1.58733704e-04 8.83471945e-03 1.14319673e-02] [ 5.44243467e-03 -3.42763074e-03 -3.11851628e-03] [-5.44252359e-03 3.42770028e-03 -3.11861121e-03] [ 5.44244273e-03 3.42759975e-03 3.11837422e-03] [-5.44255433e-03 -3.42757958e-03 3.11840478e-03]] Final stress: [-2.78329164e-04 6.96270801e-04 2.66501510e-04 1.62424124e-10 7.47255345e-11 -3.26200044e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 8.37546396e-09 -2.32614366e-03 -5.05620733e-08] [ 3.88874599e-09 2.32615218e-03 -4.90894743e-07] [-7.64914439e-05 4.51941707e-08 -9.80457215e-09] [-5.96035360e-03 -4.91631883e-03 -1.22637551e-03] [-5.96031443e-03 4.91629121e-03 1.22637112e-03] [ 7.64928145e-05 -1.47763864e-07 -4.68076075e-08] [ 5.96003158e-03 4.91613266e-03 -1.22623111e-03] [ 5.96024739e-03 -4.91624573e-03 1.22634193e-03] [-7.21585278e-03 -2.63428420e-03 3.07079045e-03] [ 7.21607066e-03 2.63436163e-03 3.07103731e-03] [-7.21592873e-03 2.63453711e-03 -3.07058535e-03] [ 7.21608628e-03 -2.63437978e-03 -3.07075077e-03]] Final stress: [ 2.25422873e-04 -3.08063616e-04 -5.16939385e-05 -2.91517595e-10 1.95883476e-10 5.17812961e-10] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-5.90588689e-10 2.94733072e-04 1.50903285e-08] [ 2.96331057e-10 -2.94733986e-04 8.33049869e-08] [-2.03802414e-04 4.20496638e-08 -1.63705045e-08] [ 7.14600578e-06 -2.65230966e-05 -1.82205192e-04] [ 7.24119087e-06 2.64682901e-05 1.82162757e-04] [ 2.03802742e-04 -2.42429081e-08 -9.57881876e-09] [-7.13348149e-06 2.65302559e-05 -1.82210687e-04] [-7.24480238e-06 -2.64667058e-05 1.82161271e-04] [ 3.42129084e-05 3.07141975e-04 -5.82748152e-05] [-3.42205055e-05 -3.07154120e-04 -5.83069757e-05] [ 3.42218954e-05 -3.07180174e-04 5.82846029e-05] [-3.42232441e-05 3.07166682e-04 5.83165929e-05]] Final stress: [-6.91030169e-06 8.78624718e-06 1.03295896e-05 5.63744411e-12 -2.13900986e-11 -1.06362322e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-2.92834951e-10 -2.74221679e-04 -6.52794374e-09] [-1.23242960e-09 2.74222915e-04 -2.53412279e-07] [ 1.35890025e-04 -2.56381726e-08 1.44345428e-08] [-1.63574096e-04 -1.28831407e-04 7.72306193e-05] [-1.63629643e-04 1.28863475e-04 -7.71969588e-05] [-1.35891477e-04 -4.76431046e-08 -1.52190581e-08] [ 1.63627574e-04 1.28862111e-04 7.72054058e-05] [ 1.63619544e-04 -1.28856605e-04 -7.72033407e-05] [-2.18440211e-04 -1.01546686e-04 -4.82622043e-05] [ 2.18424361e-04 1.01569293e-04 -4.81780755e-05] [-2.18449963e-04 1.01587605e-04 4.84067107e-05] [ 2.18425411e-04 -1.01575741e-04 4.82585682e-05]] Final stress: [1.50630259e-05 5.83899849e-08 1.32709694e-05 3.57751416e-11 2.94599866e-11 9.94154007e-11] Minimization converged after 2 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.50968387e-04 1.35158119e-03 1.68849202e-05] [-7.50968396e-04 -1.35158120e-03 -1.68860594e-05] [ 1.11199962e-03 -1.19685088e-10 6.63718186e-11] [ 4.19251599e-04 -6.91976399e-04 1.99794682e-03] [ 4.19250898e-04 6.91976797e-04 -1.99794647e-03] [ 2.03208890e-05 -1.66116636e-10 -5.32027329e-11] [-3.01299796e-04 1.07146272e-04 -5.57350115e-04] [-3.01299797e-04 -1.07146263e-04 5.57350128e-04] [ 5.65440031e-05 1.15394143e-04 -1.26943533e-03] [ 1.03126709e-05 1.72009181e-03 -1.25548679e-03] [ 5.65439635e-05 -1.15393989e-04 1.26943595e-03] [ 1.03127374e-05 -1.72009208e-03 1.25548693e-03]] Final stress: [-7.84551848e-06 2.99371979e-08 3.07696911e-05 -8.05761424e-05 -8.83477326e-14 8.75980066e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.51407234e-04 1.35415758e-03 -1.68679827e-05] [ 7.51407233e-04 -1.35415757e-03 1.68676457e-05] [-2.13620636e-05 -2.09125371e-10 8.68399665e-11] [ 2.99733863e-04 -1.10755918e-04 -5.59335881e-04] [ 2.99733547e-04 1.10756095e-04 5.59336034e-04] [-1.11920919e-03 -1.22612395e-10 -4.60443717e-11] [-4.19093639e-04 6.99530531e-04 1.99898360e-03] [-4.19093641e-04 -6.99530526e-04 -1.99898360e-03] [-7.15251157e-06 -1.71819199e-03 -1.25767235e-03] [-5.46091461e-05 -1.14049477e-04 -1.27160327e-03] [-7.15254021e-06 1.71819211e-03 1.25767257e-03] [-5.46091469e-05 1.14049509e-04 1.27160319e-03]] Final stress: [-7.96284760e-06 -9.37634350e-08 3.07526495e-05 8.06771332e-05 1.03141673e-13 1.72417541e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.43901754e-04 -1.59437011e-03 -6.80797511e-06] [-6.43901754e-04 1.59437011e-03 6.80858079e-06] [-1.06032906e-04 1.30544239e-10 -4.84886360e-11] [-1.33980644e-04 -4.76287017e-04 5.04990551e-04] [-1.33980409e-04 4.76286878e-04 -5.04990654e-04] [ 1.64169079e-03 -3.50445489e-10 -1.42248831e-10] [ 2.83133225e-04 -3.25469500e-04 -1.99295021e-03] [ 2.83132633e-04 3.25469843e-04 1.99294993e-03] [-7.03431165e-05 5.82504768e-04 6.26825056e-04] [-2.02736475e-04 -1.37948459e-04 6.22681676e-04] [-7.03431191e-05 -5.82504761e-04 -6.26824933e-04] [-2.02736472e-04 1.37948467e-04 -6.22681834e-04]] Final stress: [ 9.17629338e-07 -2.40115660e-05 -7.86618819e-06 -9.45737143e-05 4.29101349e-15 -7.09644297e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.44262858e-04 -1.60304322e-03 6.78685624e-06] [ 6.44262861e-04 1.60304322e-03 -6.78634260e-06] [-1.65654985e-03 1.11603913e-10 -5.26871483e-11] [-2.79547724e-04 3.29179040e-04 -1.99478983e-03] [-2.79547358e-04 -3.29179244e-04 1.99478965e-03] [ 1.13267516e-04 5.91663327e-11 2.07237522e-11] [ 1.33259163e-04 4.78648966e-04 5.06090131e-04] [ 1.33259200e-04 -4.78648986e-04 -5.06090120e-04] [ 2.00594577e-04 1.39018836e-04 6.23252561e-04] [ 7.30721052e-05 -5.87553590e-04 6.27363666e-04] [ 2.00594583e-04 -1.39018875e-04 -6.23252857e-04] [ 7.30720729e-05 5.87553679e-04 -6.27363683e-04]] Final stress: [ 7.15426875e-07 -2.42813634e-05 -7.98458528e-06 9.47731453e-05 7.58134833e-14 -2.49228885e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.43371722e-12 2.11126591e-03 -2.76193442e-10] [-8.40907082e-12 -6.10093220e-04 2.21881742e-10] [ 5.55322159e-04 1.52057474e-04 1.45811981e-03] [ 6.18728205e-04 -8.27677763e-04 -4.03642830e-05] [ 1.02635197e-04 -1.07682903e-05 -1.46872379e-03] [-5.55322164e-04 1.52057400e-04 -1.45811984e-03] [-1.02635177e-04 -1.07682722e-05 1.46872378e-03] [-6.18727863e-04 -8.27677965e-04 4.03644339e-05] [ 9.43897373e-04 -8.21772763e-04 -1.29623112e-03] [ 8.87782086e-04 7.57575173e-04 -1.23403701e-03] [-8.87782288e-04 7.57575251e-04 1.23403675e-03] [-9.43897516e-04 -8.21772939e-04 1.29623133e-03]] Final stress: [-8.39969023e-06 3.15656223e-07 3.07553094e-05 3.18301984e-13 -8.07260855e-05 5.22216533e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.39662810e-12 6.09199065e-04 -2.06384221e-10] [-2.95867342e-12 -2.11003737e-03 8.10428938e-11] [ 5.54070541e-04 -1.52097160e-04 -1.45726955e-03] [ 1.04041570e-04 1.18901776e-05 1.46860497e-03] [ 6.18388107e-04 8.23553204e-04 3.96519958e-05] [-5.54070543e-04 -1.52097035e-04 1.45726960e-03] [-6.18388144e-04 8.23553183e-04 -3.96519789e-05] [-1.04041347e-04 1.18900456e-05 -1.46860487e-03] [-8.89025807e-04 -7.56626981e-04 -1.23228885e-03] [-9.45038165e-04 8.23699947e-04 -1.29449474e-03] [ 9.45038075e-04 8.23699938e-04 1.29449459e-03] [ 8.89025718e-04 -7.56627016e-04 1.23228897e-03]] Final stress: [-8.33911862e-06 3.75995132e-07 3.07523293e-05 1.48396074e-13 8.06772004e-05 6.33900422e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.09447067e-12 -9.39601470e-04 -6.12041247e-11] [ 3.91965187e-12 2.22943788e-03 8.93876911e-10] [-8.62893762e-04 1.01373068e-04 1.46713659e-03] [ 2.39078051e-04 -5.90484421e-04 -1.45164602e-03] [-6.54062438e-04 -4.32978246e-04 5.01403719e-05] [ 8.62893767e-04 1.01372723e-04 -1.46713674e-03] [ 6.54062726e-04 -4.32978081e-04 -5.01405117e-05] [-2.39078525e-04 -5.90484154e-04 1.45164580e-03] [ 2.94095816e-04 5.11698603e-04 6.64993183e-04] [ 1.49128537e-04 -2.34527276e-04 5.85569608e-04] [-1.49128434e-04 -2.34527297e-04 -5.85570218e-04] [-2.94095744e-04 5.11698668e-04 -6.64992896e-04]] Final stress: [ 5.01749700e-07 -2.34293609e-05 -7.83692727e-06 -1.46018152e-13 -9.45000455e-05 -1.63843526e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.20003322e-13 -2.23338309e-03 -8.96813818e-11] [ 1.88377815e-12 9.43241552e-04 -9.68603702e-11] [-8.67723709e-04 -1.02768913e-04 -1.46787905e-03] [-6.54354059e-04 4.34215951e-04 -4.98999216e-05] [ 2.41352917e-04 5.91133487e-04 1.45219596e-03] [ 8.67723709e-04 -1.02768762e-04 1.46787911e-03] [-2.41353062e-04 5.91133404e-04 -1.45219590e-03] [ 6.54354129e-04 4.34215911e-04 4.98999546e-05] [-1.50985398e-04 2.35692875e-04 5.85835892e-04] [-2.93926063e-04 -5.13202651e-04 6.65242840e-04] [ 2.93926101e-04 -5.13202658e-04 -6.65242822e-04] [ 1.50985432e-04 2.35692897e-04 -5.85835882e-04]] Final stress: [ 4.11572258e-07 -2.35474474e-05 -7.88941368e-06 -5.43484826e-14 9.45873606e-05 -6.17052161e-14] Minimization converged after 44 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.01263289e-04 -2.48053227e-04 8.52825725e-07] [-5.01263316e-04 2.48053212e-04 8.75860398e-07] [ 4.88734034e-04 3.82262186e-04 -3.93759154e-04] [ 4.20507026e-06 6.14081211e-04 3.49910894e-04] [-2.68778242e-05 9.14608113e-05 4.28512834e-05] [-4.88733979e-04 -3.82257985e-04 -3.93757496e-04] [-4.20790457e-06 -6.14082797e-04 3.49912187e-04] [ 2.68812519e-05 -9.14629366e-05 4.28528822e-05] [-2.40990221e-04 5.70741644e-04 -1.20345292e-04] [ 2.40989750e-04 -5.70741800e-04 -1.20353846e-04] [ 5.37735243e-04 1.74743049e-04 1.20473361e-04] [-5.37735393e-04 -1.74743369e-04 1.20486494e-04]] Final stress: [ 2.29248100e-05 1.80819894e-05 2.00475999e-05 5.49283568e-13 -8.27299748e-13 -4.15027956e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-4.32855226e-04 -2.13407760e-04 -8.42107184e-07] [ 4.32855277e-04 2.13407874e-04 -7.31112499e-07] [ 4.91349610e-04 -4.58824508e-04 4.08800111e-04] [-9.73117658e-05 -1.02322409e-05 -4.96395582e-05] [ 5.55434976e-05 -6.37672465e-04 -3.58195431e-04] [-4.91349184e-04 4.58780446e-04 4.08781727e-04] [ 9.73472173e-05 1.02534719e-05 -4.96568871e-05] [-5.55793901e-05 6.37693135e-04 -3.58212807e-04] [ 4.60887891e-04 -1.97596110e-04 -1.05189692e-04] [-4.60886963e-04 1.97597144e-04 -1.05269760e-04] [-1.94389835e-04 -5.37952596e-04 1.05065588e-04] [ 1.94388871e-04 5.37953609e-04 1.05089929e-04]] Final stress: [ 2.48140365e-05 2.03663988e-05 2.07599846e-05 -3.13455519e-13 4.79889098e-12 3.54406473e-06] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-4.14724646e-09 -1.89035132e-02 -7.05069092e-09] [ 4.72628220e-09 1.89035058e-02 3.61582018e-07] [ 9.92052676e-03 1.09769549e-07 -4.85593158e-08] [-3.56906341e-03 -1.88932908e-03 1.20228438e-02] [-3.56878592e-03 1.88917028e-03 -1.20229784e-02] [-9.92052661e-03 1.85125810e-07 6.92562308e-08] [ 3.56903279e-03 1.88931097e-03 1.20228625e-02] [ 3.56889002e-03 -1.88923485e-03 -1.20229259e-02] [-6.94768792e-03 9.77239594e-04 -3.18839518e-03] [ 6.94762522e-03 -9.77333172e-04 -3.18846949e-03] [-6.94762609e-03 -9.77493655e-04 3.18820769e-03] [ 6.94761460e-03 9.77382395e-04 3.18847972e-03]] Final stress: [ 7.90145114e-04 -3.56277802e-04 2.74731019e-04 5.48502838e-11 -1.81481457e-10 -6.20359982e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-3.73756803e-10 1.98236903e-03 2.54289906e-07] [-2.07068247e-09 -1.98237016e-03 5.47056426e-07] [-1.97399987e-03 2.69870425e-07 -1.12733742e-07] [-2.97823328e-03 -1.95651341e-03 -2.23766129e-03] [-2.97779141e-03 1.95625384e-03 2.23744621e-03] [ 1.97399933e-03 -1.70853782e-07 -6.92130039e-08] [ 2.97818613e-03 1.95648458e-03 -2.23763439e-03] [ 2.97789229e-03 -1.95631779e-03 2.23749734e-03] [-3.21502812e-03 -5.85129908e-04 -6.71430225e-04] [ 3.21499497e-03 5.85135985e-04 -6.71501374e-04] [-3.21502259e-03 5.85134500e-04 6.71230031e-04] [ 3.21500499e-03 -5.85145692e-04 6.71434307e-04]] Final stress: [-8.94862629e-05 -1.26891586e-05 -1.14692159e-06 5.38423840e-11 -3.49496651e-11 2.72596661e-11] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.50804535e-04 -1.36058563e-03 -1.68793557e-05] [-7.50804526e-04 1.36058564e-03 1.68801171e-05] [-3.29015716e-04 6.51125264e-11 -4.27186526e-11] [-1.30402108e-04 -1.81415786e-04 5.63572824e-04] [-1.30401370e-04 1.81415367e-04 -5.63573185e-04] [ 1.46388158e-03 2.10626772e-10 8.17693609e-11] [ 2.54868096e-04 -4.02774082e-04 -1.99395045e-03] [ 2.54868137e-04 4.02774058e-04 1.99395047e-03] [-1.22838376e-06 1.70732927e-03 -1.25774399e-03] [ 6.01336244e-05 1.26658952e-04 -1.27167394e-03] [-1.22834219e-06 -1.70732945e-03 1.25774349e-03] [ 6.01335388e-05 -1.26658610e-04 1.27167398e-03]] Final stress: [ 3.52085610e-07 -8.40502112e-06 3.07549087e-05 -8.07074668e-05 1.40580274e-13 -1.08615299e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.50745094e-04 -1.36021499e-03 1.68824006e-05] [ 7.50745086e-04 1.36021499e-03 -1.68807172e-05] [-1.46215238e-03 4.17884217e-10 -1.78126512e-10] [-2.55223313e-04 4.02220088e-04 -1.99380513e-03] [-2.55223049e-04 -4.02220244e-04 1.99380498e-03] [ 3.28580322e-04 -4.93101963e-10 -2.06067085e-10] [ 1.31122415e-04 1.81432736e-04 5.63216028e-04] [ 1.31122046e-04 -1.81432512e-04 -5.63216234e-04] [-6.06250926e-05 -1.26873675e-04 -1.27110006e-03] [ 7.66986512e-07 -1.70784236e-03 -1.25716802e-03] [-6.06251627e-05 1.26873938e-04 1.27109964e-03] [ 7.67048065e-07 1.70784211e-03 1.25716750e-03]] Final stress: [ 3.76401680e-07 -8.38092691e-06 3.07559237e-05 8.06910992e-05 2.93041198e-14 1.07248584e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.45034911e-04 1.59642991e-03 6.77763551e-06] [-6.45034910e-04 -1.59642991e-03 -6.77731546e-06] [ 1.11424965e-03 6.83649179e-11 -2.97467772e-11] [ 5.39639262e-04 -7.98132737e-04 2.00162439e-03] [ 5.39639516e-04 7.98132592e-04 -2.00162450e-03] [ 4.36288760e-04 -1.65655512e-11 -9.51900165e-12] [-4.01285211e-04 -1.59316631e-05 -5.01354065e-04] [-4.01285225e-04 1.59316728e-05 5.01354051e-04] [-2.07218264e-04 -1.53524963e-04 6.23951642e-04] [-6.13701881e-05 5.99851288e-04 6.28070214e-04] [-2.07218267e-04 1.53524970e-04 -6.23951775e-04] [-6.13702088e-05 -5.99851213e-04 -6.28070230e-04]] Final stress: [-2.37823159e-05 1.84206859e-07 -8.00393647e-06 -9.47962007e-05 7.44196310e-14 -1.36498769e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.44670448e-04 1.58808279e-03 -6.79881834e-06] [ 6.44670451e-04 -1.58808279e-03 6.79975300e-06] [-4.35481403e-04 2.33182683e-10 -9.90089236e-11] [ 3.98077469e-04 2.03092994e-05 -5.00316277e-04] [ 3.98078231e-04 -2.03097363e-05 5.00315923e-04] [-1.10764398e-03 -1.78836252e-10 -7.32983715e-11] [-5.39235302e-04 7.87871783e-04 1.99977393e-03] [-5.39235626e-04 -7.87871598e-04 -1.99977409e-03] [ 5.87577224e-05 -5.94888315e-04 6.27547519e-04] [ 2.09292157e-04 1.52430740e-04 6.23397157e-04] [ 5.87577254e-05 5.94888309e-04 -6.27547762e-04] [ 2.09292110e-04 -1.52430542e-04 -6.23397170e-04]] Final stress: [-2.35241979e-05 3.80436369e-07 -7.88991340e-06 9.46028945e-05 1.55398863e-13 -4.22368639e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.19016720e-12 -6.04096808e-04 6.65782255e-11] [ 2.84786219e-12 2.10800869e-03 1.25412348e-09] [-8.94974062e-04 6.50130298e-05 1.49682371e-03] [ 1.40530172e-04 -2.72687501e-04 -1.44339978e-03] [-5.19373558e-04 -4.91816773e-04 -2.53650928e-06] [ 8.94974070e-04 6.50126942e-05 -1.49682387e-03] [ 5.19373642e-04 -4.91816719e-04 2.53643614e-06] [-1.40530497e-04 -2.72687316e-04 1.44339961e-03] [ 8.89121992e-04 7.76263990e-04 -1.23486437e-03] [ 9.42769091e-04 -8.28728666e-04 -1.29699618e-03] [-9.42768989e-04 -8.28728592e-04 1.29699517e-03] [-8.89121868e-04 7.76263968e-04 1.23486447e-03]] Final stress: [-1.50257492e-07 -8.05592744e-06 3.07410118e-05 -1.75279507e-13 -8.07360836e-05 2.00425775e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.64180872e-12 -2.10795415e-03 1.13495411e-10] [ 4.71900976e-12 6.04061979e-04 1.20313935e-09] [-8.94945482e-04 -6.49053437e-05 -1.49682955e-03] [-5.19194363e-04 4.91671426e-04 2.56688704e-06] [ 1.40568863e-04 2.72806152e-04 1.44337552e-03] [ 8.94945487e-04 -6.49055482e-05 1.49682944e-03] [-1.40568728e-04 2.72806234e-04 -1.44337561e-03] [ 5.19194014e-04 4.91671628e-04 -2.56707380e-06] [-9.42574444e-04 8.28602238e-04 -1.29718622e-03] [-8.89194435e-04 -7.76228451e-04 -1.23505644e-03] [ 8.89194540e-04 -7.76228463e-04 1.23505546e-03] [ 9.42574541e-04 8.28602304e-04 1.29718627e-03]] Final stress: [-1.56845077e-07 -8.06285239e-06 3.07412195e-05 -1.83128032e-13 8.07356347e-05 -1.74233248e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.94054551e-12 2.24262890e-03 1.61394045e-10] [ 1.00587603e-12 -9.55156652e-04 6.09297556e-12] [ 3.44808941e-04 2.18552221e-04 1.41870348e-03] [ 8.29999020e-04 -9.53537563e-04 6.50794465e-07] [ 1.12305282e-04 -1.72766320e-04 -1.48494910e-03] [-3.44808942e-04 2.18551929e-04 -1.41870359e-03] [-1.12305333e-04 -1.72766348e-04 1.48494911e-03] [-8.29999161e-04 -9.53537480e-04 -6.50858328e-07] [ 1.53317198e-04 -2.29127887e-04 5.85328302e-04] [ 2.90841128e-04 4.93143529e-04 6.64761697e-04] [-2.90841064e-04 4.93143660e-04 -6.64761630e-04] [-1.53317075e-04 -2.29127987e-04 -5.85328378e-04]] Final stress: [-2.41305051e-05 7.77747257e-07 -7.93072432e-06 -1.24693541e-13 -9.46990745e-05 4.70794637e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.66532607e-13 9.58064260e-04 7.13849022e-11] [-4.47577529e-13 -2.24576034e-03 9.25295159e-11] [ 3.45879253e-04 -2.19642643e-04 -1.41928336e-03] [ 1.11863732e-04 1.70789744e-04 1.48533556e-03] [ 8.31738486e-04 9.56916433e-04 -4.97207961e-07] [-3.45879253e-04 -2.19642718e-04 1.41928333e-03] [-8.31738393e-04 9.56916484e-04 4.97164668e-07] [-1.11863807e-04 1.70789790e-04 -1.48533560e-03] [-2.90670181e-04 -4.94319567e-04 6.64929919e-04] [-1.54891011e-04 2.30104060e-04 5.85511132e-04] [ 1.54891004e-04 2.30104052e-04 -5.85511173e-04] [ 2.90670171e-04 -4.94319552e-04 -6.64929932e-04]] Final stress: [-2.42247776e-05 7.06496201e-07 -7.97193195e-06 -9.73224954e-15 9.47669684e-05 -5.50139662e-14] Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 3.27954487e-04 1.67383166e-04 8.27494209e-07] [-3.27954434e-04 -1.67383155e-04 8.62394309e-07] [ 3.00185619e-04 -5.53849612e-04 -2.97444002e-05] [-2.83008858e-04 2.69394332e-04 -2.58632490e-05] [ 2.38833371e-04 -4.78707906e-04 5.45564869e-05] [-3.00185415e-04 5.53830887e-04 -2.97521293e-05] [ 2.83023671e-04 -2.69385883e-04 -2.58703361e-05] [-2.38849707e-04 4.78717053e-04 5.45487669e-05] [ 5.49609995e-04 -3.75238314e-04 3.41635833e-05] [-5.49609692e-04 3.75238581e-04 3.41354545e-05] [-1.20460058e-04 -7.28084441e-04 -3.39343758e-05] [ 1.20461021e-04 7.28085292e-04 -3.39296898e-05]] Final stress: [ 1.28583489e-05 2.98874438e-05 1.76920507e-05 -1.56491415e-12 -1.11353046e-12 -1.81066471e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-3.50109485e-04 1.78074907e-04 -8.18068511e-07] [ 3.50109361e-04 -1.78074945e-04 -8.14126229e-07] [ 2.58051816e-04 7.08372479e-04 -2.14969280e-05] [ 4.00975588e-04 5.12722673e-04 -1.71472676e-06] [-3.28217571e-04 -3.53505325e-04 2.42664817e-05] [-2.58051882e-04 -7.08418844e-04 -2.15163561e-05] [-4.00932442e-04 -5.12697687e-04 -1.73547802e-06] [ 3.28177937e-04 3.53528148e-04 2.42472958e-05] [ 1.29052001e-04 6.65701789e-04 1.12326612e-05] [-1.29053842e-04 -6.65701981e-04 1.11996830e-05] [ 3.69722247e-04 5.32856136e-04 -1.14105757e-05] [-3.69723727e-04 -5.32857348e-04 -1.14398624e-05]] Final stress: [ 1.31646615e-05 2.94969884e-05 1.80747903e-05 3.01899106e-12 -1.26521758e-12 1.72264505e-05] Minimization converged after 5 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-9.56524792e-04 -2.23351265e-06 -1.24326275e-09] [-9.56524788e-04 2.23351354e-06 1.03571340e-09] [ 1.71404324e-03 -3.29732575e-11 8.54208913e-12] [-2.18905224e-04 -1.16102327e-03 1.46045595e-03] [-2.18905137e-04 1.16102322e-03 -1.46045599e-03] [ 1.77175522e-03 1.62181870e-10 6.81540012e-11] [-2.43846182e-04 -1.11867898e-03 -1.45468613e-03] [-2.43846046e-04 1.11867890e-03 1.45468621e-03] [-1.64007326e-04 1.37001176e-03 1.45902683e-03] [-1.59615821e-04 1.38219204e-03 1.45902875e-03] [-1.64007318e-04 -1.37001184e-03 -1.45902688e-03] [-1.59615828e-04 -1.38219195e-03 -1.45902860e-03]] Final stress: [ 1.25231760e-05 1.21412332e-05 8.38057560e-06 -7.41006621e-05 6.29043972e-16 -3.90358607e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 9.56539021e-04 -2.23351953e-06 1.16102826e-09] [ 9.56539022e-04 2.23351413e-06 -1.51355456e-09] [-1.77169104e-03 -1.30677775e-10 5.17655868e-11] [ 2.43952699e-04 1.11852779e-03 -1.45466120e-03] [ 2.43952362e-04 -1.11852760e-03 1.45466135e-03] [-1.71377615e-03 1.51486595e-10 6.03569170e-11] [ 2.18910282e-04 1.16104761e-03 1.46043085e-03] [ 2.18910337e-04 -1.16104764e-03 -1.46043082e-03] [ 1.59470031e-04 -1.38238052e-03 1.45903101e-03] [ 1.63861680e-04 -1.37020022e-03 1.45902930e-03] [ 1.59470054e-04 1.38238041e-03 -1.45903092e-03] [ 1.63861699e-04 1.37020016e-03 -1.45902933e-03]] Final stress: [ 1.25171714e-05 1.21352298e-05 8.37770239e-06 7.40988368e-05 -1.48237114e-13 -1.36104129e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.30857891e-03 -3.24112547e-05 -9.01445507e-08] [-2.30857891e-03 3.24112511e-05 9.00212123e-08] [ 6.19928252e-03 -3.66079062e-13 -7.95772115e-12] [-6.93889248e-04 -6.01173749e-03 4.15557885e-03] [-6.93889188e-04 6.01173746e-03 -4.15557887e-03] [ 8.60790834e-03 -7.47037884e-11 -2.55344949e-11] [-1.84291460e-03 -4.00204523e-03 -4.08206930e-03] [-1.84291447e-03 4.00204517e-03 4.08206934e-03] [-1.30777378e-03 2.35760930e-03 1.17574028e-03] [-1.25043896e-03 2.48915993e-03 1.17587445e-03] [-1.30777381e-03 -2.35760917e-03 -1.17574024e-03] [-1.25043897e-03 -2.48915990e-03 -1.17587436e-03]] Final stress: [-5.97468366e-05 -6.45307891e-05 -5.38170307e-05 -3.11013560e-04 1.44652052e-13 2.43667784e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.30858151e-03 -3.24112744e-05 9.01303752e-08] [ 2.30858151e-03 3.24112672e-05 -9.01095963e-08] [-8.60789703e-03 -4.63301187e-11 1.69765918e-11] [ 1.84290111e-03 4.00203266e-03 -4.08207572e-03] [ 1.84290098e-03 -4.00203258e-03 4.08207579e-03] [-6.19927316e-03 -4.27499338e-11 -2.03899881e-11] [ 6.93876759e-04 6.01172317e-03 4.15558526e-03] [ 6.93876646e-04 -6.01172310e-03 -4.15558532e-03] [ 1.25044550e-03 -2.48917689e-03 1.17588419e-03] [ 1.30778034e-03 -2.35762619e-03 1.17575005e-03] [ 1.25044550e-03 2.48917687e-03 -1.17588410e-03] [ 1.30778034e-03 2.35762616e-03 -1.17575015e-03]] Final stress: [-5.97467429e-05 -6.45306963e-05 -5.38171615e-05 3.11013419e-04 -4.62556301e-14 1.76773843e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.73251171e-12 9.58074177e-04 2.56045434e-11] [ 3.00825710e-12 9.53621030e-04 -2.81934705e-10] [-2.01753578e-05 8.83308601e-04 1.68032349e-03] [ 1.14428372e-03 -1.09906784e-03 -8.43041406e-04] [-1.12020480e-03 -1.05649458e-03 -8.37293863e-04] [ 2.01753564e-05 8.83308734e-04 -1.68032343e-03] [ 1.12020462e-03 -1.05649469e-03 8.37293946e-04] [-1.14428366e-03 -1.09906787e-03 8.43041436e-04] [ 1.37526240e-03 1.64281651e-04 1.46952226e-03] [ 1.37088472e-03 1.52124559e-04 1.46952958e-03] [-1.37088467e-03 1.52124573e-04 -1.46952939e-03] [-1.37526235e-03 1.64281659e-04 -1.46952236e-03]] Final stress: [ 1.23536639e-05 1.27344133e-05 8.29149123e-06 -9.16902784e-14 -7.39417490e-05 9.29270663e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.30535486e-12 -9.54130747e-04 -5.87272844e-11] [ 5.77474631e-12 -9.58593782e-04 -3.32145808e-10] [-2.25224034e-05 -8.87726988e-04 -1.68219521e-03] [-1.12428361e-03 1.05914551e-03 8.38222119e-04] [ 1.15071766e-03 1.10578962e-03 8.43985122e-04] [ 2.25224041e-05 -8.87726785e-04 1.68219530e-03] [-1.15071785e-03 1.10578951e-03 -8.43985027e-04] [ 1.12428354e-03 1.05914555e-03 -8.38222143e-04] [-1.37347573e-03 -1.54336141e-04 1.46207686e-03] [-1.37786321e-03 -1.66509833e-04 1.46206972e-03] [ 1.37786335e-03 -1.66509862e-04 -1.46206947e-03] [ 1.37347584e-03 -1.54336043e-04 -1.46207687e-03]] Final stress: [ 1.21885830e-05 1.25701740e-05 8.34800107e-06 -2.21914765e-13 7.40503399e-05 -2.55049131e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.37399461e-12 2.34097514e-03 -4.15868576e-11] [ 5.21553856e-12 2.27615408e-03 -1.94793939e-10] [-1.14185183e-03 4.15894739e-03 4.75575082e-03] [ 5.60545417e-03 -5.53980175e-03 -2.41494609e-03] [-4.40831614e-03 -3.48581918e-03 -2.34143701e-03] [ 1.14185183e-03 4.15894743e-03 -4.75575079e-03] [ 4.40831615e-03 -3.48581919e-03 2.34143702e-03] [-5.60545407e-03 -5.53980182e-03 2.41494614e-03] [ 2.45206862e-03 1.34482748e-03 1.17553773e-03] [ 2.39473538e-03 1.21328149e-03 1.17601911e-03] [-2.39473545e-03 1.21328149e-03 -1.17601896e-03] [-2.45206866e-03 1.34482744e-03 -1.17553773e-03]] Final stress: [-6.45298830e-05 -5.97460252e-05 -5.38162279e-05 8.37915454e-14 -3.11010406e-04 1.25981964e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.52764652e-12 -2.27615465e-03 2.70401158e-11] [ 1.66720802e-12 -2.34097590e-03 1.32748963e-10] [-1.14185599e-03 -4.15897515e-03 -4.75575397e-03] [-4.40834109e-03 3.48583473e-03 2.34143843e-03] [ 5.60548338e-03 5.53982474e-03 2.41494786e-03] [ 1.14185601e-03 -4.15897523e-03 4.75575392e-03] [-5.60548347e-03 5.53982469e-03 -2.41494784e-03] [ 4.40834102e-03 3.48583477e-03 -2.34143848e-03] [-2.39471643e-03 -1.21328626e-03 1.17601630e-03] [-2.45204990e-03 -1.34483274e-03 1.17553491e-03] [ 2.45204995e-03 -1.34483269e-03 -1.17553497e-03] [ 2.39471651e-03 -1.21328630e-03 -1.17601631e-03]] Final stress: [-6.45301547e-05 -5.97462797e-05 -5.38162778e-05 -1.08890496e-13 3.11011192e-04 1.86382423e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 4.80555629e-03 3.66202740e-04 -4.05532491e-06] [-4.80556193e-03 -3.66209579e-04 -4.38866823e-06] [ 1.73611616e-03 -2.76167309e-04 -3.27704059e-03] [-9.38426746e-03 -1.43199776e-03 -1.66798334e-03] [-6.87543827e-03 5.26155368e-03 4.95356445e-03] [-1.73611960e-03 2.76211303e-04 -3.27702610e-03] [ 9.38445970e-03 1.43210821e-03 -1.66806983e-03] [ 6.87540861e-03 -5.26153698e-03 4.95354952e-03] [-8.51338143e-03 1.57211218e-03 -5.89878773e-04] [ 8.51328696e-03 -1.57217460e-03 -5.89766749e-04] [-5.58010313e-03 -2.27017820e-03 5.85648705e-04] [ 5.58004410e-03 2.27007630e-03 5.85446706e-04]] Final stress: [ 1.42843151e-04 3.77281549e-05 1.02744511e-04 1.33183572e-10 -1.27165942e-10 -1.91659245e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.89284074e-03 3.66486087e-04 3.97387016e-06] [ 4.89283985e-03 -3.66478593e-04 3.78578187e-06] [ 1.60670761e-03 9.28445245e-05 3.22820685e-03] [-7.14257085e-03 -5.10918870e-03 -4.95398947e-03] [-9.10032321e-03 1.86715840e-03 1.71710567e-03] [-1.60670846e-03 -9.25271756e-05 3.22834499e-03] [ 7.14213480e-03 5.10893836e-03 -4.95378082e-03] [ 9.10078707e-03 -1.86742350e-03 1.71732617e-03] [-5.49686516e-03 2.48924785e-03 -7.25724432e-04] [ 5.49687563e-03 -2.48914940e-03 -7.25337707e-04] [-8.70679071e-03 -1.37341296e-03 7.29940096e-04] [ 8.70675416e-03 1.37350511e-03 7.30149003e-04]] Final stress: [1.35278560e-04 2.91258518e-05 1.01237785e-04 3.96821594e-11 1.61157509e-10 1.88977414e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.66021337e-03 3.11312314e-06 9.85871464e-07] [-1.66021344e-03 -3.11356353e-06 1.05152764e-06] [ 6.48238945e-04 -1.69653680e-04 -1.23964863e-03] [-5.80318157e-04 1.03084480e-03 6.56087705e-04] [ 1.18785458e-04 -1.63834439e-04 5.82569562e-04] [-6.48238742e-04 1.69724435e-04 -1.23961942e-03] [ 5.80271090e-04 -1.03087185e-03 6.56110633e-04] [-1.18736247e-04 1.63805634e-04 5.82593526e-04] [ 2.46506442e-05 -4.15935363e-04 6.28941860e-05] [-2.46535213e-05 4.15928467e-04 6.29031773e-05] [ 1.60659826e-04 -3.97172712e-04 -6.29994558e-05] [-1.60659233e-04 3.97165149e-04 -6.29286858e-05]] Final stress: [ 4.05526958e-05 4.27873695e-05 9.24576469e-06 1.30703758e-12 -1.17274924e-11 -4.62802103e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.65972634e-03 3.10765288e-06 -9.15259086e-07] [ 1.65972622e-03 -3.10684755e-06 -8.64986652e-07] [ 6.48881479e-04 1.69631792e-04 1.23916229e-03] [ 1.18182826e-04 1.64559689e-04 -5.82387497e-04] [-5.80257898e-04 -1.03132531e-03 -6.55958566e-04] [-6.48881371e-04 -1.69599225e-04 1.23917645e-03] [-1.18231380e-04 -1.64587196e-04 -5.82364480e-04] [ 5.80309368e-04 1.03129566e-03 -6.55934172e-04] [ 1.62588969e-04 3.97144120e-04 6.48245551e-05] [-1.62587446e-04 -3.97131833e-04 6.48331337e-05] [ 2.28161836e-05 4.15950706e-04 -6.48136731e-05] [-2.28206112e-05 -4.15939203e-04 -6.47578000e-05]] Final stress: [4.05975336e-05 4.28324748e-05 9.23268644e-06 3.10156846e-12 2.00269377e-11 4.62401785e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.67088440e-02 -2.02250006e-03 -4.78502651e-05] [-1.67088440e-02 2.02250008e-03 4.78502851e-05] [ 3.82911348e-02 -1.17936824e-10 5.17856510e-11] [-7.51602268e-03 -4.64829183e-02 3.14030074e-02] [-7.51602300e-03 4.64829185e-02 -3.14030073e-02] [ 6.53569405e-02 -2.78314301e-10 -1.31915281e-10] [-1.72554681e-02 -2.77724386e-02 -2.71940170e-02] [-1.72554684e-02 2.77724388e-02 2.71940168e-02] [-7.10145246e-03 1.66535553e-02 -3.03356394e-03] [-3.24225012e-03 2.48758607e-02 -2.97133239e-03] [-7.10145248e-03 -1.66535553e-02 3.03356425e-03] [-3.24225011e-03 -2.48758608e-02 2.97133221e-03]] Final stress: [-5.44899629e-04 -8.39450784e-04 1.57473661e-04 -2.44218865e-03 3.31814435e-14 2.76488814e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.67096796e-02 -2.02271048e-03 4.78586054e-05] [ 1.67096796e-02 2.02271047e-03 -4.78580798e-05] [-6.53628253e-02 2.46809165e-10 -1.13829134e-10] [ 1.72573691e-02 2.77751723e-02 -2.71953316e-02] [ 1.72573696e-02 -2.77751726e-02 2.71953314e-02] [-3.82945543e-02 -3.09893919e-11 -1.29011577e-11] [ 7.51713046e-03 4.64873137e-02 3.14048012e-02] [ 7.51713040e-03 -4.64873137e-02 -3.14048012e-02] [ 3.24242514e-03 -2.48782182e-02 -2.97112874e-03] [ 7.10208526e-03 -1.66549944e-02 -3.03337040e-03] [ 3.24242514e-03 2.48782181e-02 2.97112851e-03] [ 7.10208521e-03 1.66549945e-02 3.03337046e-03]] Final stress: [-5.44944275e-04 -8.39528553e-04 1.57489225e-04 2.44232490e-03 1.01655940e-13 5.74486802e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.16191847e-03 1.16987187e-03 1.41102154e-08] [-1.17782524e-03 1.16987185e-03 -1.37840303e-08] [ 3.05538139e-03 8.04820420e-04 2.46623948e-03] [ 2.22209839e-03 -4.45732754e-03 9.11256102e-04] [-1.41814143e-03 -2.38236151e-04 -3.37742850e-03] [ 3.72235511e-03 8.27157335e-04 -2.48595172e-03] [ 1.88982416e-03 -3.85947512e-03 -9.01399893e-04] [-1.75284106e-03 -7.95616076e-04 3.38728459e-03] [-8.30605144e-04 1.82187268e-03 -1.59123369e-03] [-8.71792758e-04 1.85466250e-03 -1.59130312e-03] [-1.85886121e-03 8.34804111e-04 1.59128187e-03] [-1.81767374e-03 8.67594119e-04 1.59125455e-03]] Final stress: [-1.89638685e-05 -1.89638675e-05 3.01517033e-05 -1.16167861e-04 -1.16167861e-04 -8.06553856e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.17775401e-03 -1.16980074e-03 1.38830836e-08] [-1.16184751e-03 -1.16980077e-03 -1.37031050e-08] [ 3.05521901e-03 -8.05007518e-04 -2.46610025e-03] [-1.41827253e-03 2.37951694e-04 3.37723820e-03] [ 2.22215418e-03 4.45756208e-03 -9.11204917e-04] [ 3.72257552e-03 -8.27345587e-04 2.48581193e-03] [-1.75316382e-03 7.95663026e-04 -3.38709414e-03] [ 1.88968934e-03 3.85937775e-03 9.01349084e-04] [-1.85839558e-03 -8.35102753e-04 -1.59141092e-03] [-1.81720818e-03 -8.67893496e-04 -1.59138389e-03] [-8.30904684e-04 -1.82140664e-03 1.59136264e-03] [-8.72091727e-04 -1.85419705e-03 1.59143208e-03]] Final stress: [-1.89756673e-05 -1.89756683e-05 3.01484178e-05 -1.16170017e-04 1.16170017e-04 8.06546683e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.16209143e-03 1.17004517e-03 -1.40984273e-08] [ 1.17799886e-03 1.17004513e-03 1.44874307e-08] [-3.72168131e-03 8.27887001e-04 2.48595544e-03] [ 1.75332184e-03 -7.94456818e-04 -3.38728961e-03] [-1.89009776e-03 -3.86048195e-03 9.01401127e-04] [-3.05633832e-03 8.05549422e-04 -2.46624265e-03] [ 1.41943790e-03 -2.38488983e-04 3.37743296e-03] [-2.22155611e-03 -4.45692245e-03 -9.11257530e-04] [ 1.81801533e-03 8.66197740e-04 -1.59085532e-03] [ 1.85920353e-03 8.33406867e-04 -1.59088300e-03] [ 8.70396068e-04 1.85500469e-03 1.59090368e-03] [ 8.29208530e-04 1.82221419e-03 1.59083451e-03]] Final stress: [-1.89141422e-05 -1.89141447e-05 3.01682081e-05 1.16166128e-04 -1.16166128e-04 8.06578504e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.17798214e-03 -1.17002842e-03 -1.38128738e-08] [ 1.16207476e-03 -1.17002845e-03 1.37144591e-08] [-3.72179876e-03 -8.27358390e-04 -2.48608498e-03] [-1.89009306e-03 3.86008791e-03 -9.01448463e-04] [ 1.75278664e-03 7.94971388e-04 3.38746619e-03] [-3.05602972e-03 -8.05022741e-04 2.46637175e-03] [-2.22176517e-03 4.45689699e-03 9.11305040e-04] [ 1.41868985e-03 2.38634509e-04 -3.37760962e-03] [ 8.70788332e-04 -1.85527689e-03 -1.59097508e-03] [ 8.29600354e-04 -1.82248753e-03 -1.59090530e-03] [ 1.81828826e-03 -8.66588982e-04 1.59092663e-03] [ 1.85947636e-03 -8.33799384e-04 1.59095393e-03]] Final stress: [-1.89270149e-05 -1.89270152e-05 3.01633435e-05 1.16164935e-04 1.16164936e-04 -8.06572418e-07] Minimization converged after 68 steps. Minimization converged after 68 steps. Minimization converged after 67 steps. Minimization converged after 68 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.28879254e-11 1.87318942e-02 -7.16361291e-11] [ 1.39200114e-11 1.46878473e-02 -3.45642618e-12] [-9.54001079e-03 3.37548661e-02 3.37328447e-02] [ 4.38321415e-02 -4.10300759e-02 -1.91234569e-02] [-3.04991050e-02 -1.97793368e-02 -1.49107647e-02] [ 9.54001084e-03 3.37548661e-02 -3.37328448e-02] [ 3.04991048e-02 -1.97793370e-02 1.49107648e-02] [-4.38321416e-02 -4.10300758e-02 1.91234568e-02] [ 2.26962621e-02 9.27930062e-03 -3.11734946e-03] [ 1.88379436e-02 1.06537528e-03 -2.88704841e-03] [-1.88379435e-02 1.06537534e-03 2.88704844e-03] [-2.26962620e-02 9.27930054e-03 3.11734954e-03]] Final stress: [-8.39531334e-04 -5.44971943e-04 1.57493096e-04 -1.31820746e-13 -2.44235812e-03 2.91618679e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.87832094e-12 -1.46878472e-02 3.41850237e-10] [ 1.24976592e-11 -1.87318940e-02 -3.48468815e-10] [-9.54001064e-03 -3.37548651e-02 -3.37328445e-02] [-3.04991045e-02 1.97793365e-02 1.49107645e-02] [ 4.38321409e-02 4.10300751e-02 1.91234566e-02] [ 9.54001065e-03 -3.37548653e-02 3.37328444e-02] [-4.38321410e-02 4.10300750e-02 -1.91234565e-02] [ 3.04991043e-02 1.97793366e-02 -1.49107646e-02] [-1.88379430e-02 -1.06537531e-03 -2.88704873e-03] [-2.26962616e-02 -9.27930046e-03 -3.11734916e-03] [ 2.26962617e-02 -9.27930032e-03 3.11734965e-03] [ 1.88379432e-02 -1.06537538e-03 2.88704844e-03]] Final stress: [-8.39531319e-04 -5.44971934e-04 1.57493093e-04 -1.95127298e-13 2.44235810e-03 4.52371722e-13] Minimization converged after 67 steps. Minimization converged after 69 steps. Minimization converged after 68 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 0.01592118 -0.0062418 -0.0046256 ] [ 0.0087124 0.00540575 0.01050017] [ 0.01283996 -0.0051933 -0.00134575] [-0.01055762 0.01023835 -0.01298419] [-0.01528183 0.02454381 -0.00047435] [-0.01258469 0.00150264 -0.00862798] [-0.00457478 -0.00820824 0.0021899 ] [ 0.01633385 0.0058334 -0.01616615] [-0.02009555 -0.00932964 -0.01673833] [-0.00538406 -0.03118799 0.00445797] [ 0.01064298 -0.00377493 0.01056726] [ 0.00402815 0.01641196 0.03324704]] Final stress: [ 0.00619413 0.00302104 0.03381356 -0.00016887 0.00874576 -0.00295367] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.37506073e-03 1.97748289e-05 8.35479002e-06] [-1.37506075e-03 -1.97748102e-05 8.36517370e-06] [ 6.19574796e-04 -8.41226365e-05 -9.80428687e-04] [-9.01658019e-04 7.01850272e-04 3.42508550e-04] [-3.40149007e-04 6.62372788e-05 6.30649921e-04] [-6.19574764e-04 8.41174453e-05 -9.80430833e-04] [ 9.01662514e-04 -7.01847642e-04 3.42506391e-04] [ 3.40145171e-04 -6.62350941e-05 6.30648068e-04] [-1.74031215e-04 -2.36535915e-04 -4.54405297e-04] [ 1.74030953e-04 2.36536134e-04 -4.54413414e-04] [-4.27140900e-04 -4.01824902e-04 4.53321822e-04] [ 4.27140495e-04 4.01825041e-04 4.53323516e-04]] Final stress: [ 4.23939811e-05 3.81374667e-05 3.73961331e-05 4.40116804e-13 4.34112861e-13 -4.29983129e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.38674440e-03 1.97910379e-05 -8.34219288e-06] [ 1.38674436e-03 -1.97910717e-05 -8.35229189e-06] [ 6.20611455e-04 8.27076052e-05 9.73575802e-04] [-3.45925031e-04 -5.89407810e-05 -6.27480477e-04] [-8.98015031e-04 -6.95726824e-04 -3.38838175e-04] [-6.20611491e-04 -8.26954888e-05 9.73580820e-04] [ 3.45915764e-04 5.89353450e-05 -6.27475991e-04] [ 8.98025407e-04 6.95720818e-04 -3.38833210e-04] [-4.25181435e-04 4.02541253e-04 -4.52046814e-04] [ 4.25180835e-04 -4.02541524e-04 -4.52034504e-04] [-1.77058828e-04 2.37004690e-04 4.53122117e-04] [ 1.77058399e-04 -2.37005058e-04 4.53124916e-04]] Final stress: [ 4.24639118e-05 3.81989918e-05 3.74045308e-05 7.26146526e-13 -6.17076877e-13 4.31029868e-05] Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.03338644e-03 3.30717725e-03 6.44069712e-06] [-2.03338643e-03 -3.30717723e-03 -6.43961793e-06] [ 2.35255610e-03 6.13336398e-10 -2.56706639e-10] [ 1.22563210e-03 -8.57854881e-04 5.10943026e-03] [ 1.22563424e-03 8.57853663e-04 -5.10943124e-03] [-3.15959437e-04 -2.23242368e-10 -6.84938617e-11] [-1.04746401e-03 -2.07870458e-04 -1.09045438e-03] [-1.04746429e-03 2.07870616e-04 1.09045429e-03] [ 6.26249274e-04 5.60069459e-04 -2.67563097e-03] [ 2.10669890e-04 5.10043999e-03 -2.68070282e-03] [ 6.26249261e-04 -5.60069399e-04 2.67563056e-03] [ 2.10669734e-04 -5.10043940e-03 2.68070354e-03]] Final stress: [-2.63305972e-05 1.16250675e-05 5.72454499e-05 -2.14117691e-04 5.72941798e-13 -1.07279654e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.03203421e-03 3.30492768e-03 -6.47601991e-06] [ 2.03203422e-03 -3.30492765e-03 6.47753646e-06] [ 3.15265846e-04 3.89535603e-11 -4.92317292e-11] [ 1.04923204e-03 2.08831152e-04 -1.08872108e-03] [ 1.04923358e-03 -2.08832022e-04 1.08872035e-03] [-2.34887618e-03 2.01159061e-11 4.38722337e-12] [-1.22789512e-03 8.54891936e-04 5.10780033e-03] [-1.22789494e-03 -8.54892045e-04 -5.10780024e-03] [-2.08983173e-04 -5.09695365e-03 -2.67428180e-03] [-6.27583530e-04 -5.60426126e-04 -2.66924885e-03] [-2.08983198e-04 5.09695373e-03 2.67428093e-03] [-6.27583731e-04 5.60426934e-04 2.66924890e-03]] Final stress: [-2.63468819e-05 1.16527233e-05 5.71307597e-05 2.14022374e-04 7.66600486e-13 -1.51537490e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.86793610e-03 -5.83460284e-03 7.93070014e-05] [-4.86793609e-03 5.83460284e-03 -7.93048926e-05] [ 7.03073029e-03 8.06311120e-10 -3.69469313e-10] [-8.21678899e-04 -4.49919343e-03 2.55631337e-03] [-8.21677048e-04 4.49919233e-03 -2.55631432e-03] [ 3.56248283e-03 -3.03487476e-11 2.37865189e-11] [-1.07173842e-03 -2.70454330e-03 -9.00618662e-03] [-1.07173760e-03 2.70454278e-03 9.00618703e-03] [ 5.41515631e-03 2.35592041e-03 6.42256434e-06] [-3.95041080e-03 -8.93372543e-03 1.19637285e-04] [ 5.41515625e-03 -2.35591986e-03 -6.42411792e-06] [-3.95041073e-03 8.93372572e-03 -1.19636966e-04]] Final stress: [ 1.67314263e-05 -6.54923118e-06 2.03642093e-05 -4.26932466e-04 1.59549258e-13 3.53260509e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.86773240e-03 -5.83388839e-03 -7.93103936e-05] [ 4.86773237e-03 5.83388839e-03 7.93106129e-05] [-3.55817013e-03 -4.68879450e-10 2.02569462e-10] [ 1.07244133e-03 2.70183998e-03 -9.00540662e-03] [ 1.07244006e-03 -2.70183913e-03 9.00540724e-03] [-7.02998301e-03 -2.99969895e-10 -1.29094244e-10] [ 8.24347938e-04 4.50091593e-03 2.55475184e-03] [ 8.24347256e-04 -4.50091554e-03 -2.55475218e-03] [ 3.94749920e-03 8.93237052e-03 1.19692055e-04] [-5.41794323e-03 -2.35855083e-03 6.47238719e-06] [ 3.94749924e-03 -8.93237061e-03 -1.19691581e-04] [-5.41794342e-03 2.35855044e-03 -6.47342268e-06]] Final stress: [ 1.67137816e-05 -6.57330893e-06 2.03522633e-05 4.26888175e-04 2.06867124e-13 1.03222300e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.36882103e-12 5.37687806e-03 1.46822091e-10] [-2.62327755e-12 -1.32167290e-03 4.71361275e-10] [ 1.37640985e-03 2.16564277e-04 3.56789106e-03] [ 1.67809418e-03 -1.03924414e-03 1.94802193e-04] [ 6.27063103e-04 -3.58229463e-04 -3.75940025e-03] [-1.37640986e-03 2.16564453e-04 -3.56789101e-03] [-6.27063267e-04 -3.58229544e-04 3.75940029e-03] [-1.67809382e-03 -1.03924435e-03 -1.94802058e-04] [ 3.07598085e-03 -2.61614434e-03 -2.70241793e-03] [ 2.58766007e-03 1.76945116e-03 -2.64878367e-03] [-2.58766019e-03 1.76945120e-03 2.64878310e-03] [-3.07598092e-03 -2.61614442e-03 2.70241766e-03]] Final stress: [-2.90703324e-05 1.43504806e-05 5.71965838e-05 1.91597613e-13 -2.14239090e-04 2.09672594e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.88584668e-12 1.32168180e-03 3.79072158e-10] [-1.23959233e-11 -5.37695265e-03 -1.39749189e-09] [ 1.37639225e-03 -2.16549710e-04 -3.56794002e-03] [ 6.27014561e-04 3.58186216e-04 3.75941538e-03] [ 1.67803696e-03 1.03930045e-03 -1.94768766e-04] [-1.37639226e-03 -2.16550042e-04 3.56793993e-03] [-1.67803672e-03 1.03930059e-03 1.94768689e-04] [-6.27014214e-04 3.58186018e-04 -3.75941519e-03] [-2.58778684e-03 -1.76948673e-03 -2.64898253e-03] [-3.07594927e-03 2.61618546e-03 -2.70261671e-03] [ 3.07594895e-03 2.61618558e-03 2.70261807e-03] [ 2.58778660e-03 -1.76948699e-03 2.64898218e-03]] Final stress: [-2.90714218e-05 1.43482119e-05 5.71994127e-05 5.11620211e-13 2.14240957e-04 8.15076585e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.24892383e-11 -8.28727745e-04 6.11338074e-10] [-1.12731963e-11 1.05217616e-02 -1.51755694e-09] [ 1.82270081e-03 3.18279483e-03 6.56208773e-03] [ 3.70634844e-03 -4.17044435e-03 -6.68214761e-03] [-3.31276787e-03 -2.35288647e-03 -7.30761273e-05] [-1.82270082e-03 3.18279502e-03 -6.56208765e-03] [ 3.31276795e-03 -2.35288638e-03 7.30760805e-05] [-3.70634800e-03 -4.17044455e-03 6.68214781e-03] [ 1.48980500e-03 5.03785817e-03 5.65061426e-05] [-8.05447805e-03 -6.54383910e-03 6.99249198e-05] [ 8.05447772e-03 -6.54383917e-03 -6.99235744e-05] [-1.48980515e-03 5.03785818e-03 -5.65068154e-05]] Final stress: [ 8.75653875e-06 1.30505222e-06 2.01816208e-05 2.73269555e-13 -4.23771716e-04 -4.17506241e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.07516829e-13 -1.05198836e-02 1.83880247e-10] [ 4.75852257e-12 8.27858459e-04 -1.28005168e-09] [ 1.82347450e-03 -3.18080655e-03 -6.56220241e-03] [-3.30973711e-03 2.35699681e-03 7.47418491e-05] [ 3.70829480e-03 4.16862176e-03 6.68061947e-03] [-1.82347455e-03 -3.18080605e-03 6.56220262e-03] [-3.70829531e-03 4.16862147e-03 -6.68061920e-03] [ 3.30973751e-03 2.35699657e-03 -7.47416410e-05] [ 8.05962614e-03 6.53766959e-03 6.98200141e-05] [-1.48967374e-03 -5.03646901e-03 5.63205893e-05] [ 1.48967380e-03 -5.03646901e-03 -5.63197201e-05] [-8.05962605e-03 6.53766956e-03 -6.98204837e-05]] Final stress: [8.81704065e-06 1.37871067e-06 2.02139114e-05 4.76802903e-14 4.23759528e-04 3.11238390e-14] Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.02894103e-03 -3.35306002e-03 -6.51489709e-06] [-2.02894103e-03 3.35306000e-03 6.51419942e-06] [-6.20323698e-04 3.55690608e-10 -1.20609305e-10] [-9.39454405e-04 -3.98961374e-04 1.11458038e-03] [-9.39454505e-04 3.98961422e-04 -1.11458033e-03] [ 2.62305267e-03 1.74924928e-10 8.44571708e-11] [ 1.11233579e-03 -6.64965064e-04 -5.06415685e-03] [ 1.11233564e-03 6.64965135e-04 5.06415682e-03] [ 1.87093585e-04 5.02671553e-03 -2.68353695e-03] [ 6.67601620e-04 6.39282967e-04 -2.67837347e-03] [ 1.87093645e-04 -5.02671576e-03 2.68353725e-03] [ 6.67601717e-04 -6.39283364e-04 2.67837387e-03]] Final stress: [ 1.43059526e-05 -2.90414731e-05 5.72932939e-05 -2.14386652e-04 -5.19379268e-13 3.15442386e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.02872528e-03 -3.35279530e-03 6.52126365e-06] [ 2.02872528e-03 3.35279530e-03 -6.52143967e-06] [-2.62305473e-03 1.92498333e-10 -8.11562601e-11] [-1.11256606e-03 6.64503446e-04 -5.06392087e-03] [-1.11256564e-03 -6.64503676e-04 5.06392068e-03] [ 6.20510169e-04 -1.27275703e-10 -3.15280908e-11] [ 9.39480118e-04 3.99197805e-04 1.11438817e-03] [ 9.39480044e-04 -3.99197758e-04 -1.11438816e-03] [-6.67719210e-04 -6.39308318e-04 -2.67722097e-03] [-1.86647995e-04 -5.02614005e-03 -2.68237690e-03] [-6.67719246e-04 6.39308395e-04 2.67722109e-03] [-1.86648020e-04 5.02614009e-03 2.68237726e-03]] Final stress: [ 1.43013516e-05 -2.90516415e-05 5.72687291e-05 2.14373494e-04 1.46114359e-13 6.68374579e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.88884992e-03 5.71972660e-03 -7.98571186e-05] [-4.88884996e-03 -5.71972661e-03 7.98555746e-05] [ 3.53466755e-03 -7.35443223e-10 3.05633862e-10] [-1.13187158e-03 -2.66907488e-03 9.15130061e-03] [-1.13187315e-03 2.66907577e-03 -9.15129987e-03] [ 7.15219649e-03 -5.53947533e-10 -1.99041721e-10] [-7.61274004e-04 -4.60005159e-03 -2.45042413e-03] [-7.61274331e-04 4.60005165e-03 2.45042403e-03] [-4.06819056e-03 -9.19068638e-03 1.19412215e-04] [ 5.50675492e-03 2.54639561e-03 6.76420527e-06] [-4.06819042e-03 9.19068688e-03 -1.19411116e-04] [ 5.50675496e-03 -2.54639576e-03 -6.76451432e-06]] Final stress: [ 1.18417318e-06 8.76207174e-06 2.03209873e-05 -4.27243967e-04 -2.95853453e-13 1.64268928e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.88833843e-03 5.71834614e-03 7.98665104e-05] [ 4.88833845e-03 -5.71834614e-03 -7.98671049e-05] [-7.15247059e-03 3.07615209e-10 -1.85867405e-10] [ 7.60263687e-04 4.59958319e-03 -2.45035058e-03] [ 7.60265444e-04 -4.59958429e-03 2.45034965e-03] [-3.53125886e-03 3.36549809e-10 2.13723916e-10] [ 1.13293402e-03 2.66777371e-03 9.14976370e-03] [ 1.13293476e-03 -2.66777419e-03 -9.14976321e-03] [-5.50912645e-03 -2.54399741e-03 6.78333552e-06] [ 4.06945375e-03 9.18896839e-03 1.19431439e-04] [-5.50912640e-03 2.54399757e-03 -6.78387928e-06] [ 4.06945375e-03 -9.18896761e-03 -1.19429888e-04]] Final stress: [ 1.18067093e-06 8.76236228e-06 2.03178179e-05 4.27205047e-04 7.54468584e-14 -1.47129778e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.60049407e-12 -1.27575171e-03 -8.70457188e-11] [-3.34615500e-12 5.34282701e-03 -2.73803717e-12] [-1.57757841e-03 2.21976405e-04 3.57695959e-03] [-4.73308297e-04 -5.89679439e-04 -3.79771547e-03] [-1.55030380e-03 -8.21207435e-04 2.16876482e-04] [ 1.57757841e-03 2.21976380e-04 -3.57695959e-03] [ 1.55030385e-03 -8.21207396e-04 -2.16876508e-04] [ 4.73308500e-04 -5.89679555e-04 3.79771555e-03] [ 2.62462580e-03 1.84734442e-03 -2.65102310e-03] [ 3.03535509e-03 -2.69197153e-03 -2.70422907e-03] [-3.03535523e-03 -2.69197149e-03 2.70422907e-03] [-2.62462590e-03 1.84734435e-03 2.65102314e-03]] Final stress: [ 1.16063862e-05 -2.63110549e-05 5.72380511e-05 1.37293982e-13 -2.14180084e-04 1.68719138e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.03480237e-12 -5.34296261e-03 2.83824992e-10] [-7.55628430e-13 1.27588255e-03 -3.14371663e-10] [-1.57803050e-03 -2.21957056e-04 -3.57703691e-03] [-1.55021726e-03 8.21438596e-04 -2.16801971e-04] [-4.73069055e-04 5.89751599e-04 3.79771750e-03] [ 1.57803051e-03 -2.21957081e-04 3.57703691e-03] [ 4.73069492e-04 5.89751846e-04 -3.79771769e-03] [ 1.55021691e-03 8.21438787e-04 2.16801832e-04] [-3.03540224e-03 2.69181609e-03 -2.70405641e-03] [-2.62451483e-03 -1.84750940e-03 -2.65084737e-03] [ 2.62451483e-03 -1.84750961e-03 2.65084785e-03] [ 3.03540214e-03 2.69181628e-03 2.70405630e-03]] Final stress: [ 1.15971041e-05 -2.63194689e-05 5.72308491e-05 7.15018679e-14 2.14183085e-04 -8.54100970e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.27357878e-11 1.07683374e-02 -4.64421651e-10] [-1.35713490e-11 -9.69928290e-04 -4.79111029e-10] [-1.71278366e-03 2.90218308e-03 6.78845281e-03] [ 3.61325035e-03 -2.22772562e-03 -3.52663943e-05] [-3.83447468e-03 -4.14206422e-03 -6.56322104e-03] [ 1.71278360e-03 2.90218380e-03 -6.78845253e-03] [ 3.83447381e-03 -4.14206475e-03 6.56322144e-03] [-3.61325005e-03 -2.22772591e-03 3.52665649e-05] [-8.00025219e-03 -6.42207347e-03 6.55286818e-05] [ 1.36737445e-03 4.99047581e-03 6.00126054e-05] [-1.36737397e-03 4.99047579e-03 -6.00125439e-05] [ 8.00025234e-03 -6.42207360e-03 -6.55286533e-05]] Final stress: [-6.73162562e-06 1.69486103e-05 2.05005297e-05 1.67603541e-13 -4.29494896e-04 7.57153659e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.33473985e-11 9.69188709e-04 4.94568462e-10] [-8.75382571e-12 -1.07667453e-02 4.79445311e-10] [-1.71192647e-03 -2.89796451e-03 -6.78950710e-03] [-3.83819889e-03 4.14166745e-03 6.56147310e-03] [ 3.60700808e-03 2.23206617e-03 3.80573446e-05] [ 1.71192647e-03 -2.89796519e-03 6.78950682e-03] [-3.60700749e-03 2.23206651e-03 -3.80576496e-05] [ 3.83819835e-03 4.14166770e-03 -6.56147334e-03] [-1.36839954e-03 -4.99031762e-03 5.99188841e-05] [ 8.00773293e-03 6.41332693e-03 6.54996189e-05] [-8.00773292e-03 6.41332689e-03 -6.54996528e-05] [ 1.36839950e-03 -4.99031776e-03 -5.99189940e-05]] Final stress: [-6.68267989e-06 1.69678100e-05 2.05159572e-05 3.87712313e-13 4.29494347e-04 2.73625009e-13] Minimization converged after 7 steps. Minimization converged after 7 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.17879979e-03 -4.17937460e-05 -9.79076229e-08] [-4.17879978e-03 4.17937259e-05 9.89579710e-08] [ 6.33335998e-03 1.59482103e-10 -9.92090115e-11] [-3.89532726e-04 -4.37873448e-03 5.86574015e-03] [-3.89532245e-04 4.37873417e-03 -5.86574043e-03] [ 6.98851164e-03 3.12348335e-10 1.23273242e-10] [-6.73556318e-04 -3.92674859e-03 -5.76232428e-03] [-6.73556111e-04 3.92674845e-03 5.76232436e-03] [-7.34231855e-04 3.64717683e-03 7.18079512e-03] [-6.84815550e-04 3.82543807e-03 7.18092270e-03] [-7.34231751e-04 -3.64717698e-03 -7.18079589e-03] [-6.84815502e-04 -3.82543791e-03 -7.18092280e-03]] Final stress: [ 1.82699512e-05 1.23618629e-05 -9.13710805e-05 -3.35779195e-04 -3.69498532e-13 -6.29109648e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.17876158e-03 -4.17932767e-05 9.76085372e-08] [ 4.17876158e-03 4.17932752e-05 -9.77608402e-08] [-6.98850281e-03 2.11642584e-10 -6.01681023e-11] [ 6.73151037e-04 3.92676875e-03 -5.76241353e-03] [ 6.73151337e-04 -3.92676889e-03 5.76241343e-03] [-6.33365152e-03 2.98287982e-10 1.13086101e-10] [ 3.89275654e-04 4.37849515e-03 5.86583007e-03] [ 3.89276100e-04 -4.37849540e-03 -5.86582989e-03] [ 6.85236978e-04 -3.82508224e-03 7.18096127e-03] [ 7.34651563e-04 -3.64682250e-03 7.18083356e-03] [ 6.85236991e-04 3.82508220e-03 -7.18096144e-03] [ 7.34651508e-04 3.64682242e-03 -7.18083336e-03]] Final stress: [ 1.82789289e-05 1.23708862e-05 -9.13676542e-05 3.35779715e-04 7.52098302e-14 1.95394973e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.95735966e-03 -2.37475581e-05 -7.24434116e-08] [-2.95735964e-03 2.37475383e-05 7.55447319e-08] [ 5.24808681e-03 2.56872306e-10 -1.18098958e-10] [-7.93105527e-04 -4.63763925e-03 4.28702384e-03] [-7.93104243e-04 4.63763853e-03 -4.28702443e-03] [ 6.62170065e-03 -5.00202671e-10 -2.12359064e-10] [-1.41293140e-03 -3.48923563e-03 -4.24439119e-03] [-1.41293376e-03 3.48923698e-03 4.24439010e-03] [-4.20587481e-04 4.69679043e-03 -1.68608811e-03] [-3.50909180e-04 4.79159032e-03 -1.68601394e-03] [-4.20587290e-04 -4.69679125e-03 1.68608788e-03] [-3.50909285e-04 -4.79158987e-03 1.68601307e-03]] Final stress: [-3.85876202e-05 -4.24347745e-05 1.29637988e-05 -2.51132529e-04 -3.16477280e-13 -2.70311206e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.95742438e-03 -2.37479161e-05 7.26384864e-08] [ 2.95742438e-03 2.37479499e-05 -7.35237356e-08] [-6.62166089e-03 1.50983902e-09 -6.46952775e-10] [ 1.41283351e-03 3.48923560e-03 -4.24448826e-03] [ 1.41283734e-03 -3.48923782e-03 4.24448644e-03] [-5.24813792e-03 1.72110189e-09 7.55177137e-10] [ 7.93051590e-04 4.63755823e-03 4.28712267e-03] [ 7.93055898e-04 -4.63756071e-03 -4.28712059e-03] [ 3.50953589e-04 -4.79181621e-03 -1.68628811e-03] [ 4.20632460e-04 -4.69701506e-03 -1.68636063e-03] [ 3.50953395e-04 4.79181694e-03 1.68628562e-03] [ 4.20632273e-04 4.69701576e-03 1.68636365e-03]] Final stress: [-3.85857884e-05 -4.24330059e-05 1.29696048e-05 2.51133009e-04 1.18999688e-12 1.15244214e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.84016934e-11 4.22055442e-03 2.44741110e-10] [-2.11805019e-12 4.13696889e-03 1.60157583e-10] [-2.46288081e-04 2.92857445e-03 6.71326290e-03] [ 4.29761066e-03 -4.53459935e-03 -3.40880061e-03] [-4.00777378e-03 -3.99262523e-03 -3.30538238e-03] [ 2.46288078e-04 2.92857400e-03 -6.71326309e-03] [ 4.00777379e-03 -3.99262526e-03 3.30538237e-03] [-4.29761111e-03 -4.53459914e-03 3.40880040e-03] [ 3.76065912e-03 7.99072415e-04 7.18056822e-03] [ 3.71124601e-03 6.20816164e-04 7.18122692e-03] [-3.71124574e-03 6.20816321e-04 -7.18122684e-03] [-3.76065897e-03 7.99072314e-04 -7.18056830e-03]] Final stress: [ 1.23708960e-05 1.82789206e-05 -9.13676564e-05 -2.45289623e-13 -3.35779720e-04 7.72185523e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.66026007e-11 -4.13696374e-03 -9.63448377e-11] [-1.05848904e-11 -4.22054955e-03 8.74675892e-10] [-2.46166595e-04 -2.92821708e-03 -6.71344217e-03] [-4.00780358e-03 3.99303406e-03 3.30547095e-03] [ 4.29751981e-03 4.53479742e-03 3.40889082e-03] [ 2.46166593e-04 -2.92821707e-03 6.71344215e-03] [-4.29751941e-03 4.53479769e-03 -3.40889102e-03] [ 4.00780367e-03 3.99303398e-03 -3.30547092e-03] [-3.71093464e-03 -6.21300200e-04 7.18132447e-03] [-3.76034839e-03 -7.99557539e-04 7.18066556e-03] [ 3.76034813e-03 -7.99557764e-04 -7.18066629e-03] [ 3.71093444e-03 -6.21300212e-04 -7.18132433e-03]] Final stress: [ 1.23783871e-05 1.82864811e-05 -9.13658371e-05 6.40185570e-13 3.35783250e-04 -6.40464044e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.17418341e-11 2.98116708e-03 8.95811830e-10] [ 4.37874703e-11 2.93367133e-03 -2.38587718e-09] [-6.40890435e-04 3.44934193e-03 4.92535709e-03] [ 4.41744300e-03 -4.16418799e-03 -2.48419556e-03] [-3.70957340e-03 -3.01294934e-03 -2.44156198e-03] [ 6.40890462e-04 3.44934301e-03 -4.92535664e-03] [ 3.70957102e-03 -3.01295072e-03 2.44156306e-03] [-4.41744337e-03 -4.16418776e-03 2.48419541e-03] [ 4.77953224e-03 4.32587776e-04 -1.68631906e-03] [ 4.70985297e-03 3.37788125e-04 -1.68600722e-03] [-4.70985166e-03 3.37788482e-04 1.68600887e-03] [-4.77953092e-03 4.32588065e-04 1.68631751e-03]] Final stress: [-4.24462423e-05 -3.85990588e-05 1.29605121e-05 -2.20525245e-12 -2.51130610e-04 1.30087620e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.91281855e-11 -2.93343061e-03 5.59027822e-10] [-3.69183347e-11 -2.98092322e-03 -1.29486234e-09] [-6.40750096e-04 -3.44904266e-03 -4.92524843e-03] [-3.70969162e-03 3.01346068e-03 2.44150952e-03] [ 4.41742269e-03 4.16444831e-03 2.48413994e-03] [ 6.40750105e-04 -3.44904224e-03 4.92524858e-03] [-4.41742308e-03 4.16444812e-03 -2.48413980e-03] [ 3.70969324e-03 3.01345975e-03 -2.44150880e-03] [-4.70860678e-03 -3.38448391e-04 -1.68517663e-03] [-4.77828566e-03 -4.33240519e-04 -1.68548535e-03] [ 4.77828498e-03 -4.33240328e-04 1.68548613e-03] [ 4.70860628e-03 -3.38448883e-04 1.68517556e-03]] Final stress: [-4.24349272e-05 -3.85879193e-05 1.29506277e-05 1.01649986e-12 2.51132016e-04 1.42216039e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 7 steps. Minimization converged after 7 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.35738272e-03 -4.75387414e-06 -7.71580230e-09] [-1.35738272e-03 4.75386928e-06 7.31597840e-09] [ 3.31204820e-03 -8.76124076e-11 4.30905066e-11] [ 6.41503322e-04 -1.60245269e-03 2.49057212e-03] [ 6.41503255e-04 1.60245274e-03 -2.49057207e-03] [ 3.39490936e-03 1.14253871e-10 4.51319030e-11] [ 6.13674003e-04 -1.54514949e-03 -2.47797018e-03] [ 6.13673757e-04 1.54514963e-03 2.47797008e-03] [-1.63292892e-03 2.35412353e-04 -2.00640885e-03] [-1.61834431e-03 2.63415374e-04 -2.00639730e-03] [-1.63292887e-03 -2.35412599e-04 2.00640912e-03] [-1.61834435e-03 -2.63415340e-04 2.00639739e-03]] Final stress: [-2.19059468e-06 -3.12645336e-06 4.44121399e-05 -1.25583123e-04 -8.45795662e-14 -5.55473453e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.35727278e-03 -4.75405577e-06 7.29777853e-09] [ 1.35727279e-03 4.75405356e-06 -7.71534777e-09] [-3.39568596e-03 -1.70743457e-10 7.47827893e-11] [-6.13721050e-04 1.54486880e-03 -2.47802267e-03] [-6.13721221e-04 -1.54486870e-03 2.47802277e-03] [-3.31201411e-03 -1.12692208e-10 -4.07401707e-11] [-6.41955481e-04 1.60287386e-03 2.49062569e-03] [-6.41955858e-04 -1.60287364e-03 -2.49062586e-03] [ 1.61883463e-03 -2.62774995e-04 -2.00643963e-03] [ 1.63341942e-03 -2.34771168e-04 -2.00645147e-03] [ 1.61883466e-03 2.62774895e-04 2.00644004e-03] [ 1.63341939e-03 2.34771230e-04 2.00645150e-03]] Final stress: [-2.21476355e-06 -3.15065976e-06 4.44015178e-05 1.25590626e-04 -7.26628978e-15 -3.18717542e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.17429005e-04 9.22483974e-04 1.52224148e-09] [-9.27538958e-04 9.22483965e-04 -1.90754899e-09] [ 1.32144998e-04 1.56562690e-03 1.38299865e-03] [ 1.42464191e-03 -3.60371363e-03 5.13994311e-04] [-1.38624672e-03 1.86629689e-03 -1.89696544e-03] [ 3.21496559e-03 1.55411369e-03 -1.40095587e-03] [-1.27461267e-04 -9.26905898e-04 -5.05015565e-04] [-2.91696445e-03 -7.96497141e-04 1.90594403e-03] [ 1.68724455e-03 9.19586676e-04 -1.70278485e-03] [ 1.65817334e-03 9.21942982e-04 -1.70280257e-03] [-9.35300438e-04 -1.67388737e-03 1.70280096e-03] [-9.06229539e-04 -1.67153104e-03 1.70278672e-03]] Final stress: [-9.09969340e-05 -9.09969326e-05 -2.62287106e-06 -8.09789605e-05 -8.09789612e-05 -3.71691380e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.27553154e-04 -9.22497653e-04 1.62078502e-09] [-9.17442165e-04 -9.22497662e-04 -1.17682757e-09] [ 1.32289883e-04 -1.56572590e-03 -1.38306439e-03] [-1.38635182e-03 -1.86638524e-03 1.89705610e-03] [ 1.42485390e-03 3.60415412e-03 -5.14019075e-04] [ 3.21535486e-03 -1.55421334e-03 1.40102334e-03] [-2.91719121e-03 7.96619646e-04 -1.90603572e-03] [-1.27372178e-04 9.27134109e-04 5.05039220e-04] [-9.35178800e-04 1.67352678e-03 -1.70301045e-03] [-9.06105493e-04 1.67116938e-03 -1.70299689e-03] [ 1.68688498e-03 -9.19463381e-04 1.70299488e-03] [ 1.65781120e-03 -9.21820863e-04 1.70301254e-03]] Final stress: [-9.10049018e-05 -9.10048999e-05 -2.62276606e-06 -8.09861727e-05 8.09861726e-05 3.71735557e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.17502872e-04 9.22558838e-04 -1.76381026e-09] [ 9.27614765e-04 9.22558821e-04 9.00308219e-10] [-3.21526277e-03 1.55466922e-03 1.40092886e-03] [ 2.91772273e-03 -7.96293455e-04 -1.90590617e-03] [ 1.27612633e-04 -9.27051594e-04 5.05004375e-04] [-1.32142559e-04 1.56618308e-03 -1.38296888e-03] [ 1.38685614e-03 1.86675830e-03 1.89692636e-03] [-1.42464090e-03 -3.60412080e-03 -5.13984145e-04] [ 9.05916526e-04 -1.67190673e-03 -1.70303335e-03] [ 9.34992396e-04 -1.67426474e-03 -1.70304658e-03] [-1.65854803e-03 9.21633487e-04 1.70304894e-03] [-1.68762382e-03 9.19275583e-04 1.70303145e-03]] Final stress: [-9.10066600e-05 -9.10066603e-05 -2.62282697e-06 8.09882277e-05 -8.09882271e-05 3.71761344e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 9.27210197e-04 -9.22160075e-04 -1.96462393e-09] [ 9.17110011e-04 -9.22160094e-04 1.34813606e-09] [-3.21091741e-03 -1.55121873e-03 -1.39954205e-03] [ 1.31509244e-04 9.17790171e-04 -5.04505854e-04] [ 2.91339361e-03 7.98207650e-04 1.90402074e-03] [-1.24386012e-04 -1.56274913e-03 1.38160280e-03] [-1.42245533e-03 3.59780491e-03 5.13475591e-04] [ 1.38082680e-03 -1.86780688e-03 -1.89505100e-03] [-1.65799029e-03 -9.17542567e-04 -1.71067948e-03] [-1.68704788e-03 -9.15204079e-04 -1.71066185e-03] [ 9.01844735e-04 1.67135013e-03 1.71066386e-03] [ 9.30902324e-04 1.67368869e-03 1.71067786e-03]] Final stress: [-9.11336678e-05 -9.11336678e-05 -2.54851719e-06 8.09224219e-05 8.09224227e-05 -3.71202634e-07] Minimization converged after 67 steps. Minimization converged after 68 steps. Minimization converged after 69 steps. Minimization converged after 68 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.61697171e-12 1.36176472e-03 4.40199346e-11] [-8.52975899e-12 1.35226462e-03 -7.85021437e-10] [-2.85351505e-05 2.78218294e-04 2.86782415e-03] [ 1.59220845e-03 -2.47497485e-03 -1.44022899e-03] [-1.55007646e-03 -2.41109747e-03 -1.42763842e-03] [ 2.85351467e-05 2.78218687e-04 -2.86782399e-03] [ 1.55007632e-03 -2.41109755e-03 1.42763849e-03] [-1.59220785e-03 -2.47497519e-03 1.44022927e-03] [ 2.54227055e-04 1.63941597e-03 -2.00904157e-03] [ 2.39648269e-04 1.61142346e-03 -2.00901321e-03] [-2.39648489e-04 1.61142342e-03 2.00901371e-03] [-2.54227277e-04 1.63941590e-03 2.00904129e-03]] Final stress: [-3.13402355e-06 -2.19875890e-06 4.44541851e-05 3.55739388e-13 -1.25538459e-04 8.22582979e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-7.78241881e-12 -1.35273625e-03 1.19170762e-10] [-1.00519486e-11 -1.36224366e-03 -6.87536552e-10] [-2.81990305e-05 -2.81075856e-04 -2.86857354e-03] [-1.55277656e-03 2.41292097e-03 1.42800842e-03] [ 1.59457690e-03 2.47621939e-03 1.44060929e-03] [ 2.81990179e-05 -2.81075597e-04 2.86857364e-03] [-1.59457698e-03 2.47621935e-03 -1.44060925e-03] [ 1.55277726e-03 2.41292056e-03 -1.42800811e-03] [-2.42751666e-04 -1.61128614e-03 -2.00633946e-03] [-2.57336098e-04 -1.63928823e-03 -2.00636748e-03] [ 2.57335776e-04 -1.63928822e-03 2.00636792e-03] [ 2.42751388e-04 -1.61128631e-03 2.00633913e-03]] Final stress: [-3.10542176e-06 -2.16959443e-06 4.44211376e-05 5.16145729e-13 1.25575863e-04 3.96691409e-13] Minimization converged after 70 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 55 steps. Final forces: [[ 0.00284195 0.03510762 -0.01817905] [-0.00162503 -0.02438576 0.01827974] [ 0.01889166 0.01503961 0.01922777] [-0.03688961 0.00492769 0.02686519] [ 0.01569299 -0.02175984 0.02902757] [ 0.01401083 -0.01672827 -0.02327369] [-0.0106684 -0.00963025 -0.02104932] [-0.01280889 -0.00413213 -0.01055038] [ 0.0044221 -0.01018513 0.00530692] [-0.01871491 -0.01724802 -0.01958723] [ 0.00753067 0.02046482 -0.00711901] [ 0.01731664 0.02852965 0.00105149]] Final stress: [ 5.81075412e-03 3.25268036e-03 3.41529696e-02 8.91810230e-05 -9.13078751e-03 -2.90003120e-03] Minimization converged after 68 steps. Minimization converged after 70 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.31896513e-02 7.15328487e-04 -7.49367123e-06] [-1.31896428e-02 -7.15329061e-04 -7.96957396e-06] [ 6.10417436e-03 -1.07006129e-03 -1.01697848e-02] [-1.36243519e-02 2.46612977e-03 1.21175810e-03] [-8.23674561e-03 4.78237694e-03 8.94246601e-03] [-6.10417341e-03 1.06955936e-03 -1.01699928e-02] [ 1.36245728e-02 -2.46600435e-03 1.21164541e-03] [ 8.23626303e-03 -4.78209408e-03 8.94223696e-03] [-8.30238487e-03 6.13625066e-05 -3.65381272e-03] [ 8.30252251e-03 -6.13476561e-05 -3.65387665e-03] [-6.82533913e-03 -5.74531233e-03 3.67766768e-03] [ 6.82545377e-03 5.74539171e-03 3.67715613e-03]] Final stress: [ 3.37747978e-04 2.64151649e-04 3.02297070e-04 -1.69576829e-10 5.83055802e-11 -4.40548846e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.32095591e-02 7.16044357e-04 7.39369704e-06] [ 1.32095618e-02 -7.16038123e-04 6.65743891e-06] [ 6.10918078e-03 1.07748028e-03 1.01599067e-02] [-8.23946343e-03 -4.78911409e-03 -8.94110049e-03] [-1.36422704e-02 -2.46926021e-03 -1.20285377e-03] [-6.10918323e-03 -1.07704155e-03 1.01600913e-02] [ 8.23902126e-03 4.78885545e-03 -8.94088922e-03] [ 1.36426174e-02 2.46906237e-03 -1.20268546e-03] [-6.81764773e-03 5.73758399e-03 -3.69057483e-03] [ 6.81769603e-03 -5.73759016e-03 -3.68993288e-03] [-8.32525240e-03 -7.46733783e-05 3.66701925e-03] [ 8.32529899e-03 7.46910643e-05 3.66696824e-03]] Final stress: [ 3.37990980e-04 2.64322272e-04 3.02708007e-04 -3.55941381e-11 2.72659223e-11 4.40839334e-04] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.53349552e-03 2.48599706e-03 -3.17923550e-06] [-1.53349553e-03 -2.48599705e-03 3.17926709e-06] [ 2.04440792e-03 -7.10703252e-11 1.80979649e-11] [ 8.62390924e-04 -3.64183888e-04 3.86498294e-03] [ 8.62391077e-04 3.64183816e-04 -3.86498301e-03] [-6.33584528e-04 -1.57769818e-10 -5.67102053e-11] [-3.17462554e-04 -1.31236677e-04 -9.65165213e-04] [-3.17462114e-04 1.31236440e-04 9.65165404e-04] [ 2.10003080e-04 6.72686318e-04 -1.30311018e-03] [ 7.31521622e-05 3.92519023e-03 -1.31181126e-03] [ 2.10002978e-04 -6.72685933e-04 1.30311002e-03] [ 7.31521011e-05 -3.92519009e-03 1.31181132e-03]] Final stress: [ 2.18834243e-07 2.83852842e-05 4.12441337e-05 -1.61466516e-04 5.02156943e-13 5.31112980e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.53167337e-03 2.48305659e-03 3.15479028e-06] [ 1.53167337e-03 -2.48305659e-03 -3.15459122e-06] [ 6.31361376e-04 -2.84938436e-11 8.53618973e-12] [ 3.17635420e-04 1.31501081e-04 -9.63932542e-04] [ 3.17635522e-04 -1.31501132e-04 9.63932503e-04] [-2.04249903e-03 3.72291023e-11 6.00498775e-12] [-8.65689691e-04 3.62302482e-04 3.86310576e-03] [-8.65689846e-04 -3.62302394e-04 -3.86310583e-03] [-6.91373653e-05 -3.91574866e-03 -1.30883703e-03] [-2.08912873e-04 -6.71911677e-04 -1.30016524e-03] [-6.91373385e-05 3.91574853e-03 1.30883698e-03] [-2.08912900e-04 6.71911757e-04 1.30016518e-03]] Final stress: [ 1.55651327e-07 2.83913852e-05 4.11749458e-05 1.61382089e-04 -1.20681804e-14 -4.18091934e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.50537086e-02 -2.22550710e-02 7.06988469e-04] [-1.50537085e-02 2.22550709e-02 -7.06990415e-04] [ 5.52196284e-03 -8.73885697e-10 3.31304460e-10] [-3.24181298e-03 -6.73583789e-03 9.03594702e-03] [-3.24181489e-03 6.73583912e-03 -9.03594610e-03] [ 2.13325555e-02 9.61777504e-11 5.73671579e-11] [-4.30196263e-03 -1.33104580e-02 -2.80967852e-02] [-4.30196252e-03 1.33104578e-02 2.80967852e-02] [ 1.21516842e-02 1.59814021e-02 -3.38979312e-02] [-2.98145853e-03 -8.68337143e-03 -3.28080190e-02] [ 1.21516846e-02 -1.59814019e-02 3.38979322e-02] [-2.98145849e-03 8.68337110e-03 3.28080187e-02]] Final stress: [-2.54669672e-05 -2.94170802e-04 6.71525537e-04 -1.46967801e-03 -8.36138255e-13 1.66625413e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.50762615e-02 -2.22868077e-02 -7.09026777e-04] [ 1.50762613e-02 2.22868076e-02 7.09028743e-04] [-2.13597676e-02 1.61424850e-11 -1.69486788e-10] [ 4.31759575e-03 1.33411500e-02 -2.81295925e-02] [ 4.31759430e-03 -1.33411492e-02 2.81295928e-02] [-5.53510456e-03 -6.43348307e-10 -1.29464194e-10] [ 3.24677418e-03 6.74079897e-03 9.05017024e-03] [ 3.24677394e-03 -6.74079929e-03 -9.05017005e-03] [ 2.98718585e-03 8.69497669e-03 -3.28613857e-02] [-1.21803806e-02 -1.59939536e-02 -3.39543487e-02] [ 2.98718674e-03 -8.69497570e-03 3.28613844e-02] [-1.21803807e-02 1.59939528e-02 3.39543477e-02]] Final stress: [-2.52381267e-05 -2.94366610e-04 6.72909965e-04 1.47175537e-03 -1.57296720e-12 5.95403370e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.85974861e-12 4.03747826e-03 1.57061381e-10] [ 8.11947298e-12 -9.79252322e-04 7.94192296e-10] [ 1.36219012e-03 -1.50777592e-04 2.78856406e-03] [ 8.57861575e-04 -6.72450743e-04 4.86642333e-05] [ 3.42773744e-04 -4.22787510e-04 -2.81377892e-03] [-1.36219011e-03 -1.50778149e-04 -2.78856429e-03] [-3.42773249e-04 -4.22787237e-04 2.81377870e-03] [-8.57862397e-04 -6.72450274e-04 -4.86646031e-05] [ 2.38714601e-03 -1.72043215e-03 -1.30901837e-03] [ 2.20610873e-03 1.43733489e-03 -1.30147541e-03] [-2.20610855e-03 1.43733485e-03 1.30147505e-03] [-2.38714589e-03 -1.72043202e-03 1.30901860e-03]] Final stress: [-1.40326712e-06 2.99551782e-05 4.11903983e-05 -3.13170990e-13 -1.61482764e-04 -3.74643540e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.49074702e-11 9.80356138e-04 -7.98416359e-11] [-9.21066856e-12 -4.04184958e-03 7.39782879e-10] [ 1.36416700e-03 1.48929972e-04 -2.79020884e-03] [ 3.40463332e-04 4.21172121e-04 2.81486834e-03] [ 8.57131105e-04 6.73139969e-04 -4.81083323e-05] [-1.36416701e-03 1.48929615e-04 2.79020871e-03] [-8.57130252e-04 6.73140469e-04 4.81079446e-05] [-3.40463583e-04 4.21172266e-04 -2.81486846e-03] [-2.21182098e-03 -1.43895514e-03 -1.30421678e-03] [-2.39044211e-03 1.72645972e-03 -1.31181218e-03] [ 2.39044186e-03 1.72645951e-03 1.31181178e-03] [ 2.21182067e-03 -1.43895507e-03 1.30421715e-03]] Final stress: [-1.35381913e-06 2.99466000e-05 4.12520776e-05 4.65463576e-13 1.61561339e-04 -5.71113033e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.04802785e-10 -5.44219509e-03 -1.17019646e-09] [ 2.13894890e-11 3.61087143e-02 6.79222719e-10] [-6.35910796e-03 1.01364248e-02 2.16659604e-02] [ 1.12119047e-02 -5.53183498e-03 -2.21852141e-02] [-8.80966752e-03 -1.11043905e-02 -3.00096066e-04] [ 6.35910805e-03 1.01364254e-02 -2.16659601e-02] [ 8.80966467e-03 -1.11043923e-02 3.00097378e-04] [-1.12119048e-02 -5.53183495e-03 2.21852141e-02] [ 1.25318438e-02 1.09083028e-02 -3.27077623e-02] [-5.52651047e-03 -1.97417616e-02 -3.41986040e-02] [ 5.52651196e-03 -1.97417606e-02 3.41986026e-02] [-1.25318425e-02 1.09083028e-02 3.27077627e-02]] Final stress: [-1.30417301e-04 -1.89186536e-04 6.73984800e-04 -2.92511816e-12 -1.46801093e-03 2.98697839e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 4.61114225e-11 -3.61012256e-02 -7.88412166e-10] [ 2.54065749e-11 5.44156905e-03 -2.78674701e-10] [-6.35869356e-03 -1.01333246e-02 -2.16617775e-02] [-8.80822771e-03 1.11003843e-02 2.99685175e-04] [ 1.12080177e-02 5.53191203e-03 2.21810986e-02] [ 6.35869361e-03 -1.01333242e-02 2.16617777e-02] [-1.12080185e-02 5.53191142e-03 -2.21810981e-02] [ 8.80822782e-03 1.11003842e-02 -2.99685065e-04] [ 5.52285923e-03 1.97377504e-02 -3.41900139e-02] [-1.25289283e-02 -1.09068938e-02 -3.26997593e-02] [ 1.25289286e-02 -1.09068935e-02 3.26997591e-02] [-5.52285896e-03 1.97377504e-02 3.41900144e-02]] Final stress: [-1.30416350e-04 -1.89208410e-04 6.73772840e-04 -6.49708636e-13 1.46770157e-03 5.39269824e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.53084755e-03 -2.51239602e-03 3.14429740e-06] [-1.53084756e-03 2.51239600e-03 -3.14420590e-06] [-3.04241408e-04 4.27616751e-10 -1.64990140e-10] [-5.07637762e-04 1.95793452e-04 9.78758979e-04] [-5.07637407e-04 -1.95793653e-04 -9.78759128e-04] [ 1.69525649e-03 -2.20247773e-10 -7.58439944e-11] [ 1.04905448e-03 -6.90913137e-04 -3.83876725e-03] [ 1.04905401e-03 6.90913413e-04 3.83876705e-03] [ 6.01479376e-05 3.88165126e-03 -1.31260040e-03] [ 2.33775390e-04 7.18547841e-04 -1.30386387e-03] [ 6.01479518e-05 -3.88165131e-03 1.31260064e-03] [ 2.33775433e-04 -7.18548058e-04 1.30386413e-03]] Final stress: [ 2.99234367e-05 -1.35791727e-06 4.12513187e-05 -1.61641573e-04 -2.09423338e-13 3.39799311e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.53013641e-03 -2.51121002e-03 -3.13485970e-06] [ 1.53013641e-03 2.51121002e-03 3.13546018e-06] [-1.69487502e-03 2.13658798e-10 -8.24409804e-11] [-1.05009279e-03 6.89702243e-04 -3.83803238e-03] [-1.05009265e-03 -6.89702324e-04 3.83803232e-03] [ 3.03820751e-04 -6.23102893e-11 -3.72242383e-11] [ 5.07467902e-04 -1.95260146e-04 9.78260328e-04] [ 5.07467436e-04 1.95260407e-04 -9.78260538e-04] [-2.33334068e-04 -7.18244140e-04 -1.30268539e-03] [-5.86502028e-05 -3.87801016e-03 -1.31141088e-03] [-2.33334020e-04 7.18243941e-04 1.30268535e-03] [-5.86501632e-05 3.87801003e-03 1.31141072e-03]] Final stress: [ 2.99266735e-05 -1.37994059e-06 4.12246045e-05 1.61607657e-04 -2.70105671e-13 -1.53216946e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.53403676e-02 2.06849325e-02 -7.33400701e-04] [-1.53403676e-02 -2.06849325e-02 7.33402147e-04] [ 1.87093552e-02 -9.43959416e-10 2.67319754e-10] [-4.11482380e-03 -1.46832509e-02 3.00127226e-02] [-4.11482435e-03 1.46832511e-02 -3.00127225e-02] [ 9.59233893e-03 2.03586031e-10 1.26936505e-10] [-3.56423853e-03 -5.94540024e-03 -8.00083400e-03] [-3.56423919e-03 5.94540054e-03 8.00083382e-03] [-4.61440157e-03 -1.18273587e-02 -3.29400942e-02] [ 1.34829848e-02 1.88239195e-02 -3.40097964e-02] [-4.61440135e-03 1.18273583e-02 3.29400933e-02] [ 1.34829850e-02 -1.88239187e-02 3.40097955e-02]] Final stress: [-1.89304948e-04 -1.30402876e-04 6.74562376e-04 -1.46913930e-03 -1.07529560e-12 -3.03540239e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.53396072e-02 2.06839239e-02 7.33340736e-04] [ 1.53396072e-02 -2.06839239e-02 -7.33343556e-04] [-9.59171340e-03 -2.46399620e-10 1.41580984e-10] [ 3.56187641e-03 5.94480024e-03 -8.00131091e-03] [ 3.56187677e-03 -5.94480044e-03 8.00131083e-03] [-1.87111098e-02 -8.38325610e-10 -2.43673406e-10] [ 4.11467664e-03 1.46830607e-02 3.00114987e-02] [ 4.11467722e-03 -1.46830612e-02 -3.00114983e-02] [-1.34810463e-02 -1.88200768e-02 -3.40088180e-02] [ 4.61629729e-03 1.18271481e-02 -3.29392168e-02] [-1.34810463e-02 1.88200781e-02 3.40088191e-02] [ 4.61629706e-03 -1.18271476e-02 3.29392184e-02]] Final stress: [-1.89266422e-04 -1.30359213e-04 6.74553217e-04 1.46909492e-03 6.88844114e-13 2.68811546e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.74707409e-11 -9.53845701e-04 -2.16891439e-11] [ 9.13421501e-12 4.02105905e-03 -8.45926255e-10] [-9.74517005e-04 -1.08292270e-04 2.77978852e-03] [-5.32583383e-04 -1.33965496e-04 -2.85020504e-03] [-1.00649248e-03 -1.00179172e-03 4.66976788e-05] [ 9.74517001e-04 -1.08292219e-04 -2.77978848e-03] [ 1.00649183e-03 -1.00179209e-03 -4.66973715e-05] [ 5.32583611e-04 -1.33965616e-04 2.85020514e-03] [ 2.23192831e-03 1.48042184e-03 -1.30403738e-03] [ 2.36384933e-03 -1.76997886e-03 -1.31142595e-03] [-2.36384919e-03 -1.76997861e-03 1.31142656e-03] [-2.23192807e-03 1.48042168e-03 1.30403720e-03]] Final stress: [ 2.83591329e-05 2.13440800e-07 4.12433149e-05 -3.38213871e-13 -1.61546814e-04 9.02490859e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.41995286e-12 -4.02122559e-03 -2.31012731e-10] [-1.38325730e-11 9.54016442e-04 8.36213648e-10] [-9.75160604e-04 1.08206849e-04 -2.77987283e-03] [-1.00659259e-03 1.00214697e-03 -4.66594131e-05] [-5.32288222e-04 1.34131848e-04 2.85025163e-03] [ 9.75160604e-04 1.08206503e-04 2.77987269e-03] [ 5.32288700e-04 1.34132130e-04 -2.85025186e-03] [ 1.00659263e-03 1.00214694e-03 4.66594219e-05] [-2.36388023e-03 1.76973246e-03 -1.31157263e-03] [-2.23147157e-03 -1.48061344e-03 -1.30418236e-03] [ 2.23147131e-03 -1.48061345e-03 1.30418173e-03] [ 2.36387998e-03 1.76973235e-03 1.31157301e-03]] Final stress: [2.83479851e-05 2.00756180e-07 4.12403813e-05 4.34318546e-13 1.61552986e-04 1.94373544e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.03266655e-11 3.73617423e-02 -3.37704306e-10] [-4.35013179e-11 -7.20166416e-03 3.80112051e-10] [ 6.11200398e-03 9.20562778e-03 2.16896584e-02] [ 1.07522749e-02 -1.24052918e-02 -9.00584819e-04] [-9.94648567e-03 -2.65881083e-03 -2.00995465e-02] [-6.11200408e-03 9.20562814e-03 -2.16896584e-02] [ 9.94648712e-03 -2.65881006e-03 2.00995459e-02] [-1.07522749e-02 -1.24052920e-02 9.00584855e-04] [-3.94008959e-03 -1.69831065e-02 -3.42006748e-02] [ 1.12204337e-02 7.76154216e-03 -3.26163168e-02] [-1.12204343e-02 7.76154137e-03 3.26163167e-02] [ 3.94008879e-03 -1.69831063e-02 3.42006754e-02]] Final stress: [-2.94641187e-04 -2.49625665e-05 6.72971528e-04 1.58375032e-12 -1.47205731e-03 -2.42284986e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.68109806e-12 7.20356315e-03 -9.49491583e-10] [-7.05841341e-12 -3.73730418e-02 3.11374562e-10] [ 6.11520899e-03 -9.20948199e-03 -2.16955587e-02] [-9.95256617e-03 2.65947404e-03 2.01041596e-02] [ 1.07540722e-02 1.24091561e-02 9.01497138e-04] [-6.11520892e-03 -9.20948092e-03 2.16955591e-02] [-1.07540726e-02 1.24091558e-02 -9.01496966e-04] [ 9.95256754e-03 2.65947320e-03 -2.01041590e-02] [-1.12238551e-02 -7.76172138e-03 -3.26275040e-02] [ 3.94418217e-03 1.69873127e-02 -3.42127721e-02] [-3.94418250e-03 1.69873126e-02 3.42127713e-02] [ 1.12238544e-02 -7.76172142e-03 3.26275043e-02]] Final stress: [-2.94673123e-04 -2.49051042e-05 6.73268369e-04 4.48482144e-13 1.47249582e-03 9.82600066e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.15140122e-03 -1.22846851e-04 -6.85883248e-07] [-5.15140122e-03 1.22846874e-04 6.85915863e-07] [ 1.70769910e-02 2.16496136e-11 -1.20112872e-11] [-4.71225184e-03 -1.37496980e-02 7.98202105e-03] [-4.71225182e-03 1.37496980e-02 -7.98202103e-03] [ 1.86585321e-02 4.61300071e-12 -6.80477645e-12] [-5.26550966e-03 -1.26446699e-02 -7.68542473e-03] [-5.26550965e-03 1.26446699e-02 7.68542478e-03] [-1.49487943e-03 3.89634134e-03 -2.85451071e-04] [-1.24371944e-03 4.41424051e-03 -2.84284422e-04] [-1.49487942e-03 -3.89634138e-03 2.85451032e-04] [-1.24371940e-03 -4.41424054e-03 2.84284365e-04]] Final stress: [-2.46201664e-05 -4.36683425e-05 3.31079046e-05 -6.44565792e-04 -3.60818439e-14 5.48441485e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.15184047e-03 -1.22865200e-04 6.86036967e-07] [ 5.15184048e-03 1.22865218e-04 -6.86055336e-07] [-1.86600582e-02 1.64560963e-11 1.05364576e-11] [ 5.26569586e-03 1.26457197e-02 -7.68612448e-03] [ 5.26569588e-03 -1.26457198e-02 7.68612446e-03] [-1.70785531e-02 -6.39148016e-11 4.55436192e-12] [ 4.71248927e-03 1.37506762e-02 7.98276789e-03] [ 4.71248920e-03 -1.37506762e-02 -7.98276784e-03] [ 1.24404207e-03 -4.41478974e-03 -2.84340305e-04] [ 1.49523797e-03 -3.89681095e-03 -2.85507159e-04] [ 1.24404210e-03 4.41478975e-03 2.84340294e-04] [ 1.49523800e-03 3.89681097e-03 2.85507144e-04]] Final stress: [-2.46168740e-05 -4.36679575e-05 3.31139768e-05 6.44613799e-04 -8.58867558e-14 1.06902923e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.20859612e-02 -3.15714689e-04 -2.05433333e-06] [-1.20859611e-02 3.15714744e-04 2.05242164e-06] [ 1.77073046e-02 8.72009067e-10 -2.94610430e-10] [-3.84119896e-03 -1.61441098e-02 1.64412700e-02] [-3.84119591e-03 1.61441082e-02 -1.64412713e-02] [ 2.24515588e-02 -2.91405076e-11 1.35886469e-10] [-5.74007723e-03 -1.25812092e-02 -1.58107125e-02] [-5.74007617e-03 1.25812089e-02 1.58107131e-02] [ 5.45180708e-04 2.54958949e-02 -9.33583729e-03] [ 1.04262307e-03 2.65434194e-02 -9.33323781e-03] [ 5.45180270e-04 -2.54958945e-02 9.33583768e-03] [ 1.04262314e-03 -2.65434186e-02 9.33324024e-03]] Final stress: [-1.29535864e-04 -1.74118241e-04 1.65057297e-04 -8.53254925e-04 1.64422778e-12 -1.88878595e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.20801709e-02 -3.15424390e-04 2.05132186e-06] [ 1.20801709e-02 3.15424396e-04 -2.05267659e-06] [-2.24370570e-02 -1.66133081e-09 5.75004812e-10] [ 5.73629595e-03 1.25774373e-02 -1.58026542e-02] [ 5.73629413e-03 -1.25774364e-02 1.58026549e-02] [-1.77004874e-02 1.49066341e-09 5.25773888e-10] [ 3.84118873e-03 1.61333842e-02 1.64327811e-02] [ 3.84119213e-03 -1.61333861e-02 -1.64327798e-02] [-1.04320269e-03 -2.65307894e-02 -9.33304199e-03] [-5.45681336e-04 -2.54830161e-02 -9.33563199e-03] [-1.04320275e-03 2.65307899e-02 9.33304076e-03] [-5.45681410e-04 2.54830168e-02 9.33563152e-03]] Final stress: [-1.29319699e-04 -1.73870566e-04 1.65093388e-04 8.52819627e-04 6.45901260e-13 -3.60283411e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.32958284e-11 5.27363802e-03 -1.01454873e-11] [ 3.80480738e-12 5.02799735e-03 -2.83816030e-11] [-5.58864046e-04 1.26056849e-02 9.04306173e-03] [ 1.35947781e-02 -1.08636492e-02 -4.67211781e-03] [-1.27984451e-02 -9.63110402e-03 -4.37556713e-03] [ 5.58864054e-04 1.26056850e-02 -9.04306168e-03] [ 1.27984451e-02 -9.63110404e-03 4.37556716e-03] [-1.35947781e-02 -1.08636491e-02 4.67211783e-03] [ 4.27992356e-03 1.62800561e-03 -2.86563959e-04] [ 4.02881243e-03 1.11024496e-03 -2.83061256e-04] [-4.02881241e-03 1.11024493e-03 2.83061274e-04] [-4.27992353e-03 1.62800563e-03 2.86563883e-04]] Final stress: [-4.36674647e-05 -2.46230739e-05 3.31010024e-05 2.60121968e-14 -6.44506224e-04 -3.37267260e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.15899291e-11 -5.02788350e-03 3.74789500e-11] [-2.72460306e-12 -5.27351433e-03 -3.25821218e-11] [-5.58876765e-04 -1.26054609e-02 -9.04284201e-03] [-1.27981705e-02 9.63085054e-03 4.37546349e-03] [ 1.35945074e-02 1.08634068e-02 4.67200157e-03] [ 5.58876773e-04 -1.26054610e-02 9.04284202e-03] [-1.35945073e-02 1.08634068e-02 -4.67200155e-03] [ 1.27981705e-02 9.63085054e-03 -4.37546342e-03] [-4.02866563e-03 -1.11017901e-03 -2.83047287e-04] [-4.27976720e-03 -1.62791845e-03 -2.86549822e-04] [ 4.27976714e-03 -1.62791843e-03 2.86549761e-04] [ 4.02866563e-03 -1.11017908e-03 2.83047247e-04]] Final stress: [-4.36674946e-05 -2.46238799e-05 3.30994257e-05 5.94946327e-14 6.44493481e-04 -5.90578000e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 6.22553770e-11 1.23943836e-02 2.86390022e-10] [ 4.42492940e-11 1.17637266e-02 6.51712022e-10] [-1.89660333e-03 1.30697404e-02 1.86053844e-02] [ 1.55386473e-02 -1.36978017e-02 -9.62552467e-03] [-1.31690658e-02 -9.86712929e-03 -8.99551632e-03] [ 1.89660352e-03 1.30697411e-02 -1.86053843e-02] [ 1.31690635e-02 -9.86713074e-03 8.99551718e-03] [-1.55386477e-02 -1.36978016e-02 9.62552437e-03] [ 2.62532442e-02 -2.68399574e-04 -9.33728599e-03] [ 2.57559876e-02 -1.31546491e-03 -9.32698409e-03] [-2.57559863e-02 -1.31546434e-03 9.32698326e-03] [-2.62532430e-02 -2.68399694e-04 9.33728520e-03]] Final stress: [-1.73926517e-04 -1.29386708e-04 1.65012511e-04 -1.76367650e-12 -8.52743419e-04 1.71235153e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 2.65314077e-11 -1.17625199e-02 -5.10140469e-10] [-1.39056983e-11 -1.23930943e-02 -4.81104052e-10] [-1.89572284e-03 -1.30697655e-02 -1.86045022e-02] [-1.31708111e-02 9.87013631e-03 8.99508771e-03] [ 1.55394759e-02 1.36992267e-02 9.62507337e-03] [ 1.89572289e-03 -1.30697601e-02 1.86045040e-02] [-1.55394818e-02 1.36992234e-02 -9.62507093e-03] [ 1.31708164e-02 9.87013325e-03 -8.99508551e-03] [-2.57507484e-02 1.31260288e-03 -9.32441784e-03] [-2.62479776e-02 2.65607176e-04 -9.33471969e-03] [ 2.62479777e-02 2.65607719e-04 9.33471706e-03] [ 2.57507488e-02 1.31260245e-03 9.32441493e-03]] Final stress: [-1.73862987e-04 -1.29327167e-04 1.64987999e-04 -8.07312662e-13 8.52732640e-04 1.65741167e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.29554727e-03 -2.63591276e-05 -7.18901003e-08] [-2.29554727e-03 2.63591217e-05 7.14891221e-08] [ 5.31338841e-03 -5.79566786e-11 2.11420926e-11] [-8.48014218e-04 -4.51944260e-03 3.78552237e-03] [-8.48014378e-04 4.51944269e-03 -3.78552230e-03] [ 6.47512185e-03 1.07701955e-10 4.73234050e-11] [-1.37701649e-03 -3.57144970e-03 -3.73151516e-03] [-1.37701619e-03 3.57144953e-03 3.73151530e-03] [-7.13471817e-04 2.66938503e-03 2.53671781e-04] [-6.60205401e-04 2.77308554e-03 2.53762798e-04] [-7.13471833e-04 -2.66938496e-03 -2.53671767e-04] [-6.60205395e-04 -2.77308557e-03 -2.53762684e-04]] Final stress: [-2.39222182e-05 -2.78007192e-05 -2.40812441e-06 -2.73038412e-04 1.92503668e-14 2.03731913e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.29824703e-03 -2.64116801e-05 7.18038349e-08] [ 2.29824704e-03 2.64116750e-05 -7.15266523e-08] [-6.48986923e-03 2.35257559e-10 -9.82438638e-11] [ 1.37974483e-03 3.58184856e-03 -3.73635251e-03] [ 1.37974513e-03 -3.58184872e-03 3.73635236e-03] [-5.32839639e-03 2.93680072e-12 5.47363538e-12] [ 8.50967297e-04 4.52950380e-03 3.79050153e-03] [ 8.50967295e-04 -4.52950380e-03 -3.79050153e-03] [ 6.63401190e-04 -2.77918359e-03 2.61243222e-04] [ 7.16772296e-04 -2.67525301e-03 2.61151893e-04] [ 6.63401188e-04 2.77918359e-03 -2.61243363e-04] [ 7.16772317e-04 2.67525294e-03 -2.61151780e-04]] Final stress: [-2.38821986e-05 -2.77692792e-05 -2.51193871e-06 2.73351287e-04 -6.11601001e-14 1.24369384e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.61864489e-03 5.89860582e-03 1.64180048e-06] [-6.17855115e-03 5.89859044e-03 -1.64201916e-06] [ 1.65543322e-02 8.92371751e-03 1.03969157e-02] [ 8.00383623e-03 -2.05259269e-02 4.12507790e-03] [-1.38937446e-02 4.29689897e-04 -1.45107003e-02] [ 1.56561265e-02 9.07023164e-03 -1.11293213e-02] [ 8.28646086e-03 -2.08689225e-02 -3.75884524e-03] [-1.32781814e-02 1.64238002e-03 1.48768733e-02] [ 5.94031341e-03 9.86069619e-03 1.37910324e-03] [ 4.78722787e-03 1.03984792e-02 1.36836152e-03] [-1.07061172e-02 -5.63275469e-03 -1.37053679e-03] [-9.55305783e-03 -5.09478665e-03 -1.37692786e-03]] Final stress: [ 3.74585565e-05 3.74588163e-05 6.23232255e-05 -6.43179435e-04 -6.43179438e-04 -2.10765064e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.17740913e-03 -5.89752443e-03 1.64139609e-06] [-5.61765496e-03 -5.89753979e-03 -1.64128333e-06] [ 1.65490197e-02 -8.92080696e-03 -1.03952016e-02] [-1.38890207e-02 -4.29895725e-04 1.45082559e-02] [ 8.00211121e-03 2.05207763e-02 -4.12434283e-03] [ 1.56524991e-02 -9.06728598e-03 1.11273608e-02] [-1.32743462e-02 -1.64101183e-03 -1.48743058e-02] [ 8.28393919e-03 2.08624271e-02 3.75823330e-03] [-1.07030542e-02 5.63103827e-03 1.36794488e-03] [-9.55034375e-03 5.09322135e-03 1.37433312e-03] [ 5.93849819e-03 -9.85788316e-03 -1.37650749e-03] [ 4.78576154e-03 -1.03955151e-02 -1.36577052e-03]] Final stress: [ 3.74000369e-05 3.74002970e-05 6.23230001e-05 -6.43083410e-04 6.43083414e-04 2.10701500e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.61654879e-03 5.89632475e-03 -1.64037682e-06] [ 6.17608520e-03 5.89630944e-03 1.64051213e-06] [-1.56483360e-02 9.06541488e-03 1.11248081e-02] [ 1.32714374e-02 1.64099297e-03 -1.48709576e-02] [-8.28171908e-03 -2.08572566e-02 3.75743116e-03] [-1.65448638e-02 8.91898978e-03 -1.03929575e-02] [ 1.38860505e-02 4.30037488e-04 1.45050619e-02] [-7.99982234e-03 -2.05154325e-02 -4.12338637e-03] [ 9.54797808e-03 -5.09298816e-03 1.37398404e-03] [ 1.07002249e-02 -5.63059543e-03 1.36759950e-03] [-4.78565533e-03 1.03928129e-02 -1.36542632e-03] [-5.93792833e-03 9.85539046e-03 -1.37615714e-03]] Final stress: [ 3.73992163e-05 3.73994761e-05 6.23046986e-05 6.42951725e-04 -6.42951728e-04 2.10616618e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.17807576e-03 -5.89814991e-03 -1.64165380e-06] [ 5.61823926e-03 -5.89816529e-03 1.64172671e-06] [-1.56547106e-02 -9.06953212e-03 -1.11284110e-02] [-8.28557076e-03 2.08668817e-02 -3.75855642e-03] [ 1.32771565e-02 -1.64225918e-03 1.48756763e-02] [-1.65526566e-02 -8.92303343e-03 1.03961088e-02] [-8.00305453e-03 2.05240583e-02 4.12473722e-03] [ 1.38925682e-02 -4.29846805e-04 -1.45095551e-02] [-4.78693311e-03 -1.03972343e-02 1.36778579e-03] [-5.93986624e-03 -9.85951826e-03 1.37852544e-03] [ 9.55192262e-03 5.09444916e-03 -1.37635019e-03] [ 1.07048295e-02 5.63235015e-03 -1.36996092e-03]] Final stress: [ 3.74489415e-05 3.74492014e-05 6.23209956e-05 6.43137872e-04 6.43137875e-04 -2.10737198e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.31559258e-03 -2.31950731e-05 -1.01068976e-07] [-4.76024896e-03 1.89243095e-05 2.09587869e-08] [ 8.98438791e-04 -3.93108167e-04 3.04717079e-03] [-1.38454224e-03 -1.02212284e-03 -8.72520924e-06] [-1.20915569e-03 2.15179020e-04 -3.11444333e-03] [ 1.98412282e-04 4.91811176e-04 3.11624192e-03] [-9.17227042e-04 -9.25211225e-04 -3.04573337e-03] [-8.84146700e-04 1.64166555e-03 5.52594330e-06] [ 2.11065972e-03 2.26189414e-03 -1.73587051e-04] [ 2.60753340e-04 -2.26245649e-03 -1.69745410e-04] [ 2.20239318e-04 2.33927501e-03 1.69832237e-04] [ 2.15122461e-03 -2.34265540e-03 1.73543577e-04]] Final stress: [ 2.93197989e-05 2.65414189e-05 2.88888732e-05 -2.43632810e-04 -1.55849787e-07 -6.34430093e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.75879496e-03 -1.89135884e-05 -2.15713867e-08] [ 3.31461067e-03 2.31818229e-05 1.01156814e-07] [ 8.98169341e-04 3.93076594e-04 -3.04631308e-03] [-1.20883548e-03 -2.15211661e-04 3.11349727e-03] [-1.38434725e-03 1.02176624e-03 8.78694998e-06] [ 1.98278665e-04 -4.91750106e-04 -3.11535586e-03] [-8.84083316e-04 -1.64116941e-03 -5.46812464e-06] [-9.16962460e-04 9.25078980e-04 3.04481575e-03] [ 2.20279942e-04 -2.33866336e-03 -1.69783748e-04] [ 2.15072818e-03 2.34198569e-03 -1.73512786e-04] [ 2.11018564e-03 -2.26127131e-03 1.73556257e-04] [ 2.60771029e-04 2.26189011e-03 1.69697793e-04]] Final stress: [ 2.93142123e-05 2.65374219e-05 2.88837013e-05 -2.43562711e-04 1.55759814e-07 6.34240881e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.75975817e-03 -1.89207215e-05 2.11047867e-08] [-3.31525648e-03 2.31907030e-05 -1.01330657e-07] [-1.98324649e-04 -4.91857216e-04 3.11597734e-03] [ 9.17110476e-04 9.25201759e-04 -3.04543755e-03] [ 8.84135724e-04 -1.64160912e-03 5.48407883e-06] [-8.98423601e-04 3.93168014e-04 3.04691729e-03] [ 1.38454238e-03 1.02200876e-03 -8.76643493e-06] [ 1.20908158e-03 -2.15123878e-04 -3.11413688e-03] [-2.60785368e-04 2.26221091e-03 -1.69761414e-04] [-2.11050092e-03 -2.26159903e-03 -1.73606241e-04] [-2.15105749e-03 2.34234453e-03 1.73562517e-04] [-2.20279833e-04 -2.33901472e-03 1.69847525e-04]] Final stress: [ 2.93213181e-05 2.65434762e-05 2.88892901e-05 2.43609612e-04 1.55818179e-07 -6.34370395e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.31513973e-03 -2.31891779e-05 1.02933606e-07] [ 4.75959188e-03 1.89194685e-05 -2.12760066e-08] [-1.98269490e-04 4.91930206e-04 -3.11591168e-03] [ 8.84152785e-04 1.64163577e-03 -5.45526934e-06] [ 9.17053485e-04 -9.25213812e-04 3.04534280e-03] [-8.98444191e-04 -3.93240255e-04 -3.04685307e-03] [ 1.20906169e-03 2.15074580e-04 3.11404003e-03] [ 1.38459660e-03 -1.02197617e-03 8.79875080e-06] [-2.15099349e-03 -2.34219906e-03 -1.73573480e-04] [-2.20333492e-04 2.33887819e-03 -1.69852595e-04] [-2.60838617e-04 -2.26207963e-03 1.69766912e-04] [-2.11043743e-03 2.26145989e-03 1.73615950e-04]] Final stress: [ 2.93233514e-05 2.65456730e-05 2.88901782e-05 2.43601732e-04 -1.55805626e-07 6.34351784e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.99710394e-12 2.32464417e-03 1.34166427e-10] [ 2.51236946e-12 2.27182173e-03 2.24026836e-10] [-5.29807104e-04 3.45680093e-03 4.34544257e-03] [ 4.34657746e-03 -4.05550045e-03 -2.20002192e-03] [-3.76481224e-03 -3.07963909e-03 -2.14587318e-03] [ 5.29807099e-04 3.45680081e-03 -4.34544261e-03] [ 3.76481252e-03 -3.07963894e-03 2.14587305e-03] [-4.34657751e-03 -4.05550042e-03 2.20002189e-03] [ 2.75390330e-03 7.42016627e-04 2.61028174e-04] [ 2.70053302e-03 6.38089030e-04 2.61375022e-04] [-2.70053313e-03 6.38088983e-04 -2.61375143e-04] [-2.75390341e-03 7.42016616e-04 -2.61028209e-04]] Final stress: [-2.77690734e-05 -2.38820490e-05 -2.51199735e-06 1.83539873e-13 -2.73349334e-04 -1.33615261e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.41909299e-12 -2.27028235e-03 1.69537013e-10] [ 5.30925334e-12 -2.32304381e-03 3.51605707e-10] [-5.29943053e-04 -3.45165335e-03 -4.34215874e-03] [-3.75878378e-03 3.07433010e-03 2.14427192e-03] [ 4.34063026e-03 4.05036197e-03 2.19833820e-03] [ 5.29943049e-04 -3.45165372e-03 4.34215859e-03] [-4.34062998e-03 4.05036212e-03 -2.19833832e-03] [ 3.75878337e-03 3.07433034e-03 -2.14427211e-03] [-2.69704470e-03 -6.36290821e-04 2.56969214e-04] [-2.75035425e-03 -7.40084843e-04 2.56622840e-04] [ 2.75035431e-03 -7.40084837e-04 -2.56622967e-04] [ 2.69704476e-03 -6.36290797e-04 -2.56969151e-04]] Final stress: [-2.77878066e-05 -2.39057636e-05 -2.45084353e-06 -1.09868556e-13 2.73167781e-04 -3.67215358e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.03875907e-03 7.46146685e-04 -6.44229958e-05] [-4.03449070e-03 6.98056125e-04 6.45057964e-05] [ 3.94135864e-04 1.20526059e-03 4.85762974e-03] [ 7.38951359e-04 -5.40603215e-05 -2.45335761e-03] [-1.09170336e-03 -7.05850672e-04 -2.40460445e-03] [-4.01534637e-04 2.08994922e-03 1.30414569e-03] [ 1.16247307e-03 7.26077802e-05 -6.60382423e-04] [-8.10530267e-04 6.90244700e-04 -6.43471692e-04] [ 9.68653565e-04 1.15485355e-03 -1.37655739e-04] [-9.65390383e-04 -3.52605631e-03 -2.05659828e-04] [-9.22879388e-04 1.07619955e-03 1.37403951e-04] [ 9.23555806e-04 -3.44735090e-03 2.05869572e-04]] Final stress: [ 2.65199580e-05 2.93362281e-05 2.88853006e-05 -1.55774441e-07 -2.43574356e-04 -6.34265937e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.03577447e-03 7.44824921e-04 6.43993173e-05] [ 4.03151353e-03 6.96780034e-04 -6.44837182e-05] [ 4.01848849e-04 2.09006305e-03 -1.30415861e-03] [ 8.10192965e-04 6.90940530e-04 6.43487449e-04] [-1.16249584e-03 7.26746852e-05 6.60378203e-04] [-3.94466762e-04 1.20623957e-03 -4.85344566e-03] [ 1.09216789e-03 -7.05674177e-04 2.40253986e-03] [-7.39062604e-04 -5.32844105e-05 2.45123940e-03] [-9.26817007e-04 -3.44586215e-03 -2.01351720e-04] [ 9.23806037e-04 1.07460968e-03 -1.32921199e-04] [ 9.68624241e-04 -3.52449212e-03 2.01141279e-04] [-9.69536822e-04 1.15318038e-03 1.33175396e-04]] Final stress: [ 2.65567901e-05 2.93704120e-05 2.88183170e-05 1.55660195e-07 -2.43471457e-04 6.34093251e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.03489490e-03 -6.97978247e-04 6.45290448e-05] [-4.03916386e-03 -7.46082623e-04 -6.44461322e-05] [ 4.01702655e-04 -2.09032432e-03 1.30440844e-03] [-1.16265641e-03 -7.26649123e-05 -6.60516005e-04] [ 8.10558818e-04 -6.90570705e-04 -6.43600715e-04] [-3.94303260e-04 -1.20571467e-03 4.85798417e-03] [-7.39212109e-04 5.40499970e-05 -2.45354159e-03] [ 1.09211622e-03 7.06121474e-04 -2.40477542e-03] [ 9.66281494e-04 3.52644488e-03 -2.04782450e-04] [-9.69083534e-04 -1.15483666e-03 -1.36756257e-04] [-9.24432273e-04 3.44771645e-03 2.04992676e-04] [ 9.23297349e-04 -1.07616067e-03 1.36504241e-04]] Final stress: [ 2.65321124e-05 2.93491954e-05 2.88765224e-05 1.55826040e-07 2.43612240e-04 -6.34390903e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.03543413e-03 -6.98229458e-04 -6.45308657e-05] [ 4.03970453e-03 -7.46341497e-04 6.44434995e-05] [ 3.94224355e-04 -1.20547407e-03 -4.85876084e-03] [-1.09197816e-03 7.06122804e-04 2.40515920e-03] [ 7.39153635e-04 5.41937853e-05 2.45393557e-03] [-4.01626874e-04 -2.09030741e-03 -1.30439772e-03] [-8.10637559e-04 -6.90417812e-04 6.43593833e-04] [ 1.16265179e-03 -7.26577464e-05 6.60512628e-04] [-9.23077272e-04 -1.07644239e-03 -1.37421331e-04] [ 9.23702978e-04 3.44797239e-03 -2.05912589e-04] [ 9.68870657e-04 -1.15513251e-03 1.37675104e-04] [-9.65553951e-04 3.52671391e-03 2.05703501e-04]] Final stress: [ 2.65240110e-05 2.93415237e-05 2.88897702e-05 -1.55844817e-07 2.43628734e-04 6.34413743e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.70212797e-03 -6.20858721e-06 5.69302753e-07] [-1.70212833e-03 6.20881839e-06 5.85250483e-07] [ 3.19420414e-04 -1.76891038e-04 -1.27035674e-03] [-8.27573738e-05 9.37755315e-04 8.17973404e-04] [ 6.16116128e-04 -8.40685581e-05 4.51624519e-04] [-3.19420402e-04 1.76887232e-04 -1.27035825e-03] [ 8.27603625e-05 -9.37753420e-04 8.17971984e-04] [-6.16108423e-04 8.40641303e-05 4.51627837e-04] [ 6.12861501e-04 -5.25966889e-04 -1.56535805e-04] [-6.12865781e-04 5.25970960e-04 -1.56543239e-04] [ 2.22696788e-04 -3.57267223e-04 1.56717025e-04] [-2.22702856e-04 3.57269260e-04 1.56724709e-04]] Final stress: [ 2.04741964e-05 2.83123939e-05 2.46058160e-05 7.59426166e-12 5.78847602e-12 -5.69019469e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.67034961e-03 -5.86500347e-06 -5.46357453e-07] [ 1.67034980e-03 5.86494239e-06 -5.85538097e-07] [ 3.10465079e-04 1.73042638e-04 1.24315962e-03] [ 6.00265848e-04 7.33170810e-05 -4.44504750e-04] [-8.77288217e-05 -9.15829490e-04 -7.97896514e-04] [-3.10465054e-04 -1.73061328e-04 1.24315183e-03] [-6.00248996e-04 -7.33076171e-05 -4.44512790e-04] [ 8.77075317e-05 9.15842028e-04 -7.97906609e-04] [ 2.15431648e-04 3.49274353e-04 -1.52347778e-04] [-2.15429933e-04 -3.49276658e-04 -1.52342851e-04] [ 5.91046886e-04 5.11766545e-04 1.52181826e-04] [-5.91044377e-04 -5.11767491e-04 1.52149906e-04]] Final stress: [ 2.00863087e-05 2.76625744e-05 2.42517075e-05 -4.54093920e-12 -2.55323523e-12 5.60817623e-05] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.40342260e-04 1.23306746e-03 -1.72592349e-06] [-7.40342246e-04 -1.23306747e-03 1.72811038e-06] [ 9.23724475e-04 3.25025882e-10 -1.44170814e-10] [ 5.76528277e-04 -2.44050733e-04 1.92164495e-03] [ 5.76529106e-04 2.44050251e-04 -1.92164536e-03] [-2.22297812e-04 -4.46439794e-11 -3.91176417e-11] [ 4.09745555e-05 1.96793339e-04 -5.85296078e-04] [ 4.09735948e-05 -1.96792793e-04 5.85295615e-04] [-1.37592234e-04 4.06119996e-04 -5.05986878e-04] [-9.02816527e-05 1.88651562e-03 -5.08824168e-04] [-1.37592119e-04 -4.06120483e-04 5.05986275e-04] [-9.02816852e-05 -1.88651546e-03 5.08823640e-04]] Final stress: [-2.58790054e-06 1.06040645e-05 2.03972682e-05 -7.87994371e-05 -2.84714164e-13 -1.32226033e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.40704407e-04 1.23380261e-03 1.72925985e-06] [ 7.40704416e-04 -1.23380260e-03 -1.72848555e-06] [ 2.22709889e-04 7.48350702e-10 -3.05905603e-10] [-4.08946266e-05 -1.97007086e-04 -5.85571009e-04] [-4.08931108e-05 1.97006226e-04 5.85570305e-04] [-9.24590570e-04 2.15670348e-10 8.99303617e-11] [-5.75987661e-04 2.44883740e-04 1.92208415e-03] [-5.75987312e-04 -2.44883943e-04 -1.92208397e-03] [ 8.98622765e-05 -1.88837938e-03 -5.09437797e-04] [ 1.37255028e-04 -4.06151834e-04 -5.06597469e-04] [ 8.98622676e-05 1.88837936e-03 5.09437103e-04] [ 1.37254996e-04 4.06151942e-04 5.06598130e-04]] Final stress: [-2.58424125e-06 1.05948155e-05 2.04071845e-05 7.88198603e-05 1.22945285e-13 -2.60742960e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.38881988e-03 -2.25019191e-03 6.92082092e-06] [-1.38881988e-03 2.25019191e-03 -6.92068397e-06] [-3.77875915e-04 1.41563154e-10 -7.69132445e-11] [-1.24491260e-04 -3.84224837e-04 9.15248273e-04] [-1.24491310e-04 3.84224865e-04 -9.15248288e-04] [ 2.21749424e-03 4.19504292e-10 1.62836494e-10] [ 5.38709329e-04 -4.42300692e-04 -3.42122629e-03] [ 5.38710496e-04 4.42300014e-04 3.42122682e-03] [ 1.61905239e-04 2.59862915e-03 -2.50692830e-03] [-1.07113135e-04 2.42853913e-04 -2.49571694e-03] [ 1.61905173e-04 -2.59862890e-03 2.50692749e-03] [-1.07113103e-04 -2.42854074e-04 2.49571700e-03]] Final stress: [-5.40650860e-06 -3.72580404e-05 4.48669316e-05 -1.53358090e-04 7.48705386e-14 8.70354361e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.38880624e-03 -2.25008850e-03 -6.92077396e-06] [ 1.38880624e-03 2.25008851e-03 6.92149704e-06] [-2.21716952e-03 3.60610617e-10 -1.65854409e-10] [-5.38699767e-04 4.42016435e-04 -3.42119063e-03] [-5.38699136e-04 -4.42016770e-04 3.42119030e-03] [ 3.77821425e-04 6.64122482e-10 2.51142215e-10] [ 1.24447309e-04 3.84332658e-04 9.15216120e-04] [ 1.24448467e-04 -3.84333304e-04 -9.15215623e-04] [ 1.07205865e-04 -2.42881533e-04 -2.49591969e-03] [-1.62086462e-04 -2.59850583e-03 -2.50713032e-03] [ 1.07205852e-04 2.42881513e-04 2.49591854e-03] [-1.62086519e-04 2.59850580e-03 2.50713048e-03]] Final stress: [-5.41021438e-06 -3.72626916e-05 4.48685245e-05 1.53356231e-04 1.96362955e-13 1.05195638e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.66143678e-11 1.97767845e-03 1.47707994e-10] [ 2.51261739e-11 -4.99157623e-04 4.67877716e-10] [ 5.78777085e-04 -3.03345979e-04 1.44857426e-03] [ 2.99118615e-04 -5.54431111e-04 -5.59027759e-05] [ 2.41817922e-04 -1.09635450e-04 -1.38325677e-03] [-5.78777077e-04 -3.03345969e-04 -1.44857427e-03] [-2.41817841e-04 -1.09635427e-04 1.38325675e-03] [-2.99119828e-04 -5.54430421e-04 5.59022497e-05] [ 1.12752120e-03 -6.14456446e-04 -5.05720326e-04] [ 1.16356143e-03 8.42608077e-04 -5.07883094e-04] [-1.16356081e-03 8.42607850e-04 5.07882905e-04] [-1.12752073e-03 -6.14455952e-04 5.05720457e-04]] Final stress: [-2.98511622e-06 1.09914924e-05 2.03839385e-05 -9.14649711e-13 -7.88048591e-05 -1.53526549e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.49660747e-12 4.99537400e-04 1.02795661e-09] [-8.23244789e-12 -1.97918428e-03 1.35076246e-10] [ 5.79319059e-04 3.02961200e-04 -1.44919388e-03] [ 2.41108889e-04 1.08957172e-04 1.38359760e-03] [ 2.98636127e-04 5.54738923e-04 5.61818784e-05] [-5.79319073e-04 3.02960316e-04 1.44919353e-03] [-2.98635441e-04 5.54739321e-04 -5.61822014e-05] [-2.41109257e-04 1.08957391e-04 -1.38359779e-03] [-1.16585929e-03 -8.43350947e-04 -5.08717685e-04] [-1.12873518e-03 6.16517266e-04 -5.06563936e-04] [ 1.12873501e-03 6.16517358e-04 5.06564199e-04] [ 1.16585917e-03 -8.43351123e-04 5.08717116e-04]] Final stress: [-2.97018456e-06 1.09821447e-05 2.04006355e-05 2.55620864e-13 7.88276439e-05 5.38512020e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.57154837e-11 -8.38950988e-04 -3.87861556e-10] [-2.90306214e-11 3.62182119e-03 -2.45430088e-10] [-1.27726054e-03 6.63015983e-05 2.49559841e-03] [ 6.70939648e-05 -6.80423712e-04 -2.53729199e-03] [-7.13595780e-04 -7.24449537e-04 5.91647627e-07] [ 1.27726051e-03 6.63023019e-05 -2.49559815e-03] [ 7.13595659e-04 -7.24449605e-04 -5.91580072e-07] [-6.70930666e-05 -6.80424246e-04 2.53729243e-03] [ 1.57193100e-03 1.18819907e-03 -2.50959174e-03] [ 1.26607929e-03 -1.24106245e-03 -2.49322583e-03] [-1.26607962e-03 -1.24106263e-03 2.49322569e-03] [-1.57193138e-03 1.18819901e-03 2.50959176e-03]] Final stress: [-6.71801515e-06 -3.59501617e-05 4.48681958e-05 7.76803552e-13 -1.53326311e-04 -2.06513717e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.36871877e-12 -3.62179978e-03 3.16133561e-10] [ 4.57113559e-13 8.38907632e-04 -2.34354287e-10] [-1.27709042e-03 -6.62746386e-05 -2.49558908e-03] [-7.13571790e-04 7.24328960e-04 -6.06227672e-07] [ 6.70046147e-05 6.80397588e-04 2.53729680e-03] [ 1.27709038e-03 -6.62745804e-05 2.49558911e-03] [-6.70047071e-05 6.80397554e-04 -2.53729676e-03] [ 7.13571736e-04 7.24328995e-04 6.06195241e-07] [-1.26609721e-03 1.24116912e-03 -2.49327672e-03] [-1.57207656e-03 -1.18817498e-03 -2.50964191e-03] [ 1.57207663e-03 -1.18817501e-03 2.50964210e-03] [ 1.26609731e-03 1.24116914e-03 2.49327642e-03]] Final stress: [-6.71607395e-06 -3.59476557e-05 4.48701354e-05 -9.27132025e-15 1.53325039e-04 -2.05083094e-13] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.40030260e-04 -1.24011504e-03 1.72427051e-06] [-7.40030266e-04 1.24011504e-03 -1.72407426e-06] [-2.82523498e-04 1.23475587e-10 -6.07706697e-11] [ 6.44901978e-05 1.55408424e-04 5.88805230e-04] [ 6.44901948e-05 -1.55408431e-04 -5.88805251e-04] [ 9.79266044e-04 3.09425564e-10 1.14534503e-10] [ 5.50851104e-04 -2.03614399e-04 -1.91533444e-03] [ 5.50851749e-04 2.03614016e-04 1.91533474e-03] [-9.23392016e-05 1.87755725e-03 -5.09518766e-04] [-1.31343447e-04 4.17406114e-04 -5.06675552e-04] [-9.23392067e-05 -1.87755718e-03 5.09518238e-04] [-1.31343410e-04 -4.17406224e-04 5.06675557e-04]] Final stress: [ 1.09687239e-05 -2.96695384e-06 2.04067922e-05 -7.88615610e-05 -8.08540964e-14 3.78640157e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.40044487e-04 -1.24006537e-03 -1.72512700e-06] [ 7.40044496e-04 1.24006538e-03 1.72585285e-06] [-9.78843136e-04 2.19579422e-10 -1.19905213e-10] [-5.50846920e-04 2.03508221e-04 -1.91529666e-03] [-5.50845766e-04 -2.03508867e-04 1.91529609e-03] [ 2.82435803e-04 7.28615026e-10 2.85798314e-10] [-6.47093858e-05 -1.55620159e-04 5.88900754e-04] [-6.47081118e-05 1.55619436e-04 -5.88900178e-04] [ 1.31603433e-04 -4.17555400e-04 -5.06531729e-04] [ 9.21108936e-05 -1.87772360e-03 -5.09374964e-04] [ 1.31603421e-04 4.17555390e-04 5.06530450e-04] [ 9.21107865e-05 1.87772402e-03 5.09375338e-04]] Final stress: [ 1.09720904e-05 -2.96004746e-06 2.04066304e-05 7.88584817e-05 3.94002583e-13 -8.77675125e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.39099000e-03 2.22851010e-03 -6.94365454e-06] [-1.39099000e-03 -2.22851009e-03 6.94400763e-06] [ 1.59409926e-03 -2.80025287e-11 1.78121340e-11] [ 8.40020768e-04 -9.62533346e-04 3.44373362e-03] [ 8.40021235e-04 9.62533088e-04 -3.44373380e-03] [ 2.62183881e-04 -1.29365481e-10 -6.69344868e-11] [-4.22923297e-04 1.35119672e-04 -9.03457007e-04] [-4.22924185e-04 -1.35119189e-04 9.03456624e-04] [-1.27342509e-04 2.03912148e-04 -2.49579375e-03] [ 1.73093683e-04 2.63476366e-03 -2.50696900e-03] [-1.27342425e-04 -2.03912504e-04 2.49579401e-03] [ 1.73093586e-04 -2.63476338e-03 2.50696901e-03]] Final stress: [-3.59646673e-05 -6.71234777e-06 4.48632410e-05 -1.53216357e-04 1.09602402e-14 -1.27638331e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.39100281e-03 2.22860352e-03 6.94466750e-06] [ 1.39100280e-03 -2.22860350e-03 -6.94365807e-06] [-2.62039807e-04 7.04692175e-10 -3.08353326e-10] [ 4.22932514e-04 -1.35129396e-04 -9.03478639e-04] [ 4.22933964e-04 1.35128583e-04 9.03477938e-04] [-1.59446364e-03 1.03900064e-10 5.39628047e-11] [-8.39984521e-04 9.62695990e-04 3.44376686e-03] [-8.39983829e-04 -9.62696403e-04 -3.44376650e-03] [-1.72941624e-04 -2.63490208e-03 -2.50677030e-03] [ 1.27241530e-04 -2.03890982e-04 -2.49559407e-03] [-1.72941664e-04 2.63490237e-03 2.50676933e-03] [ 1.27241464e-04 2.03891088e-04 2.49559463e-03]] Final stress: [-3.59611930e-05 -6.70978707e-06 4.48611487e-05 1.53217841e-04 3.61607234e-13 5.16798391e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.24980167e-11 -4.92761209e-04 1.20632879e-09] [-3.34328061e-12 1.97260126e-03 3.32858136e-10] [-6.23774431e-04 -2.86578146e-04 1.44325365e-03] [-2.22942186e-04 -1.63425534e-04 -1.39397412e-03] [-2.60183639e-04 -5.16112879e-04 -5.87301869e-05] [ 6.23774431e-04 -2.86578533e-04 -1.44325383e-03] [ 2.60184709e-04 -5.16112274e-04 5.87296948e-05] [ 2.22941397e-04 -1.63425079e-04 1.39397377e-03] [ 1.16898846e-03 8.51856290e-04 -5.07837466e-04] [ 1.12042151e-03 -6.25660055e-04 -5.05646984e-04] [-1.12042157e-03 -6.25660427e-04 5.05647125e-04] [-1.16898867e-03 8.51856588e-04 5.07836818e-04]] Final stress: [ 1.06053370e-05 -2.59371658e-06 2.03842856e-05 2.48051892e-13 -7.88025985e-05 -1.37362021e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.00443950e-11 -1.97009972e-03 -5.06620102e-10] [-3.09853101e-12 4.92048042e-04 -9.54309930e-10] [-6.22824512e-04 2.87390899e-04 -1.44225117e-03] [-2.60522305e-04 5.15131167e-04 5.83341898e-05] [-2.24070985e-04 1.64683693e-04 1.39337019e-03] [ 6.22824506e-04 2.87391187e-04 1.44225130e-03] [ 2.24069959e-04 1.64683102e-04 -1.39336971e-03] [ 2.60523106e-04 5.15130725e-04 -5.83338165e-05] [-1.11839832e-03 6.22428828e-04 -5.04225358e-04] [-1.16577755e-03 -8.50608403e-04 -5.06431873e-04] [ 1.16577757e-03 -8.50608009e-04 5.06432312e-04] [ 1.11839853e-03 6.22428495e-04 5.04225392e-04]] Final stress: [ 1.06234025e-05 -2.61240607e-06 2.03582313e-05 -1.89815249e-13 7.87612241e-05 1.46762208e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.28469974e-11 3.62363575e-03 2.64245432e-10] [ 2.27619939e-11 -8.56747662e-04 3.90513582e-10] [ 6.84579846e-04 -1.09591671e-05 2.51243094e-03] [ 1.07447167e-03 -1.21736081e-03 1.69686749e-05] [ 2.08996133e-04 -1.17856218e-04 -2.48843907e-03] [-6.84579845e-04 -1.09596143e-05 -2.51243111e-03] [-2.08995850e-04 -1.17856075e-04 2.48843897e-03] [-1.07447309e-03 -1.21736000e-03 -1.69692721e-05] [ 1.28541127e-03 -1.18857019e-03 -2.47509721e-03] [ 1.54168944e-03 1.15130197e-03 -2.49155639e-03] [-1.54168883e-03 1.15130183e-03 2.49155642e-03] [-1.28541078e-03 -1.18856982e-03 2.47509739e-03]] Final stress: [-3.71252583e-05 -5.16337938e-06 4.46238616e-05 -8.10011828e-13 -1.52905255e-04 -1.06137670e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.67861582e-13 8.57077010e-04 5.50109512e-10] [-8.47798598e-12 -3.62489259e-03 1.54549059e-10] [ 6.84818777e-04 1.03409606e-05 -2.51294455e-03] [ 2.08404633e-04 1.17317624e-04 2.48883008e-03] [ 1.07464781e-03 1.21804362e-03 -1.68365513e-05] [-6.84818797e-04 1.03395854e-05 2.51294404e-03] [-1.07464708e-03 1.21804405e-03 1.68362302e-05] [-2.08405215e-04 1.17317954e-04 -2.48883034e-03] [-1.54272564e-03 -1.15167155e-03 -2.49320387e-03] [-1.28578817e-03 1.18987748e-03 -2.47676995e-03] [ 1.28578804e-03 1.18987774e-03 2.47677032e-03] [ 1.54272565e-03 -1.15167189e-03 2.49320388e-03]] Final stress: [-3.71382379e-05 -5.18576768e-06 4.46459148e-05 2.27592802e-13 1.52937417e-04 1.24703582e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 2 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.45665053e-03 -2.71220186e-05 -7.12700603e-08] [-2.45665053e-03 2.71220469e-05 7.14501421e-08] [ 7.77330443e-03 7.72424308e-12 1.02336644e-11] [-1.56992822e-03 -3.64359814e-03 3.95690008e-03] [-1.56992819e-03 3.64359813e-03 -3.95690007e-03] [ 5.80312276e-03 -1.02547383e-10 -6.45306001e-11] [-5.34202462e-04 -5.40974529e-03 -3.89643188e-03] [-5.34202710e-04 5.40974539e-03 3.89643180e-03] [-1.14009485e-03 1.81507828e-03 -1.15093504e-03] [-1.08733743e-03 1.92512054e-03 -1.15082713e-03] [-1.14009486e-03 -1.81507830e-03 1.15093504e-03] [-1.08733741e-03 -1.92512055e-03 1.15082707e-03]] Final stress: [ 6.49073596e-05 6.08710929e-05 6.93238375e-05 -2.89941580e-04 -2.10219224e-14 -1.47641523e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.45342437e-03 -2.70599692e-05 7.10307135e-08] [ 2.45342437e-03 2.70599685e-05 -7.11526417e-08] [-5.79219123e-03 2.99356054e-11 -1.82177592e-12] [ 5.34433792e-04 5.39585510e-03 -3.89098477e-03] [ 5.34433931e-04 -5.39585513e-03 3.89098479e-03] [-7.75358295e-03 8.65114856e-11 4.70002670e-11] [ 1.56565795e-03 3.63745830e-03 3.95128076e-03] [ 1.56565814e-03 -3.63745840e-03 -3.95128063e-03] [ 1.08336536e-03 -1.92369371e-03 -1.15038764e-03] [ 1.13600547e-03 -1.81392813e-03 -1.15049515e-03] [ 1.08336535e-03 1.92369370e-03 1.15038749e-03] [ 1.13600545e-03 1.81392815e-03 1.15049523e-03]] Final stress: [ 6.46401409e-05 6.06139102e-05 6.91781143e-05 2.89554487e-04 7.80498030e-14 -1.34967556e-14] Minimization converged after 45 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-9.40433098e-12 2.48374615e-03 -4.08491228e-11] [-1.56579268e-11 2.42950084e-03 -5.29240055e-11] [ 1.03631593e-03 3.66622706e-03 4.53384734e-03] [ 4.03446056e-03 -3.30744150e-03 -2.29739574e-03] [-5.02013914e-03 -5.04247328e-03 -2.23692425e-03] [-1.03631590e-03 3.66622704e-03 -4.53384732e-03] [ 5.02013917e-03 -5.04247332e-03 2.23692431e-03] [-4.03446060e-03 -3.30744146e-03 2.29739583e-03] [ 1.89623622e-03 1.16855420e-03 -1.15080209e-03] [ 1.84347616e-03 1.05851004e-03 -1.15044213e-03] [-1.84347619e-03 1.05851002e-03 1.15044205e-03] [-1.89623619e-03 1.16855420e-03 1.15080210e-03]] Final stress: [ 6.08571463e-05 6.48935571e-05 6.93129531e-05 1.52191134e-14 -2.89950980e-04 -1.75018842e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.94131180e-12 -2.42953062e-03 7.10387436e-11] [ 5.12385236e-13 -2.48377544e-03 8.27956581e-11] [ 1.03643167e-03 -3.66570456e-03 -4.53397594e-03] [-5.01986332e-03 5.04251668e-03 2.23698911e-03] [ 4.03406764e-03 3.30728443e-03 2.29745962e-03] [-1.03643167e-03 -3.66570473e-03 4.53397593e-03] [-4.03406751e-03 3.30728451e-03 -2.29745967e-03] [ 5.01986324e-03 5.04251673e-03 -2.23698912e-03] [-1.84370235e-03 -1.05870031e-03 -1.15046515e-03] [-1.89646102e-03 -1.16874318e-03 -1.15082516e-03] [ 1.89646100e-03 -1.16874315e-03 1.15082508e-03] [ 1.84370232e-03 -1.05870035e-03 1.15046514e-03]] Final stress: [6.08639873e-05 6.49003428e-05 6.93164557e-05 7.77276999e-14 2.89946045e-04 1.63192458e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 47 steps. Minimization converged after 45 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.22761219e-04 6.26913044e-04 3.91734517e-09] [-6.31064882e-04 6.26913045e-04 -4.25884244e-09] [ 1.68393611e-03 7.28420322e-04 1.24641418e-03] [ 7.45948691e-04 -1.83262669e-03 4.59520819e-04] [-1.22092033e-03 -1.17275451e-04 -1.70591494e-03] [ 1.39335141e-03 7.36919136e-04 -1.25402873e-03] [ 8.91373446e-04 -2.07601224e-03 -4.55713282e-04] [-1.07576075e-03 1.42646674e-04 1.70972230e-03] [ 4.52293597e-04 1.02022182e-03 6.08662318e-04] [ 4.36681068e-04 1.03285520e-03 6.08641623e-04] [-1.03434465e-03 -4.50804093e-04 -6.08646450e-04] [-1.01873248e-03 -4.38170764e-04 -6.08657500e-04]] Final stress: [ 1.68903631e-05 1.68903646e-05 6.74644595e-06 -7.61089007e-05 -7.61089010e-05 -3.24646597e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.31100061e-04 -6.26947834e-04 4.09872786e-09] [-6.22795620e-04 -6.26947837e-04 -3.57447919e-09] [ 1.68379902e-03 -7.28422780e-04 -1.24645202e-03] [-1.22086638e-03 1.17175208e-04 1.70596690e-03] [ 7.45973842e-04 1.83267194e-03 -4.59535028e-04] [ 1.39341607e-03 -7.36921004e-04 1.25406753e-03] [-1.07580682e-03 -1.42572492e-04 -1.70977487e-03] [ 8.91297399e-04 2.07588212e-03 4.55727121e-04] [-1.03430980e-03 4.50860886e-04 6.08244448e-04] [-1.01869576e-03 4.38227307e-04 6.08255313e-04] [ 4.52350988e-04 -1.02018601e-03 -6.08260454e-04] [ 4.36737117e-04 -1.03281950e-03 -6.08239470e-04]] Final stress: [ 1.68830211e-05 1.68830204e-05 6.75021731e-06 -7.61119386e-05 7.61119387e-05 3.24669332e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.22851701e-04 6.27004572e-04 -3.84792136e-09] [ 6.31157446e-04 6.27004564e-04 3.98608837e-09] [-1.39352675e-03 7.36986545e-04 1.25411095e-03] [ 1.07595963e-03 1.42486793e-04 -1.70983367e-03] [-8.91144923e-04 -2.07566694e-03 4.55742302e-04] [-1.68356043e-03 7.28489325e-04 -1.24649381e-03] [ 1.22084558e-03 -1.16959228e-04 1.70602491e-03] [-7.45996906e-04 -1.83276009e-03 -4.59550941e-04] [ 1.01860416e-03 -4.38388333e-04 6.07668357e-04] [ 1.03422094e-03 -4.51022241e-04 6.07657688e-04] [-4.36896977e-04 1.03272941e-03 -6.07652627e-04] [-4.52513476e-04 1.02009562e-03 -6.07673302e-04]] Final stress: [ 1.68706794e-05 1.68706783e-05 6.75497644e-06 7.61169994e-05 -7.61169996e-05 3.24706952e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.31064222e-04 -6.26912389e-04 -4.04100449e-09] [ 6.22760576e-04 -6.26912389e-04 4.17310397e-09] [-1.39334997e-03 -7.36917163e-04 -1.25402861e-03] [-8.91375954e-04 2.07601460e-03 -4.55713349e-04] [ 1.07575746e-03 -1.42646991e-04 1.70972212e-03] [-1.68393911e-03 -7.28418464e-04 1.24641402e-03] [-7.45948377e-04 1.83262553e-03 4.59520619e-04] [ 1.22091904e-03 1.17279074e-04 -1.70591486e-03] [-4.36678052e-04 -1.03285692e-03 6.08647026e-04] [-4.52290320e-04 -1.02022345e-03 6.08667600e-04] [ 1.01873409e-03 4.38167514e-04 -6.08662827e-04] [ 1.03434639e-03 4.50801049e-04 -6.08651878e-04]] Final stress: [ 1.68905136e-05 1.68905136e-05 6.74641951e-06 7.61088393e-05 7.61088396e-05 -3.24646823e-07] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.01739683e-03 -2.31633741e-05 -9.20377873e-08] [-4.12386667e-03 1.96791272e-05 8.88917741e-09] [ 1.03782721e-03 -9.34635996e-04 3.10680580e-03] [-1.18291859e-03 -5.40419785e-04 4.48658312e-05] [-5.56849386e-04 -1.87479999e-04 -3.14462798e-03] [ 2.11433329e-05 8.99055091e-04 3.11871617e-03] [-1.57855643e-05 -7.49729144e-04 -3.12189589e-03] [-6.48799373e-04 1.50841011e-03 -3.80228134e-06] [ 2.74835164e-03 1.60093519e-03 1.73316031e-03] [-1.52287775e-03 -2.36408723e-03 1.65506375e-03] [-1.54671462e-03 2.45421092e-03 -1.65499585e-03] [ 2.77309293e-03 -1.68277490e-03 -1.73320670e-03]] Final stress: [ 4.50279080e-05 4.23705605e-05 2.98632025e-06 -2.46034119e-04 -1.46302561e-07 -7.69318730e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-4.12369778e-03 -1.96772573e-05 -8.36048300e-09] [ 3.01727308e-03 2.31612016e-05 9.16535000e-08] [ 1.03784519e-03 9.34500961e-04 -3.10663033e-03] [-5.56919629e-04 1.87531360e-04 3.14446648e-03] [-1.18283524e-03 5.40358160e-04 -4.48815277e-05] [ 2.10835695e-05 -8.98919876e-04 -3.11853806e-03] [-6.48684154e-04 -1.50841018e-03 3.78406697e-06] [-1.58190094e-05 7.49739023e-04 3.12173716e-03] [-1.54657844e-03 -2.45408528e-03 1.65493111e-03] [ 2.77290750e-03 1.68274824e-03 1.73313729e-03] [ 2.74817035e-03 -1.60091601e-03 -1.73309027e-03] [-1.52274544e-03 2.36396966e-03 -1.65499921e-03]] Final stress: [ 4.50296988e-05 4.23726185e-05 2.98806343e-06 -2.46022090e-04 1.46290091e-07 7.69269746e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 4.12290222e-03 -1.96692795e-05 9.10421890e-09] [-3.01676114e-03 2.31517256e-05 -9.02241164e-08] [-2.12641355e-05 -8.98504688e-04 3.11782842e-03] [ 1.61596627e-05 7.49469750e-04 -3.12103693e-03] [ 6.48432178e-04 -1.50836408e-03 -3.78312972e-06] [-1.03771479e-03 9.34089579e-04 3.10593303e-03] [ 1.18239871e-03 5.40606074e-04 4.48725703e-05] [ 5.57096052e-04 1.87505040e-04 -3.14375372e-03] [ 1.52251283e-03 2.36349950e-03 1.65465651e-03] [-2.74768565e-03 -1.60035859e-03 1.73272648e-03] [-2.77240559e-03 1.68215694e-03 -1.73277386e-03] [ 1.54632966e-03 -2.45358196e-03 -1.65458825e-03]] Final stress: [ 4.50180468e-05 4.23621080e-05 2.98758591e-06 2.45972771e-04 1.46237012e-07 -7.69104903e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.01735986e-03 -2.31535298e-05 9.12884385e-08] [ 4.12366171e-03 1.96722981e-05 -8.68854167e-09] [-2.13685233e-05 8.97593875e-04 -3.11763441e-03] [ 6.49823488e-04 1.50865894e-03 4.20614386e-06] [ 1.80898389e-05 -7.50323962e-04 3.12048371e-03] [-1.03730120e-03 -9.33313736e-04 -3.10579227e-03] [ 5.58791314e-04 -1.86193264e-04 3.14319136e-03] [ 1.18338831e-03 -5.41255907e-04 -4.45155348e-05] [-2.77224042e-03 -1.68342799e-03 1.73035169e-03] [ 1.54293365e-03 2.45398293e-03 1.65208696e-03] [ 1.51916775e-03 -2.36386547e-03 -1.65215521e-03] [-2.74758606e-03 1.60162581e-03 -1.73030504e-03]] Final stress: [ 4.49943013e-05 4.23387292e-05 3.02076533e-06 2.45980429e-04 -1.46213050e-07 7.68915331e-05] Minimization converged after 40 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.57414181e-03 5.77477943e-04 -4.77023580e-05] [-3.57065358e-03 5.29683401e-04 4.77846108e-05] [ 5.55440858e-04 6.08672162e-05 4.93639846e-03] [ 8.77198722e-05 -5.74874836e-05 -2.49072713e-03] [-5.88113562e-04 -9.90989822e-04 -2.44600732e-03] [-5.61467814e-04 1.89601208e-03 1.29279870e-03] [ 1.22392024e-03 -2.28379963e-04 -6.54232895e-04] [-7.12700671e-04 6.66368048e-04 -6.38275800e-04] [ 1.78857266e-03 1.45337250e-03 1.72064324e-03] [-2.56039828e-03 -2.68060151e-03 1.66859212e-03] [-1.74204930e-03 1.37371901e-03 -1.72089880e-03] [ 2.50558777e-03 -2.60004141e-03 -1.66837282e-03]] Final stress: [ 4.22707368e-05 4.51670402e-05 2.99076380e-06 -1.46467144e-07 -2.46178383e-04 -7.69790164e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.57461554e-03 5.77586337e-04 4.77141981e-05] [ 3.57112617e-03 5.29777203e-04 -4.78006401e-05] [ 5.61616351e-04 1.89626437e-03 -1.29298274e-03] [ 7.12826982e-04 6.66409318e-04 6.38366548e-04] [-1.22417988e-03 -2.28572561e-04 6.54328624e-04] [-5.55587548e-04 6.06503570e-05 -4.93720449e-03] [ 5.88014178e-04 -9.91039578e-04 2.44640294e-03] [-8.74861279e-05 -5.72952692e-05 2.49113789e-03] [-2.50593861e-03 -2.60050064e-03 1.66856996e-03] [ 1.74237229e-03 1.37406444e-03 1.72111011e-03] [ 2.56076146e-03 -2.68108630e-03 -1.66878734e-03] [-1.78890972e-03 1.45374233e-03 -1.72085506e-03]] Final stress: [ 4.22793390e-05 4.51765049e-05 2.99253204e-06 1.46509561e-07 -2.46215210e-04 7.69913346e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 3.57095211e-03 -5.29749869e-04 4.77914372e-05] [-3.57444097e-03 -5.77552903e-04 -4.77099710e-05] [ 5.61602197e-04 -1.89616895e-03 1.29290724e-03] [-1.22409890e-03 2.28533637e-04 -6.54288558e-04] [ 7.12753909e-04 -6.66433471e-04 -6.38328520e-04] [-5.55574093e-04 -6.07931676e-05 4.93685559e-03] [-8.75495987e-05 5.72606335e-05 -2.49095934e-03] [ 5.88068484e-04 9.90987301e-04 -2.44623149e-03] [ 2.56039457e-03 2.68099201e-03 1.66868589e-03] [-1.78871395e-03 -1.45358029e-03 1.72074549e-03] [-2.50557605e-03 2.60041756e-03 -1.66846713e-03] [ 1.74218229e-03 -1.37391250e-03 -1.72100064e-03]] Final stress: [ 4.22785143e-05 4.51753222e-05 2.99347326e-06 1.46489430e-07 2.46199249e-04 -7.69847609e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-3.56868161e-03 -5.29193562e-04 -4.77145315e-05] [ 3.57215941e-03 -5.76887986e-04 4.76316043e-05] [ 5.54123817e-04 -6.85247110e-05 -4.92907132e-03] [-5.91063412e-04 9.88540624e-04 2.44242166e-03] [ 9.20119876e-05 5.71639036e-05 2.48698421e-03] [-5.60142011e-04 -1.89599987e-03 -1.29208066e-03] [-7.12719462e-04 -6.66367373e-04 6.37942858e-04] [ 1.22266719e-03 2.26264082e-04 6.53849174e-04] [-1.73703231e-03 -1.36994063e-03 1.71403841e-03] [ 2.49852603e-03 2.60200832e-03 1.66159961e-03] [ 1.78350852e-03 -1.44942510e-03 -1.71378375e-03] [-2.55335815e-03 2.68236230e-03 -1.66181726e-03]] Final stress: [ 4.21746950e-05 4.50657661e-05 3.05845130e-06 -1.46127816e-07 2.45931393e-04 7.68488671e-05] Minimization converged after 5 steps. Minimization converged after 5 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ -1.14993 0.18798 0.2954 -0. -0. 0.00073] [ 0.18798 -0.0179 0.29869 0. -0. 0. ] [ 0.2954 0.29869 2.25773 0. -0. 0.00008] [ -0. 0. 0. -2.79928 -0. 0. ] [ -0. -0. -0. -0. -5.73386 0. ] [ 0.00073 0. 0.00008 0. 0. -11.79966]] 95%% Error estimate [ASE units]: [[ 255.9724 440.37008 268.15015 0. 0. 0.00988] [ 440.37008 247.99362 0.05239 0. 0. 0. ] [ 268.15015 0.05239 0. 0.00323 0. 0.01214] [ 0. 0. 0.00323 5700.28581 0.00007 0. ] [ 0. 0. 0. 0.00007 5454.17318 0. ] [ 0.00988 0. 0.01214 0. 0. 1763.35828]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 2850.142906 is too big compared to maximum elastic constant component 11.799656 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 11.130703 WARNING: Maximum deviation from material symmetry according to space group 182 is too big compared to maximum elastic constant component 11.799656 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method energy-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. Minimization converged after 21 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 22 steps. Minimization converged after 20 steps. Minimization converged after 5 steps. Minimization converged after 15 steps. Minimization converged after 24 steps. Minimization converged after 18 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 8.75075012e-12 -1.49170315e-01 1.81310966e-10] [-3.15523940e-10 1.49170315e-01 -8.59417737e-09] [ 5.04855304e-02 -1.35621836e-09 6.64366284e-10] [ 4.49306773e-03 -5.35569176e-03 7.01521440e-02] [ 4.49306452e-03 5.35569357e-03 -7.01521423e-02] [-5.04855305e-02 5.60038460e-10 3.02606273e-10] [-4.49306638e-03 5.35569248e-03 7.01521434e-02] [-4.49306563e-03 -5.35569289e-03 -7.01521429e-02] [-3.94645446e-02 -1.50736591e-02 4.36696454e-02] [ 3.94645445e-02 1.50736589e-02 4.36696487e-02] [-3.94645445e-02 1.50736590e-02 -4.36696419e-02] [ 3.94645446e-02 -1.50736594e-02 -4.36696468e-02]] Final stress: [-8.59311171e-03 -5.58649580e-03 -2.51083068e-02 7.21147341e-13 -1.73085696e-14 3.77651892e-13] Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 16 steps. Minimization converged after 23 steps. Minimization converged after 16 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.74023018e-11 1.36548537e-01 1.93478344e-10] [ 4.18262543e-10 -1.36548537e-01 -1.07696137e-08] [-5.88349076e-02 -3.19157811e-10 2.24718910e-10] [-3.02530515e-02 5.40982961e-02 -8.61108932e-02] [-3.02530531e-02 -5.40982952e-02 8.61108941e-02] [ 5.88349076e-02 1.94991018e-09 8.80509450e-10] [ 3.02530504e-02 -5.40982968e-02 -8.61108927e-02] [ 3.02530528e-02 5.40982953e-02 8.61108941e-02] [ 3.90552403e-02 1.40534041e-03 -8.06619629e-05] [-3.90552400e-02 -1.40534113e-03 -8.06562125e-05] [ 3.90552404e-02 -1.40534092e-03 8.06649075e-05] [-3.90552398e-02 1.40534060e-03 8.06604016e-05]] Final stress: [-3.90639600e-03 -9.04911621e-03 -2.35328235e-02 -1.79011281e-12 -7.12549928e-13 4.88274062e-13] Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 47 steps. Minimization converged after 47 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 5 steps. Minimization converged after 9 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 0.14049426 -0.04338096 -0.1147837 ] [-0.14049426 0.04338096 -0.1147837 ] [-0.03653169 0.10580556 -0.08668036] [-0.06056209 0.03148354 0.02652854] [ 0.09671792 -0.04123853 -0.01557246] [ 0.03653169 -0.10580556 -0.08668036] [ 0.06056209 -0.03148354 0.02652854] [-0.09671792 0.04123853 -0.01557246] [ 0.09116554 -0.01516022 0.16665241] [-0.09116554 0.01516022 0.16665241] [-0.14497129 -0.1137843 0.02385557] [ 0.14497129 0.1137843 0.02385557]] Final stress: [-3.36348760e-03 -9.14565576e-04 -1.85901945e-02 -5.14799776e-14 -5.92098816e-14 4.93327769e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.14049427 -0.04338095 0.11478399] [ 0.14049427 0.04338095 0.11478399] [-0.03653169 -0.10580542 0.0866803 ] [ 0.09671792 0.04123851 0.01557245] [-0.06056192 -0.03148369 -0.02652863] [ 0.03653169 0.10580542 0.0866803 ] [-0.09671792 -0.04123851 0.01557245] [ 0.06056192 0.03148369 -0.02652863] [-0.14497127 0.11378426 -0.02385554] [ 0.14497127 -0.11378426 -0.02385554] [ 0.09116566 0.01516023 -0.16665257] [-0.09116566 -0.01516023 -0.16665257]] Final stress: [-3.36348778e-03 -9.14563850e-04 -1.85901944e-02 9.75238698e-15 -3.78566567e-14 -4.93327680e-03] Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 54 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 19 steps. Minimization converged after 23 steps. Minimization converged after 5 steps. Minimization converged after 18 steps. Minimization converged after 20 steps. Minimization converged after 4 steps. Minimization converged after 16 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.20950758e-11 -7.37513019e-02 1.25458866e-10] [-5.23278643e-11 7.37513019e-02 -1.39749387e-09] [ 2.14984191e-02 -1.51701873e-10 1.02806208e-10] [ 2.38889036e-03 -9.17241773e-03 3.79813322e-02] [ 2.38888997e-03 9.17241795e-03 -3.79813319e-02] [-2.14984192e-02 -9.38237710e-10 -3.53151161e-10] [-2.38888901e-03 9.17241851e-03 3.79813315e-02] [-2.38889011e-03 -9.17241787e-03 -3.79813320e-02] [-2.25827165e-02 -1.58306860e-02 2.22935138e-02] [ 2.25827160e-02 1.58306862e-02 2.22935139e-02] [-2.25827166e-02 1.58306863e-02 -2.22935123e-02] [ 2.25827160e-02 -1.58306863e-02 -2.22935136e-02]] Final stress: [-5.93558025e-03 -3.53240475e-03 -1.61231922e-02 1.15633222e-12 3.64645792e-13 7.44129422e-13] Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 46 steps. Minimization converged after 46 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 20 steps. Minimization converged after 23 steps. Minimization converged after 18 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-9.20441945e-10 -1.12241562e-01 -6.85640100e-09] [-1.35742535e-10 1.12241563e-01 -2.95659227e-09] [ 1.04556165e-01 -1.55838280e-08 5.96233524e-09] [-3.50854427e-02 1.08508288e-01 1.46985201e-02] [-3.50854623e-02 -1.08508276e-01 -1.46985114e-02] [-1.04556165e-01 -1.21142313e-08 -4.90281386e-09] [ 3.50854515e-02 -1.08508282e-01 1.46985159e-02] [ 3.50854802e-02 1.08508266e-01 -1.46985039e-02] [ 3.63149707e-02 -3.27081410e-02 -6.05911189e-02] [-3.63149794e-02 3.27081600e-02 -6.05911254e-02] [ 3.63149642e-02 3.27081686e-02 6.05911168e-02] [-3.63149808e-02 -3.27081561e-02 6.05911156e-02]] Final stress: [1.20379063e-02 4.44144484e-03 2.84669386e-02 1.38171538e-11 3.22287375e-11 5.37169959e-11] Minimization converged after 24 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 55 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 20 steps. Minimization converged after 23 steps. Minimization converged after 4 steps. Minimization converged after 20 steps. Minimization converged after 22 steps. Minimization converged after 4 steps. Minimization converged after 17 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.45773418e-10 2.26802762e-02 3.84072663e-09] [ 1.34426189e-08 -2.26802781e-02 -1.24612237e-07] [-1.16418368e-01 -3.41943407e-09 2.21396834e-09] [-1.95704428e-01 -2.15015057e-02 -6.60955803e-02] [-1.95704503e-01 2.15015508e-02 6.60956147e-02] [ 1.16418366e-01 4.80580207e-08 1.92766760e-08] [ 1.95704445e-01 2.15015155e-02 -6.60955890e-02] [ 1.95704489e-01 -2.15015431e-02 6.60956106e-02] [-2.19760904e-01 -1.62284819e-01 -2.09645424e-01] [ 2.19760890e-01 1.62284790e-01 -2.09645361e-01] [-2.19760900e-01 1.62284798e-01 2.09645443e-01] [ 2.19760899e-01 -1.62284829e-01 2.09645385e-01]] Final stress: [ 1.18256207e-02 -4.44789862e-04 1.67864865e-02 -2.72961145e-11 -6.57199564e-11 5.25763052e-11] Minimization converged after 22 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.31652134e-10 -9.81894780e-02 -2.90362856e-09] [ 1.34201539e-11 9.81894781e-02 -4.25129071e-10] [ 3.22479800e-02 -1.89736338e-10 1.20689791e-10] [-1.21509254e-02 -7.35532232e-04 6.51669010e-02] [-1.21509250e-02 7.35532026e-04 -6.51669011e-02] [-3.22479800e-02 -8.94678776e-10 -2.87040176e-10] [ 1.21509236e-02 7.35531222e-04 6.51669018e-02] [ 1.21509246e-02 -7.35531747e-04 -6.51669013e-02] [-4.51190268e-02 -4.81982451e-02 1.78340184e-02] [ 4.51190281e-02 4.81982457e-02 1.78340173e-02] [-4.51190271e-02 4.81982465e-02 -1.78340170e-02] [ 4.51190279e-02 -4.81982454e-02 -1.78340157e-02]] Final stress: [-1.01836234e-03 -3.08915346e-03 -8.83684632e-03 -2.25633670e-12 1.30526974e-12 1.96726712e-12] Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 25 steps. Minimization converged after 21 steps. Minimization converged after 18 steps. Minimization converged after 23 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.08156993 -0.01183069 0.02781374] [-0.08156993 0.01183069 0.02781374] [-0.02961294 -0.06315142 -0.02637246] [ 0.07902669 0.03613785 0.05628323] [-0.04334076 0.06052513 0.04347627] [ 0.02961294 0.06315142 -0.02637246] [-0.07902669 -0.03613785 0.05628323] [ 0.04334076 -0.06052513 0.04347627] [ 0.04679511 0.00100339 -0.02202809] [-0.04679511 -0.00100339 -0.02202809] [-0.04866351 -0.05457013 -0.07917269] [ 0.04866351 0.05457013 -0.07917269]] Final stress: [-2.86606212e-03 -1.83383789e-03 -8.59213129e-03 3.56845673e-14 4.02672239e-15 1.24357602e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.08156984 -0.01183068 -0.02781348] [ 0.08156984 0.01183068 -0.02781348] [-0.02961312 0.063152 0.02637192] [-0.04334042 -0.06052574 -0.04347612] [ 0.0790267 -0.03613809 -0.05628312] [ 0.02961312 -0.063152 0.02637192] [ 0.04334042 0.06052574 -0.04347612] [-0.0790267 0.03613809 -0.05628312] [-0.04866329 0.05456971 0.07917267] [ 0.04866329 -0.05456971 0.07917267] [ 0.04679505 -0.00100377 0.02202812] [-0.04679505 0.00100377 0.02202812]] Final stress: [-2.86607539e-03 -1.83384989e-03 -8.59213603e-03 -2.97276901e-14 -2.17658609e-14 -1.24357438e-03] Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 61 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 3 steps. Minimization converged after 18 steps. Minimization converged after 21 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.49263046e-10 9.09997011e-03 -2.48965426e-09] [ 3.41803169e-10 -9.09997009e-03 -9.23339082e-09] [ 2.84074233e-03 -3.97531297e-09 1.63803568e-09] [-1.97951345e-02 3.54045048e-02 -1.48911594e-03] [-1.97951441e-02 -3.54044992e-02 1.48912045e-03] [-2.84074241e-03 3.87609389e-10 1.82668422e-10] [ 1.97951375e-02 -3.54045030e-02 -1.48911742e-03] [ 1.97951434e-02 3.54044996e-02 1.48912007e-03] [ 5.42544805e-03 -1.67924262e-02 -2.19828054e-02] [-5.42544906e-03 1.67924272e-02 -2.19828040e-02] [ 5.42544732e-03 1.67924291e-02 2.19828085e-02] [-5.42544872e-03 -1.67924287e-02 2.19828037e-02]] Final stress: [ 4.22235177e-03 3.81421227e-03 1.05114992e-02 6.86155865e-13 -4.83235635e-14 9.81674915e-12] Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 25 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 27 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.06010283 0.06319321 0.10831583] [ 0.06010283 -0.06319321 0.10831583] [ 0.15853031 -0.09975518 0.03296369] [ 0.0713136 0.07101023 -0.01695026] [-0.14186792 0.07188627 0.04637671] [-0.15853031 0.09975518 0.03296369] [-0.0713136 -0.07101023 -0.01695026] [ 0.14186792 -0.07188627 0.04637671] [ 0.03837731 -0.00394729 -0.20433346] [-0.03837731 0.00394729 -0.20433346] [ 0.04571596 0.00961056 0.0336275 ] [-0.04571596 -0.00961056 0.0336275 ]] Final stress: [ 3.86828834e-03 1.04241971e-02 2.31569479e-02 -1.94716602e-13 3.77461796e-13 2.54158069e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.06010333 0.06319295 -0.10831629] [-0.06010333 -0.06319295 -0.10831629] [ 0.15852783 0.09975433 -0.03296506] [-0.14186681 -0.07188738 -0.04637602] [ 0.07131442 -0.07100901 0.0169508 ] [-0.15852783 -0.09975433 -0.03296506] [ 0.14186681 0.07188738 -0.04637602] [-0.07131442 0.07100901 0.0169508 ] [ 0.0457156 -0.00961153 -0.03362589] [-0.0457156 0.00961153 -0.03362589] [ 0.03837686 0.00394805 0.20433247] [-0.03837686 -0.00394805 0.20433247]] Final stress: [ 3.86819213e-03 1.04240305e-02 2.31567717e-02 4.48909747e-14 4.97411567e-13 -2.54164557e-04] Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-6.20528316e-03 -2.73990340e-03 8.26182103e-03] [-2.03839942e-02 -4.66640867e-03 -7.79754410e-03] [-1.15556398e-02 -8.59651312e-03 1.82768132e-03] [-2.28082220e-02 3.04965406e-03 -1.40090612e-02] [-1.15976448e-02 -8.61388345e-03 1.94457558e-02] [ 1.31953012e-03 -7.75499597e-03 8.30810491e-03] [ 2.05342066e-02 1.06452593e-02 -3.57703548e-02] [ 4.80463687e-05 9.87627928e-04 5.50453026e-03] [-1.55766700e-02 2.26126045e-02 6.90893049e-03] [ 3.32151602e-02 8.41523074e-03 -1.15007400e-02] [ 1.76167464e-02 -1.92357495e-02 4.57234591e-02] [ 1.53937644e-02 5.89707753e-03 -2.69025829e-02]] Final stress: [ 0.00100223 0.0081587 0.03195506 -0.00501119 -0.00392313 -0.00317195] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[-2.03927184e-02 4.66733012e-03 7.78482899e-03] [-6.20768933e-03 2.74315509e-03 -8.27397307e-03] [-1.15629995e-02 8.58182154e-03 -1.82121558e-03] [-1.15820221e-02 8.61781212e-03 -1.94412633e-02] [-2.28293738e-02 -3.04739094e-03 1.40138685e-02] [ 1.31513951e-03 7.75886463e-03 -8.30187856e-03] [ 4.52292521e-05 -9.83384160e-04 -5.49579950e-03] [ 2.05314494e-02 -1.06375844e-02 3.57790456e-02] [ 1.76316010e-02 1.92302363e-02 -4.57572706e-02] [ 1.53941720e-02 -5.88759398e-03 2.68976945e-02] [-1.55772869e-02 -2.26249540e-02 -6.88628198e-03] [ 3.32344989e-02 -8.41831227e-03 1.15022449e-02]] Final stress: [ 0.00100227 0.0081588 0.03195543 -0.00501099 0.00392306 0.00317193] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 6.21610433e-03 -2.73928595e-03 -8.24409580e-03] [ 2.03860045e-02 -4.67430646e-03 7.76385470e-03] [-1.31499021e-03 -7.74126223e-03 -8.29768126e-03] [-2.72658446e-05 9.81204025e-04 -5.49740466e-03] [-2.05661969e-02 1.06465254e-02 3.58141557e-02] [ 1.15676896e-02 -8.60969531e-03 -1.82919984e-03] [ 1.15953483e-02 -8.61130389e-03 -1.94589064e-02] [ 2.28071963e-02 3.07670004e-03 1.40218068e-02] [-1.53885115e-02 5.88363095e-03 2.68762417e-02] [-1.76309634e-02 -1.92384517e-02 -4.57685225e-02] [-3.32201874e-02 8.41180409e-03 1.15250678e-02] [ 1.55757722e-02 2.26144411e-02 -6.90531626e-03]] Final stress: [ 0.00100235 0.00815892 0.03195563 0.00501079 -0.00392308 0.00317209] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 52 steps. Final forces: [[ 2.03914856e-02 4.66137646e-03 -7.79247017e-03] [ 6.20439708e-03 2.74290263e-03 8.27329624e-03] [-1.32250317e-03 7.75838420e-03 8.30179335e-03] [-2.05219799e-02 -1.06340616e-02 -3.57809838e-02] [-5.29342532e-05 -9.89607551e-04 5.50126895e-03] [ 1.15724354e-02 8.58161250e-03 1.82793443e-03] [ 2.28234814e-02 -3.05053311e-03 -1.40199580e-02] [ 1.15889973e-02 8.62225355e-03 1.94531212e-02] [-3.32417791e-02 -8.42047557e-03 -1.15109653e-02] [ 1.55783852e-02 -2.26204998e-02 6.87205239e-03] [-1.53855749e-02 -5.88485428e-03 -2.68894213e-02] [-1.76344105e-02 1.92335026e-02 4.57643320e-02]] Final stress: [ 0.00100229 0.00815877 0.03195561 0.00501093 0.00392298 -0.00317189] Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 56 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 4 steps. Minimization converged after 20 steps. Minimization converged after 20 steps. Minimization converged after 3 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 26 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 26 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 58 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 3 steps. Minimization converged after 20 steps. Minimization converged after 21 steps. Minimization converged after 3 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 27 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 27 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 25 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.09607934 0.07064476 -0.1199963 ] [-0.09607934 -0.07064476 -0.1199963 ] [ 0.18399254 -0.18164431 -0.08499273] [ 0.19404231 0.19183282 0.11396883] [-0.23538606 0.16020129 0.16580267] [-0.18399254 0.18164431 -0.08499273] [-0.19404231 -0.19183282 0.11396883] [ 0.23538605 -0.16020128 0.16580267] [-0.02380676 0.05951334 -0.09563282] [ 0.02380676 -0.05951334 -0.09563282] [ 0.12543388 -0.11542022 0.02085035] [-0.12543388 0.11542022 0.02085034]] Final stress: [ 2.22602467e-03 1.13252259e-02 1.59735388e-02 3.20467685e-12 -3.32139802e-13 -1.19475802e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.09607808 0.07064427 0.11999528] [ 0.09607808 -0.07064427 0.11999526] [ 0.18399308 0.18164063 0.08499964] [-0.23538266 -0.16019876 -0.16580322] [ 0.19404721 -0.19183532 -0.1139742 ] [-0.18399308 -0.18164063 0.08499964] [ 0.23538266 0.16019876 -0.16580322] [-0.19404721 0.19183532 -0.1139742 ] [ 0.12545014 0.11542185 -0.02086631] [-0.12545014 -0.11542186 -0.02086631] [-0.02381428 -0.05951027 0.09564882] [ 0.02381428 0.05951027 0.09564881]] Final stress: [2.22596309e-03 1.13251750e-02 1.59737150e-02 3.12771756e-13 1.71764749e-12 1.19458638e-03] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 58 steps. Minimization converged after 59 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 59 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. Minimization converged after 3 steps. Minimization converged after 19 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 3.39252237e-11 -4.80366495e-03 1.46065909e-08] [-2.32634245e-09 4.80366480e-03 -1.18385746e-07] [ 1.82718269e-02 1.40113322e-08 -5.04667128e-09] [ 5.34436703e-03 2.56878157e-02 2.19003755e-03] [ 5.34436653e-03 -2.56878158e-02 -2.19003685e-03] [-1.82718272e-02 3.24163403e-08 1.43237854e-08] [-5.34440284e-03 -2.56878370e-02 2.19005547e-03] [-5.34432777e-03 2.56877940e-02 -2.19001853e-03] [ 1.22255220e-02 2.62877060e-03 8.14119487e-02] [-1.22255222e-02 -2.62877204e-03 8.14120407e-02] [ 1.22255195e-02 -2.62876001e-03 -8.14119496e-02] [-1.22255196e-02 2.62875820e-03 -8.14119829e-02]] Final stress: [ 1.64028914e-03 1.31056486e-03 -3.29539973e-04 8.25924948e-12 -1.01842532e-11 4.86631318e-11] Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.41844167e-09 8.68323431e-02 -3.85266785e-08] [-3.15093853e-09 -8.68323430e-02 4.95789437e-08] [-1.05074068e-02 7.24591498e-10 -3.87677113e-10] [-4.69297879e-02 1.58779990e-01 -1.07831927e-03] [-4.69297812e-02 -1.58779994e-01 1.07831607e-03] [ 1.05074075e-02 -2.34331402e-09 -1.02564088e-09] [ 4.69297899e-02 -1.58779989e-01 -1.07831938e-03] [ 4.69297860e-02 1.58779991e-01 1.07831739e-03] [-1.78333461e-02 -1.22478481e-01 -2.86063574e-02] [ 1.78333455e-02 1.22478484e-01 -2.86063990e-02] [-1.78333460e-02 1.22478481e-01 2.86063550e-02] [ 1.78333446e-02 -1.22478481e-01 2.86063970e-02]] Final stress: [ 7.46945752e-03 8.27051782e-03 1.21131986e-02 1.65637072e-11 3.83450528e-12 -6.51502275e-12] Minimization converged after 22 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 26 steps. Minimization converged after 25 steps. Minimization converged after 23 steps. Minimization converged after 25 steps. Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-3.09443582e-10 5.84189122e-02 -9.12033515e-09] [-2.42964853e-10 -5.84189128e-02 8.53613087e-09] [-2.70617208e-02 5.28844746e-09 -2.16025522e-09] [-1.84055189e-02 2.76176628e-02 -3.87666576e-02] [-1.84055252e-02 -2.76176593e-02 3.87666600e-02] [ 2.70617209e-02 1.14537739e-08 4.39386819e-09] [ 1.84055208e-02 -2.76176618e-02 -3.87666581e-02] [ 1.84055248e-02 2.76176593e-02 3.87666600e-02] [ 2.62917112e-04 -3.37132646e-02 -4.25964777e-02] [-2.62919771e-04 3.37132562e-02 -4.25964829e-02] [ 2.62919351e-04 3.37132560e-02 4.25964716e-02] [-2.62917714e-04 -3.37132647e-02 4.25964830e-02]] Final stress: [-3.14896972e-04 1.11786020e-03 1.01574220e-03 2.24022286e-12 -1.48335162e-11 -4.34756156e-13] Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.16130922 0.0473196 0.05139948] [-0.16130922 -0.0473196 0.05139947] [ 0.21407435 0.00082738 -0.23637379] [-0.08250992 0.08714973 0.03752318] [ 0.02882168 0.04361039 0.0978558 ] [-0.21407435 -0.00082738 -0.23637379] [ 0.08250992 -0.08714973 0.03752318] [-0.02882168 -0.04361039 0.0978558 ] [ 0.04911287 0.07739775 -0.08549192] [-0.04911287 -0.07739775 -0.08549192] [ 0.07314214 -0.19539212 0.13508725] [-0.07314214 0.19539212 0.13508725]] Final stress: [ 2.25666670e-03 1.28121157e-02 1.82295591e-02 5.85365134e-13 -1.30242194e-12 -3.25815678e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.16129854 0.04731846 -0.05140037] [ 0.16129854 -0.04731846 -0.05140036] [ 0.21405892 -0.00084028 0.23635402] [ 0.02880418 -0.04361732 -0.09785446] [-0.08250559 -0.08712902 -0.03750813] [-0.21405892 0.00084028 0.23635402] [-0.02880418 0.04361732 -0.09785446] [ 0.08250559 0.08712902 -0.03750813] [ 0.07308594 0.19538384 -0.13506598] [-0.07308594 -0.19538384 -0.13506598] [ 0.04914035 -0.07740202 0.0854749 ] [-0.04914035 0.07740202 0.0854749 ]] Final stress: [ 2.25621747e-03 1.28111889e-02 1.82285923e-02 -1.70483193e-12 -6.55314956e-13 3.25844123e-03] Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 63 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 60 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 23 steps. Minimization converged after 26 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 4.54127869e-09 4.50505693e-02 8.71356027e-08] [ 6.31958511e-08 -4.50505731e-02 -8.98990697e-07] [ 2.00116359e-01 -1.06097382e-07 4.59647369e-08] [-1.09544146e-01 1.65939906e-01 6.29138822e-03] [-1.09544354e-01 -1.65939782e-01 -6.29127803e-03] [-2.00116378e-01 1.98864055e-07 8.18597980e-08] [ 1.09544159e-01 -1.65939894e-01 6.29135383e-03] [ 1.09544336e-01 1.65939784e-01 -6.29125546e-03] [ 6.37071031e-03 5.91585314e-02 5.15040993e-01] [-6.37074605e-03 -5.91585791e-02 5.15041478e-01] [ 6.37073367e-03 -5.91586280e-02 -5.15040768e-01] [-6.37074271e-03 5.91585730e-02 -5.15041227e-01]] Final stress: [ 1.77887192e-02 1.75784800e-02 1.55041089e-02 -2.57702246e-10 -1.11863440e-10 -1.67542476e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 7.09104317e-10 -1.67837355e-03 7.88894960e-09] [-1.06394493e-09 1.67837382e-03 -1.20750636e-07] [ 1.17363202e-02 -1.97095706e-08 8.89724280e-09] [-6.23269143e-03 1.15592113e-02 -1.10735488e-03] [-6.23274280e-03 -1.15591818e-02 1.10738022e-03] [-1.17363201e-02 4.30127001e-09 2.63612419e-09] [ 6.23268468e-03 -1.15592157e-02 -1.10735202e-03] [ 6.23272263e-03 1.15591944e-02 1.10737054e-03] [-2.65210265e-03 -2.91019973e-03 5.50806080e-02] [ 2.65211736e-03 2.91019966e-03 5.50806616e-02] [-2.65210659e-03 2.91021646e-03 -5.50805724e-02] [ 2.65211909e-03 -2.91020939e-03 -5.50806397e-02]] Final stress: [ 1.17164851e-03 7.59872773e-04 -3.64295941e-04 -2.07679014e-11 7.91656549e-12 5.40650067e-11] Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 5.10005593e-10 5.79842473e-02 1.29784512e-08] [ 5.77235915e-10 -5.79842473e-02 -1.43605312e-08] [-1.80039539e-02 1.62859060e-10 6.63460953e-12] [-2.76773537e-02 7.69513508e-02 -3.59477632e-02] [-2.76773528e-02 -7.69513514e-02 3.59477629e-02] [ 1.80039537e-02 -2.33862199e-09 -8.52893089e-10] [ 2.76773556e-02 -7.69513498e-02 -3.59477642e-02] [ 2.76773525e-02 7.69513516e-02 3.59477629e-02] [ 1.27897382e-02 -6.10922199e-02 -5.88516506e-03] [-1.27897393e-02 6.10922206e-02 -5.88515317e-03] [ 1.27897379e-02 6.10922204e-02 5.88516791e-03] [-1.27897393e-02 -6.10922202e-02 5.88515411e-03]] Final stress: [ 2.97561242e-03 4.39314844e-03 5.68577360e-03 -1.94732186e-12 1.61204548e-13 -7.78503447e-14] Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 29 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.10764103 -0.04915253 0.00964366] [-0.10764103 0.04915253 0.00964367] [ 0.19780815 -0.04733162 -0.09716053] [-0.07244054 0.1762897 0.10642881] [ 0.0900508 -0.04118582 -0.02815661] [-0.19780815 0.04733165 -0.09716051] [ 0.07244048 -0.17628974 0.10642884] [-0.09005076 0.0411858 -0.02815659] [-0.06230075 0.01623861 -0.0329583 ] [ 0.06230076 -0.0162386 -0.03295827] [ 0.18057091 -0.10313493 0.0422029 ] [-0.1805709 0.10313494 0.04220293]] Final stress: [ 7.91625425e-03 1.03088160e-02 1.45824205e-02 -5.88139339e-11 -6.75045928e-12 -2.43668137e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.10763855 -0.0491513 -0.00964377] [ 0.10763855 0.0491513 -0.00964377] [ 0.19780835 0.04733169 0.0971667 ] [ 0.09004924 0.04119037 0.02815662] [-0.07243991 -0.17628955 -0.1064347 ] [-0.19780835 -0.0473317 0.0971667 ] [-0.09004922 -0.04119036 0.02815661] [ 0.0724399 0.17628956 -0.10643471] [ 0.18057302 0.10314445 -0.0422067 ] [-0.18057302 -0.10314445 -0.04220671] [-0.06230831 -0.01623397 0.03296187] [ 0.06230831 0.01623397 0.03296186]] Final stress: [ 7.91629308e-03 1.03089747e-02 1.45826007e-02 -8.65907450e-12 -2.65923782e-13 2.43571510e-04] Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 23 steps. Minimization converged after 26 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 44 steps. Minimization converged after 43 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.10882313 0.01818743 0.05766587] [-0.10882313 -0.01818743 0.05766588] [ 0.06693603 0.04127272 -0.1158637 ] [-0.05703975 0.01057899 0.00503478] [ 0.06769997 0.03264767 0.03912711] [-0.06693603 -0.04127271 -0.11586369] [ 0.05703974 -0.010579 0.00503479] [-0.06769996 -0.03264767 0.03912711] [ 0.02710815 0.01877234 -0.03954451] [-0.02710815 -0.01877234 -0.0395445 ] [ 0.01983974 -0.09928452 0.05358042] [-0.01983974 0.09928452 0.05358044]] Final stress: [-7.31780220e-04 3.65349699e-03 6.47379171e-03 -1.24085662e-11 -4.24005588e-13 -2.68693583e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.10882468 0.01818702 -0.05766655] [ 0.10882468 -0.01818702 -0.05766657] [ 0.06693342 -0.04127236 0.11586015] [ 0.06770785 -0.03264579 -0.03912233] [-0.05703499 -0.01058106 -0.00503536] [-0.06693342 0.04127236 0.11586015] [-0.06770785 0.03264579 -0.03912233] [ 0.05703499 0.01058106 -0.00503536] [ 0.01985046 0.09928031 -0.05358546] [-0.01985046 -0.09928031 -0.05358545] [ 0.02710744 -0.01877277 0.03954956] [-0.02710744 0.01877277 0.03954955]] Final stress: [-7.31937389e-04 3.65338829e-03 6.47376117e-03 -5.19065489e-13 2.43222671e-12 2.68690112e-03] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 69 steps. Minimization converged after 63 steps. Minimization converged after 64 steps. Minimization converged after 63 steps. Minimization converged after 62 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-6.42741429e-08 2.27080353e-02 -8.95292440e-07] [ 8.84698637e-08 -2.27080831e-02 -1.79912796e-06] [ 2.32003232e-01 -8.01095925e-07 3.22500305e-07] [ 8.81571899e-02 2.56814533e-01 9.29625058e-02] [ 8.81542692e-02 -2.56812863e-01 -9.29611380e-02] [-2.32003257e-01 8.56948071e-07 3.16566671e-07] [-8.81555864e-02 -2.56813608e-01 9.29617289e-02] [-8.81551517e-02 2.56813333e-01 -9.29615223e-02] [ 2.11194538e-01 1.17187423e-01 4.31298399e-01] [-2.11195076e-01 -1.17188035e-01 4.31298209e-01] [ 2.11194707e-01 -1.17188015e-01 -4.31297541e-01] [-2.11194890e-01 1.17187223e-01 -4.31298586e-01]] Final stress: [ 1.56848931e-02 1.96097911e-02 1.68837659e-02 2.68849894e-11 -3.09099314e-09 2.30145728e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-3.62609456e-10 -4.75910755e-03 -1.00709833e-08] [-1.84169624e-09 4.75910791e-03 -1.10108902e-07] [ 1.53518378e-02 -1.70950810e-08 8.62804928e-09] [ 1.01315290e-02 1.98399834e-02 5.40104968e-03] [ 1.01314945e-02 -1.98399637e-02 -5.40103033e-03] [-1.53518382e-02 -1.49133892e-08 -4.49153060e-09] [-1.01314909e-02 -1.98399617e-02 5.40103216e-03] [-1.01314935e-02 1.98399636e-02 -5.40103106e-03] [ 1.61979625e-02 6.90782931e-03 3.89043994e-02] [-1.61979795e-02 -6.90782010e-03 3.89044301e-02] [ 1.61979595e-02 -6.90781657e-03 -3.89043351e-02] [-1.61979790e-02 6.90781739e-03 -3.89043988e-02]] Final stress: [ 9.96167056e-04 8.82355043e-04 -9.82340757e-05 3.37518930e-11 1.08642329e-11 3.02107912e-11] Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 3.97695210e-10 8.01346990e-02 2.48116327e-09] [-1.30940629e-09 -8.01346981e-02 3.15252707e-08] [-3.56157388e-02 4.78735052e-09 -2.39793413e-09] [-7.66806628e-03 7.83790364e-02 -2.54599843e-02] [-7.66803981e-03 -7.83790514e-02 2.54599714e-02] [ 3.56157391e-02 -7.57833457e-09 -3.00352764e-09] [ 7.66804278e-03 -7.83790495e-02 -2.54599733e-02] [ 7.66805256e-03 7.83790445e-02 2.54599773e-02] [ 2.81605457e-02 -1.33520786e-01 -4.80082802e-02] [-2.81605370e-02 1.33520795e-01 -4.80082853e-02] [ 2.81605427e-02 1.33520798e-01 4.80082620e-02] [-2.81605400e-02 -1.33520786e-01 4.80082838e-02]] Final stress: [ 2.51130085e-03 3.21368396e-03 6.19955496e-03 -3.95243655e-12 3.29568415e-11 5.24454967e-12] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-5.01001324e-10 -6.68599385e-02 1.16023020e-08] [ 9.77630005e-10 6.68599385e-02 3.02175822e-08] [ 8.71309099e-03 6.48984910e-09 -2.56126800e-09] [ 8.13325108e-04 5.60576811e-03 4.05853233e-02] [ 8.13333556e-04 -5.60577287e-03 -4.05853271e-02] [-8.71309103e-03 -1.81092932e-08 -7.49548717e-09] [-8.13311770e-04 -5.60576026e-03 4.05853168e-02] [-8.13344013e-04 5.60577886e-03 -4.05853322e-02] [-2.09984302e-02 2.22145869e-02 1.21345954e-02] [ 2.09984283e-02 -2.22145876e-02 1.21345780e-02] [-2.09984302e-02 -2.22145876e-02 -1.21345930e-02] [ 2.09984288e-02 2.22145861e-02 -1.21345929e-02]] Final stress: [ 2.36377884e-03 -1.34931216e-03 1.88478061e-03 1.36094213e-12 3.65684869e-12 2.27048330e-12] Minimization converged after 27 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.84007928e-10 5.04320378e-02 6.40890274e-09] [-1.04089004e-09 -5.04320376e-02 3.33484772e-08] [-2.18339093e-02 1.65402336e-08 -6.81334719e-09] [-1.09094533e-02 1.52168496e-02 -2.93920556e-02] [-1.09094209e-02 -1.52168685e-02 2.93920402e-02] [ 2.18339095e-02 -8.37065056e-09 -3.27640360e-09] [ 1.09094414e-02 -1.52168564e-02 -2.93920498e-02] [ 1.09094332e-02 1.52168613e-02 2.93920460e-02] [ 5.88032656e-03 -4.79442868e-02 8.60186186e-03] [-5.88032605e-03 4.79442896e-02 8.60185709e-03] [ 5.88032599e-03 4.79442904e-02 -8.60187502e-03] [-5.88032642e-03 -4.79442875e-02 -8.60185440e-03]] Final stress: [-1.60500829e-04 1.19328513e-03 1.85155438e-03 1.97715436e-12 9.56273823e-12 2.34576530e-12] Minimization converged after 24 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 46 steps. Minimization converged after 45 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.05760521 0.01529059 0.03071436] [-0.05760521 -0.01529059 0.03071432] [ 0.12659507 0.01819122 -0.05842437] [-0.00970774 0.10666911 0.02114231] [ 0.0527022 -0.08666974 -0.00335099] [-0.12659507 -0.01819124 -0.05842437] [ 0.00970775 -0.1066691 0.0211423 ] [-0.05270222 0.08666975 -0.003351 ] [ 0.05596159 -0.00028238 -0.02004678] [-0.05596159 0.00028238 -0.02004678] [ 0.08783021 -0.04304319 0.02996552] [-0.08783021 0.04304319 0.02996549]] Final stress: [ 4.08891355e-03 8.32615879e-03 8.59058316e-03 7.73756065e-12 -6.47884272e-12 -2.18012618e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.05760466 0.01528964 -0.03071452] [ 0.05760466 -0.01528965 -0.03071449] [ 0.12658849 -0.01819343 0.05842193] [ 0.05270434 0.08667118 0.00335363] [-0.00970072 -0.10666493 -0.02114304] [-0.12658849 0.01819343 0.05842193] [-0.05270435 -0.08667118 0.00335363] [ 0.00970073 0.10666493 -0.02114303] [ 0.08783144 0.04304143 -0.02996377] [-0.08783144 -0.04304142 -0.02996378] [ 0.05596385 0.00028558 0.02004574] [-0.05596385 -0.00028558 0.02004576]] Final stress: [4.08866595e-03 8.32580941e-03 8.59021742e-03 9.69585797e-13 6.08040028e-12 2.18008054e-03] Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 72 steps. Minimization converged after 71 steps. Minimization converged after 72 steps. Minimization converged after 71 steps. Minimization converged after 64 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 25 steps. Minimization converged after 30 steps. Minimization converged after 2 steps. Minimization converged after 21 steps. Minimization converged after 23 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.69704259e-11 7.19405329e-03 4.59080707e-09] [ 4.53528555e-10 -7.19405341e-03 -6.13686737e-08] [-2.55158992e-03 -4.76195838e-09 2.05443831e-09] [-9.91002844e-04 3.18893918e-03 -5.34519997e-03] [-9.91009080e-04 -3.18893551e-03 5.34520322e-03] [ 2.55158970e-03 2.42938925e-08 1.01274018e-08] [ 9.90986768e-04 -3.18894876e-03 -5.34519225e-03] [ 9.91020639e-04 3.18892907e-03 5.34520894e-03] [ 1.94124672e-03 -3.71427902e-03 5.67781291e-03] [-1.94124503e-03 3.71427678e-03 5.67785522e-03] [ 1.94124777e-03 3.71427450e-03 -5.67781185e-03] [-1.94124521e-03 -3.71427566e-03 -5.67783163e-03]] Final stress: [ 4.55078166e-05 3.91312324e-04 3.67832119e-04 -4.46815607e-12 -1.84917971e-12 -1.17001331e-11] Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-2.84275059e-09 -6.31193959e-02 -1.06967465e-08] [ 5.24454126e-08 6.31193966e-02 6.25483503e-07] [ 7.42886284e-02 7.90489385e-08 -3.21376455e-08] [-3.30726493e-02 1.05371111e-01 6.52865041e-02] [-3.30725548e-02 -1.05371161e-01 -6.52865480e-02] [-7.42886330e-02 -2.42466142e-07 -1.00167090e-07] [ 3.30728044e-02 -1.05371013e-01 6.52864178e-02] [ 3.30724099e-02 1.05371238e-01 -6.52866094e-02] [-3.40057545e-02 -5.47781350e-02 -9.95081572e-02] [ 3.40057207e-02 5.47781369e-02 -9.95085677e-02] [-3.40057572e-02 5.47781429e-02 9.95081441e-02] [ 3.40057358e-02 -5.47781571e-02 9.95083337e-02]] Final stress: [ 1.36287285e-02 6.26341367e-04 1.65465093e-02 -1.16200718e-10 1.61605769e-10 8.50702903e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-8.46909765e-11 -3.32023781e-02 6.03898898e-09] [ 1.15806381e-09 3.32023783e-02 7.58517349e-08] [ 1.58107248e-02 2.18407954e-08 -9.13095313e-09] [ 4.06825758e-03 -9.74051124e-04 1.31701176e-02] [ 4.06830319e-03 9.74024931e-04 -1.31701392e-02] [-1.58107246e-02 -2.12776237e-08 -8.75564333e-09] [-4.06826634e-03 9.74046343e-04 1.31701214e-02] [-4.06830014e-03 -9.74026988e-04 -1.31701375e-02] [ 6.36003605e-03 1.47074831e-02 -2.82619782e-02] [-6.36003319e-03 -1.47074807e-02 -2.82620080e-02] [ 6.36003562e-03 -1.47074814e-02 2.82619619e-02] [-6.36003407e-03 1.47074851e-02 2.82619979e-02]] Final stress: [ 6.98005794e-04 -6.47068730e-04 4.47187190e-04 -6.61662590e-12 3.47072168e-12 -4.64306785e-12] Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 43 steps. Minimization converged after 44 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 0.06787056 -0.03219908 0.00067401] [-0.06787056 0.03219908 0.00067394] [ 0.05278662 -0.00547526 -0.04605989] [-0.01850706 0.04838544 0.04571583] [ 0.0265978 0.0163537 -0.00144672] [-0.05278662 0.00547521 -0.04605991] [ 0.01850711 -0.04838542 0.04571581] [-0.02659784 -0.01635367 -0.00144674] [-0.02018301 -0.00134307 -0.00118771] [ 0.02018301 0.00134307 -0.00118772] [ 0.03184154 -0.03219923 0.00230458] [-0.03184154 0.03219923 0.00230452]] Final stress: [ 2.16103894e-03 1.68822131e-03 3.63048477e-03 2.54711196e-11 -3.01849289e-13 -1.07037486e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-0.06784142 -0.03218401 -0.0006739 ] [ 0.06784143 0.03218401 -0.00067387] [ 0.05287255 0.00550061 0.04614665] [ 0.02659423 -0.01634953 0.00144062] [-0.01857458 -0.04844859 -0.04579593] [-0.05287255 -0.00550063 0.04614664] [-0.02659424 0.01634952 0.00144062] [ 0.01857457 0.0484486 -0.04579593] [ 0.03190438 0.03228846 -0.00233704] [-0.03190436 -0.03228845 -0.00233706] [-0.02029223 0.00134259 0.0012196 ] [ 0.02029224 -0.00134257 0.00121961]] Final stress: [ 2.16397648e-03 1.69240688e-03 3.63314477e-03 -3.40079059e-11 1.90734820e-11 1.06915456e-03] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-9.25764576e-10 6.41263681e-02 -1.59014508e-08] [ 9.98615728e-10 -6.41263683e-02 -2.35204963e-08] [-2.15036208e-02 -4.06571088e-09 1.67013850e-09] [-3.06291181e-02 5.70700212e-02 -4.63252727e-02] [-3.06291321e-02 -5.70700130e-02 4.63252791e-02] [ 2.15036207e-02 1.80941539e-08 7.37043349e-09] [ 3.06291152e-02 -5.70700229e-02 -4.63252710e-02] [ 3.06291427e-02 5.70700067e-02 4.63252842e-02] [ 1.63621268e-02 -2.60989811e-02 -1.90561075e-02] [-1.63621315e-02 2.60989791e-02 -1.90560975e-02] [ 1.63621273e-02 2.60989789e-02 1.90561064e-02] [-1.63621303e-02 -2.60989828e-02 1.90561094e-02]] Final stress: [ 1.48603934e-03 3.54707111e-03 4.61231893e-03 3.82414118e-12 -8.18787856e-13 4.80697243e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 5.38252221e-11 -7.88022877e-03 2.44602938e-09] [-3.29529071e-10 7.88022865e-03 -6.26959534e-08] [ 4.83076661e-03 -1.35470237e-08 5.60187668e-09] [-3.61774564e-04 -5.50773951e-04 5.79990943e-03] [-3.61802316e-04 5.50789903e-04 -5.79989636e-03] [-4.83076675e-03 1.95618222e-08 8.02691159e-09] [ 3.61771933e-04 5.50772108e-04 5.79991083e-03] [ 3.61803793e-04 -5.50790502e-04 -5.79989567e-03] [-2.48691288e-03 3.02748824e-03 5.71975356e-03] [ 2.48691323e-03 -3.02749014e-03 5.71978659e-03] [-2.48691257e-03 -3.02748930e-03 -5.71974674e-03] [ 2.48691379e-03 3.02748775e-03 -5.71977501e-03]] Final stress: [ 4.32435992e-04 1.58494278e-05 3.72229148e-04 -3.36247026e-13 -3.04397292e-12 2.38655908e-12] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.17513163e-09 5.75003876e-02 2.45066860e-08] [-1.08150710e-08 -5.75003869e-02 2.81511889e-07] [-4.17165130e-02 1.02313776e-07 -4.27833392e-08] [-3.07699524e-02 3.54171828e-02 -3.93756477e-02] [-3.07697518e-02 -3.54173000e-02 3.93755511e-02] [ 4.17165150e-02 -4.32417357e-08 -1.79040355e-08] [ 3.07698769e-02 -3.54172260e-02 -3.93756109e-02] [ 3.07697993e-02 3.54172723e-02 3.93755735e-02] [-6.24972892e-03 -5.51195167e-02 -1.99375331e-02] [ 6.24974656e-03 5.51195184e-02 -1.99376099e-02] [-6.24972628e-03 5.51195155e-02 1.99374337e-02] [ 6.24974310e-03 -5.51195060e-02 1.99375981e-02]] Final stress: [ 7.21543418e-04 2.03848976e-03 3.79053840e-03 5.12066377e-12 4.37221702e-11 -3.86848863e-11] Minimization converged after 26 steps. Minimization converged after 40 steps. Minimization converged after 42 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 45 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 62 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 25 steps. Minimization converged after 28 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 3.06976666e-12 2.07952053e-04 9.80628911e-11] [ 3.90106003e-12 -2.07952062e-04 -1.54329659e-09] [ 5.41989692e-04 -2.94006819e-10 1.32231670e-10] [-3.86660667e-04 6.88070963e-04 2.80536097e-04] [-3.86661369e-04 -6.88070563e-04 -2.80535747e-04] [-5.41989697e-04 2.49999188e-10 1.07842561e-10] [ 3.86660772e-04 -6.88070912e-04 2.80536043e-04] [ 3.86661034e-04 6.88070757e-04 -2.80535903e-04] [-8.55729307e-05 4.50433155e-05 3.65931539e-04] [ 8.55730182e-05 -4.50434382e-05 3.65932190e-04] [-8.55729073e-05 -4.50434072e-05 -3.65931058e-04] [ 8.55730475e-05 4.50433365e-05 -3.65931955e-04]] Final stress: [ 1.09191814e-04 -1.03794058e-05 2.58767464e-05 -1.78586705e-13 -1.75976549e-13 1.81109694e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 6.57920940e-12 -2.10851833e-04 2.44418707e-10] [ 4.13946655e-13 2.10851836e-04 -2.60592536e-09] [ 8.61227052e-04 -9.71005276e-10 4.07960998e-10] [-3.17741714e-04 5.36806386e-04 -2.79791276e-04] [-3.17743515e-04 -5.36805349e-04 2.79792143e-04] [-8.61227059e-04 3.99014155e-12 8.02712237e-12] [ 3.17742360e-04 -5.36806025e-04 -2.79791589e-04] [ 3.17742642e-04 5.36805865e-04 2.79791725e-04] [ 7.99276881e-05 -5.15806663e-05 3.64559793e-04] [-7.99275598e-05 5.15806830e-05 3.64560543e-04] [ 7.99276503e-05 5.15808184e-05 -3.64558731e-04] [-7.99275523e-05 -5.15807475e-05 -3.64560662e-04]] Final stress: [-1.05014952e-05 1.08842060e-04 2.57881069e-05 -1.85499236e-13 9.16451596e-14 4.64156163e-13] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 3.19228421e-10 1.72920155e-02 3.57378860e-08] [ 4.37143766e-10 -1.72920162e-02 -5.11214853e-08] [-3.63242742e-03 -2.89531052e-08 1.24160777e-08] [-3.21165503e-03 8.37756734e-03 -1.33204891e-02] [-3.21172646e-03 -8.37752637e-03 1.33205233e-02] [ 3.63242699e-03 -2.44876257e-08 -1.03871301e-08] [ 3.21172100e-03 -8.37752973e-03 -1.33205206e-02] [ 3.21166567e-03 8.37756148e-03 1.33204942e-02] [ 4.12468084e-03 -1.60705098e-03 2.71686576e-03] [-4.12468565e-03 1.60704234e-03 2.71686298e-03] [ 4.12468233e-03 1.60704400e-03 -2.71681928e-03] [-4.12468302e-03 -1.60705391e-03 -2.71690379e-03]] Final stress: [-1.47686861e-04 9.13491415e-04 5.08965340e-04 1.48186846e-12 -2.47221062e-11 9.88392060e-12] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 15 steps. Final forces: [[-1.24202456e-08 -6.79577264e-02 1.39827266e-07] [ 2.38526174e-08 6.79577284e-02 3.67899806e-07] [ 3.95074978e-02 9.10178306e-08 -3.74107976e-08] [-1.02773578e-02 4.48298684e-02 6.37485188e-02] [-1.02770982e-02 -4.48300140e-02 -6.37486377e-02] [-3.95074994e-02 -1.83397917e-07 -7.45582866e-08] [ 1.02774164e-02 -4.48298318e-02 6.37484885e-02] [ 1.02770922e-02 4.48300164e-02 -6.37486405e-02] [-3.18994511e-02 -1.19782989e-02 -3.11421176e-02] [ 3.18994257e-02 1.19783324e-02 -3.11422600e-02] [-3.18994515e-02 1.19782920e-02 3.11420914e-02] [ 3.18994146e-02 -1.19782742e-02 3.11421614e-02]] Final stress: [ 7.56591253e-03 -1.02075371e-03 7.89209891e-03 2.33167542e-11 7.13729930e-11 -1.01817341e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-4.02240463e-11 -3.98688106e-02 -2.42782766e-08] [ 5.41289824e-09 3.98688115e-02 2.36937931e-07] [ 1.29962735e-02 5.22638196e-08 -2.17727416e-08] [ 4.65360025e-04 1.56227719e-03 3.18781767e-02] [ 4.65469057e-04 -1.56233937e-03 -3.18782282e-02] [-1.29962735e-02 -6.85415922e-08 -2.79052923e-08] [-4.65364019e-04 -1.56227763e-03 3.18781775e-02] [-4.65453967e-04 1.56232953e-03 -3.18782206e-02] [-1.46865713e-02 3.61895572e-03 -3.72425106e-02] [ 1.46865664e-02 -3.61894078e-03 -3.72426322e-02] [-1.46865759e-02 -3.61894040e-03 3.72424753e-02] [ 1.46865644e-02 3.61895113e-03 3.72425992e-02]] Final stress: [ 1.58826417e-03 -1.19535398e-03 1.30919692e-03 -1.95028749e-12 1.86620831e-11 1.32416290e-11] Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 45 steps. Minimization converged after 47 steps. Minimization converged after 38 steps. Minimization converged after 40 steps. Minimization converged after 27 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 7.14244677e-10 -1.84719779e-02 -2.24191197e-08] [-1.35585032e-09 1.84719784e-02 -1.34741775e-07] [ 9.52375390e-03 -5.83326476e-08 2.41210483e-08] [-1.67447827e-03 1.42797772e-03 1.35354849e-02] [-1.67457405e-03 -1.42792247e-03 -1.35354390e-02] [-9.52375398e-03 2.05586477e-08 8.69531518e-09] [ 1.67449078e-03 -1.42797087e-03 1.35354786e-02] [ 1.67454630e-03 1.42793929e-03 -1.35354526e-02] [-6.25213132e-03 -1.91067140e-03 2.65183158e-03] [ 6.25214095e-03 1.91067623e-03 2.65186590e-03] [-6.25213377e-03 1.91068234e-03 -2.65178689e-03] [ 6.25214010e-03 -1.91067357e-03 -2.65185815e-03]] Final stress: [ 1.00802822e-03 -2.63598021e-04 4.97787638e-04 -1.06441732e-11 1.43877440e-11 1.54342187e-11] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-3.30692362e-10 7.03279522e-02 -1.72344523e-08] [-2.61776284e-09 -7.03279521e-02 4.84205693e-08] [-4.97373778e-02 -6.23213214e-09 2.87825980e-09] [-6.26021953e-02 8.47374640e-02 -7.05165305e-02] [-6.26022083e-02 -8.47374566e-02 7.05165374e-02] [ 4.97373786e-02 -3.70731737e-08 -1.50161299e-08] [ 6.26022149e-02 -8.47374527e-02 -7.05165403e-02] [ 6.26021692e-02 8.47374796e-02 7.05165181e-02] [-4.47425054e-04 -1.10633245e-01 -3.43944890e-02] [ 4.47437923e-04 1.10633247e-01 -3.43945439e-02] [-4.47428290e-04 1.10633255e-01 3.43945116e-02] [ 4.47437259e-04 -1.10633248e-01 3.43945177e-02]] Final stress: [ 4.05458940e-03 4.11828011e-03 8.13942541e-03 -2.57228628e-12 -1.54191196e-11 2.44426742e-11] Minimization converged after 25 steps. Minimization converged after 42 steps. Minimization converged after 42 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 47 steps. Minimization converged after 46 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.05867676 -0.04580622 0.00069266] [ 0.03295429 -0.04582307 -0.00069269] [-0.06752197 0.00263267 -0.02025409] [-0.00311132 -0.00279134 -0.00192488] [ 0.01041512 0.02914293 0.0255929 ] [-0.00097814 0.00926445 0.00926854] [-0.0487402 0.0828919 0.00743077] [-0.0105874 -0.00062233 -0.02011319] [ 0.09693742 0.04341215 -0.00987424] [ 0.04573846 0.07037324 -0.01297007] [-0.08243366 -0.08502976 0.01272486] [-0.03134936 -0.05764462 0.01011942]] Final stress: [-0.0020171 -0.00201593 0.00147788 -0.00363778 -0.00363782 -0.0008252 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 0.03295421 0.04582298 0.00069269] [ 0.05867665 0.04580613 -0.00069266] [-0.06752178 -0.00263273 0.020254 ] [ 0.01041501 -0.02914291 -0.02559278] [-0.00311127 0.00279146 0.00192485] [-0.00097804 -0.00926451 -0.00926846] [-0.01058749 0.00062231 0.02011307] [-0.04874008 -0.08289165 -0.00743074] [-0.08243374 0.08502983 -0.01272485] [-0.03134952 0.05764473 -0.01011941] [ 0.09693747 -0.0434123 0.00987423] [ 0.04573859 -0.07037334 0.01297006]] Final stress: [-0.0020171 -0.00201593 0.00147788 -0.00363777 0.00363782 0.0008252 ] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.05867605 -0.0458056 -0.00069265] [-0.03295376 -0.04582245 0.00069268] [ 0.00097758 0.00926487 -0.00926802] [ 0.01058799 -0.00062218 0.02011244] [ 0.0487395 0.08289036 -0.00743058] [ 0.06752078 0.00263311 0.02025354] [-0.01041436 0.02914282 -0.02559214] [ 0.00311109 -0.00279204 0.0019247 ] [ 0.03135064 -0.05764575 -0.01011935] [ 0.08243447 -0.08503063 -0.01272477] [-0.0457397 0.07037416 0.01296997] [-0.09693819 0.04341333 0.00987418]] Final stress: [-0.00201708 -0.00201591 0.00147788 0.00363776 -0.0036378 0.00082519] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-0.03295429 0.04582308 -0.00069269] [-0.05867678 0.04580623 0.00069266] [ 0.0009782 -0.00926445 0.00926855] [ 0.04874025 -0.08289199 0.00743078] [ 0.01058738 0.0006223 -0.0201132 ] [ 0.06752204 -0.00263267 -0.0202541 ] [ 0.00311135 0.00279128 -0.00192488] [-0.01041513 -0.02914294 0.02559292] [-0.0457386 -0.07037332 -0.01297008] [-0.0969376 -0.04341223 -0.00987425] [ 0.03134942 0.05764477 0.01011943] [ 0.08243376 0.08502992 0.01272487]] Final stress: [-0.0020171 -0.00201593 0.00147789 0.00363778 0.00363782 -0.0008252 ] Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 8.35844407e-05 -1.75750014e-05 6.89621325e-05] [-8.35844394e-05 1.75750007e-05 6.89621944e-05] [ 3.76008918e-04 1.87468388e-04 4.98665593e-04] [ 9.00335598e-05 7.34548170e-04 -1.15396091e-04] [ 1.62986487e-04 -6.17007302e-04 -4.57727433e-04] [-3.76008916e-04 -1.87468365e-04 4.98665605e-04] [-9.00335851e-05 -7.34548185e-04 -1.15396077e-04] [-1.62986486e-04 6.17007304e-04 -4.57727431e-04] [ 3.37354737e-04 -1.15902051e-04 1.06239382e-03] [-3.37354724e-04 1.15902044e-04 1.06239381e-03] [ 2.52690089e-04 2.34715576e-04 -1.05689808e-03] [-2.52690081e-04 -2.34715577e-04 -1.05689804e-03]] Final stress: [ 3.57759949e-05 4.00298401e-05 8.05780765e-06 -2.48588132e-14 5.82214086e-15 1.49183492e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-8.32616837e-05 -1.76656923e-05 -6.89618341e-05] [ 8.32616842e-05 1.76656937e-05 -6.89618380e-05] [ 3.76127137e-04 -1.87169247e-04 -4.99828205e-04] [ 1.65920362e-04 6.18872365e-04 4.59565865e-04] [ 9.25541504e-05 -7.36446621e-04 1.14734370e-04] [-3.76127139e-04 1.87169259e-04 -4.99828194e-04] [-1.65920398e-04 -6.18872378e-04 4.59565885e-04] [-9.25541499e-05 7.36446628e-04 1.14734375e-04] [ 2.55532890e-04 -2.36007768e-04 1.05734357e-03] [-2.55532856e-04 2.36007757e-04 1.05734359e-03] [ 3.39936790e-04 1.16053911e-04 -1.06285380e-03] [-3.39936787e-04 -1.16053907e-04 -1.06285378e-03]] Final stress: [ 3.57681645e-05 4.00665029e-05 8.05661380e-06 -3.78904294e-14 6.46797869e-14 -1.49178764e-04] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.30816063e-10 -1.79864812e-02 -7.01835901e-09] [ 6.06354966e-10 1.79864816e-02 5.31114647e-08] [ 6.53389226e-03 -3.44619555e-09 1.16702145e-09] [ 1.71537381e-03 -4.49899687e-03 1.08226046e-02] [ 1.71536643e-03 4.49900116e-03 -1.08226017e-02] [-6.53389194e-03 -2.65709701e-08 -1.10214286e-08] [-1.71536740e-03 4.49900090e-03 1.08226009e-02] [-1.71538789e-03 -4.49898879e-03 -1.08226118e-02] [-2.19885417e-03 4.97436817e-03 5.97969715e-03] [ 2.19886256e-03 -4.97436337e-03 5.97965519e-03] [-2.19885756e-03 -4.97435420e-03 -5.97969766e-03] [ 2.19886283e-03 4.97436254e-03 -5.97968293e-03]] Final stress: [ 3.98388263e-04 -5.40735181e-04 -2.60231789e-05 -1.38981632e-11 1.25635585e-11 3.08852688e-11] Minimization converged after 2 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 8.67076855e-10 8.70121362e-04 2.87070412e-09] [ 6.01795863e-10 -8.70122407e-04 -3.12201705e-08] [-2.46549443e-04 8.87533447e-09 -2.89235674e-09] [-5.10492410e-05 2.34370355e-04 -4.89126946e-04] [-5.10749382e-05 -2.34355972e-04 4.89139105e-04] [ 2.46549783e-04 4.90455990e-09 2.08634129e-09] [ 5.10430926e-05 -2.34374638e-04 -4.89124370e-04] [ 5.10382013e-05 2.34377235e-04 4.89122672e-04] [ 2.37299635e-04 1.32061123e-04 6.22147846e-05] [-2.37282812e-04 -1.32081067e-04 6.22261756e-05] [ 2.37301618e-04 -1.32068298e-04 -6.22007756e-05] [-2.37277364e-04 1.32058527e-04 -6.22214898e-05]] Final stress: [ 4.35030349e-05 6.36079044e-05 1.58485984e-04 -3.44233560e-11 -2.52284936e-11 3.23377433e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.80102600e-11 1.83752029e-03 7.41827200e-09] [-1.38049502e-10 -1.83752018e-03 2.16854315e-07] [-3.12644473e-04 5.50314534e-08 -2.29691909e-08] [-3.43036280e-04 6.83096647e-04 -1.15173076e-03] [-3.42927385e-04 -6.83159424e-04 1.15167889e-03] [ 3.12645235e-04 -5.61308303e-08 -2.33413756e-08] [ 3.43032307e-04 -6.83098121e-04 -1.15172909e-03] [ 3.42927770e-04 6.83158456e-04 1.15167921e-03] [ 3.56255045e-04 9.42782409e-05 -1.11814396e-04] [-3.56253090e-04 -9.42769126e-05 -1.11912065e-04] [ 3.56256003e-04 -9.42823153e-05 1.11775447e-04] [-3.56254976e-04 9.42844146e-05 1.11874806e-04]] Final stress: [-4.39394505e-06 8.25329834e-05 -8.43287668e-05 -1.81653864e-12 3.05203208e-12 -2.42416879e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.52176654e-11 -2.91218704e-02 1.43817203e-09] [-5.61543312e-10 2.91218702e-02 -2.52521190e-08] [-3.02940312e-03 -7.09687464e-09 2.91366500e-09] [-3.02808719e-03 -1.64911584e-02 1.51010611e-02] [-3.02810410e-03 1.64911682e-02 -1.51010532e-02] [ 3.02940304e-03 5.30956190e-09 2.17931752e-09] [ 3.02809489e-03 1.64911629e-02 1.51010576e-02] [ 3.02810300e-03 -1.64911675e-02 -1.51010539e-02] [-1.64971040e-02 -1.22483030e-02 -2.09079265e-06] [ 1.64971006e-02 1.22483021e-02 -2.08071856e-06] [-1.64971037e-02 1.22483025e-02 2.09692718e-06] [ 1.64971012e-02 -1.22483048e-02 2.08158498e-06]] Final stress: [ 6.75393746e-04 -1.74055521e-03 2.07496742e-04 6.54068093e-12 -1.91086007e-12 3.77364230e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.72514666e-09 -1.66637079e-03 5.67659448e-08] [-2.85845458e-10 1.66636821e-03 4.77826395e-07] [ 3.70373566e-04 1.65862064e-07 -7.05794727e-08] [ 6.85083810e-05 -6.15801372e-04 9.62949398e-04] [ 6.87691656e-05 6.15650573e-04 -9.63078833e-04] [-3.70372996e-04 -1.54990543e-08 -9.64013995e-09] [-6.85359585e-05 6.15786723e-04 9.62964889e-04] [-6.86697746e-05 -6.15710877e-04 -9.63030839e-04] [-5.36250916e-04 -4.54668094e-05 -9.91767200e-05] [ 5.36206705e-04 4.54391490e-05 -9.93095954e-05] [-5.36236614e-04 4.54082458e-05 9.89820223e-05] [ 5.36210452e-04 -4.54534115e-05 9.92453053e-05]] Final stress: [-1.22484852e-05 -9.17085280e-05 -1.37299048e-04 5.83053071e-11 -6.22236873e-11 -9.15513198e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.29079184e-02 2.07818939e-02 2.35078576e-04] [-1.29079184e-02 -2.07818939e-02 -2.35081788e-04] [ 2.18328630e-02 -4.13889162e-10 1.79945125e-10] [ 3.90396659e-03 -1.13512581e-02 3.16019102e-02] [ 3.90396488e-03 1.13512591e-02 -3.16019094e-02] [ 1.50913763e-03 5.87278265e-10 2.61054009e-10] [-7.08259176e-04 -2.79056639e-05 -9.04287522e-03] [-7.08257647e-04 2.79047875e-05 9.04287596e-03] [-3.57793977e-03 -1.38796737e-03 -2.22942427e-02] [ 1.61915045e-03 2.14757922e-02 -2.24758009e-02] [-3.57793983e-03 1.38796766e-03 2.22942433e-02] [ 1.61915060e-03 -2.14757927e-02 2.24758015e-02]] Final stress: [-1.37491821e-04 -1.76564954e-05 5.25824469e-04 -1.40147811e-03 -1.21021195e-13 1.71840639e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.29096751e-02 2.07847448e-02 -2.34986170e-04] [ 1.29096751e-02 -2.07847448e-02 2.34988762e-04] [-1.51020396e-03 3.08593143e-11 -3.12654403e-11] [ 7.07828407e-04 2.72145090e-05 -9.04425615e-03] [ 7.07828646e-04 -2.72146437e-05 9.04425601e-03] [-2.18353695e-02 -9.57081143e-10 -3.95608898e-10] [-3.90447201e-03 1.13534020e-02 3.16059835e-02] [-3.90447381e-03 -1.13534009e-02 -3.16059844e-02] [-1.61962482e-03 -2.14779083e-02 -2.24798210e-02] [ 3.57938079e-03 1.38846013e-03 -2.22980803e-02] [-1.61962481e-03 2.14779082e-02 2.24798210e-02] [ 3.57938078e-03 -1.38846002e-03 2.22980792e-02]] Final stress: [-1.37544483e-04 -1.76983547e-05 5.25911608e-04 1.40167345e-03 1.70039070e-13 -4.29631156e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.18088168e-03 -1.88508500e-02 -1.32024541e-04] [-8.18088168e-03 1.88508500e-02 1.32026860e-04] [ 2.32641768e-03 5.72004357e-10 -2.52354458e-10] [-2.89457217e-03 5.35263199e-03 7.74842162e-03] [-2.89457131e-03 -5.35263248e-03 -7.74842207e-03] [ 2.36343391e-02 -2.23006603e-10 -1.03680751e-10] [ 3.86832322e-03 -2.00192108e-02 -2.06592514e-02] [ 3.86832265e-03 2.00192111e-02 2.06592512e-02] [-5.06390626e-03 1.05185731e-02 9.95011113e-03] [-7.09341661e-04 -1.55634110e-03 1.00570303e-02] [-5.06390622e-03 -1.05185732e-02 -9.95011191e-03] [-7.09341645e-04 1.55634103e-03 -1.00570307e-02]] Final stress: [ 4.12525862e-04 1.99865808e-04 4.96514844e-05 -1.04216111e-03 -2.82314382e-13 -2.99372169e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.18088154e-03 -1.88508495e-02 1.32024630e-04] [ 8.18088152e-03 1.88508495e-02 -1.32023005e-04] [-2.36343382e-02 5.62064185e-10 -2.57604302e-10] [-3.86832331e-03 2.00192100e-02 -2.06592512e-02] [-3.86832254e-03 -2.00192104e-02 2.06592508e-02] [-2.32641771e-03 -1.94763352e-11 -1.21688871e-11] [ 2.89457125e-03 -5.35263220e-03 7.74842185e-03] [ 2.89457222e-03 5.35263165e-03 -7.74842144e-03] [ 7.09341737e-04 1.55634128e-03 1.00570307e-02] [ 5.06390594e-03 -1.05185729e-02 9.95011052e-03] [ 7.09341614e-04 -1.55634072e-03 -1.00570319e-02] [ 5.06390597e-03 1.05185728e-02 -9.95011062e-03]] Final stress: [4.12525851e-04 1.99865799e-04 4.96514783e-05 1.04216109e-03 4.78188997e-13 1.39503334e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.41820532e-11 3.47843502e-02 1.20355787e-09] [ 4.65947414e-11 -9.69812093e-03 2.04611964e-10] [ 1.16864890e-02 8.03855261e-03 2.00068594e-02] [ 2.53391626e-03 -1.73781856e-02 -4.31859495e-03] [ 2.81105239e-03 -4.62243428e-03 -2.36381630e-02] [-1.16864890e-02 8.03855181e-03 -2.00068597e-02] [-2.81105226e-03 -4.62243423e-03 2.36381629e-02] [-2.53391868e-03 -1.73781841e-02 4.31859387e-03] [ 8.66176272e-03 -7.61745306e-03 -2.74021903e-02] [ 1.13823263e-02 9.03640502e-03 -1.69022187e-02] [-1.13823251e-02 9.03640497e-03 1.69022192e-02] [-8.66176170e-03 -7.61745246e-03 2.74021898e-02]] Final stress: [-2.43657317e-04 8.60817992e-05 5.17713209e-04 -1.79600997e-12 -1.39145872e-03 -1.30598270e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.54964597e-12 9.69666072e-03 1.83545535e-10] [ 7.90249766e-13 -3.47809155e-02 -3.74167576e-10] [ 1.16837292e-02 -8.03863403e-03 -2.00049258e-02] [ 2.81339526e-03 4.62373735e-03 2.36374637e-02] [ 2.53388603e-03 1.73746703e-02 4.31776918e-03] [-1.16837293e-02 -8.03863335e-03 2.00049260e-02] [-2.53388672e-03 1.73746699e-02 -4.31776888e-03] [-2.81339456e-03 4.62373696e-03 -2.36374634e-02] [-1.13810313e-02 -9.03478884e-03 -1.69009131e-02] [-8.66089469e-03 7.61714265e-03 -2.74009704e-02] [ 8.66089465e-03 7.61714270e-03 2.74009703e-02] [ 1.13810313e-02 -9.03478890e-03 1.69009126e-02]] Final stress: [-2.43649088e-04 8.60914662e-05 5.17675508e-04 -1.87055053e-14 1.39136320e-03 1.57426401e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.59399500e-11 -9.80071363e-03 -1.22930684e-10] [-1.97315984e-12 2.64984606e-02 1.77227492e-09] [-9.92804508e-03 5.83229151e-04 1.81740377e-02] [ 7.36474801e-03 5.02848823e-03 -1.42756300e-02] [-1.33487271e-02 -2.00826635e-02 1.59400273e-04] [ 9.92804509e-03 5.83228760e-04 -1.81740379e-02] [ 1.33487282e-02 -2.00826629e-02 -1.59400805e-04] [-7.36474857e-03 5.02848855e-03 1.42756298e-02] [ 3.06462854e-03 1.07885908e-02 1.28742708e-02] [ 5.90151456e-03 -4.66651838e-03 7.28599171e-03] [-5.90151479e-03 -4.66651872e-03 -7.28599293e-03] [-3.06462888e-03 1.07885911e-02 -1.28742703e-02]] Final stress: [ 3.56495062e-04 2.61050988e-04 4.99330635e-05 5.31655831e-13 -1.03993929e-03 -1.23783261e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.21613017e-11 -2.64984606e-02 -1.45953719e-10] [ 1.44604534e-11 9.80071364e-03 9.38784451e-10] [-9.92804510e-03 -5.83229169e-04 -1.81740377e-02] [-1.33487277e-02 2.00826632e-02 -1.59400581e-04] [ 7.36474799e-03 -5.02848822e-03 1.42756301e-02] [ 9.92804511e-03 -5.83229564e-04 1.81740375e-02] [-7.36474805e-03 -5.02848824e-03 -1.42756300e-02] [ 1.33487269e-02 2.00826637e-02 1.59400208e-04] [-5.90151445e-03 4.66651852e-03 7.28599273e-03] [-3.06462850e-03 -1.07885910e-02 1.28742700e-02] [ 3.06462892e-03 -1.07885909e-02 -1.28742706e-02] [ 5.90151487e-03 4.66651866e-03 -7.28599235e-03]] Final stress: [ 3.56495062e-04 2.61050988e-04 4.99330639e-05 -7.05872723e-13 1.03993929e-03 -1.74594580e-13] Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.15532481e-10 1.68849533e-02 -2.27448547e-08] [-7.23858279e-10 -1.68849534e-02 4.79805819e-08] [-1.05534338e-02 -3.58457819e-09 1.31847849e-09] [-7.96574223e-04 3.90471959e-03 -1.01143083e-02] [-7.96599702e-04 -3.90470519e-03 1.01143193e-02] [ 1.05534340e-02 -1.22259886e-08 -5.38691320e-09] [ 7.96596825e-04 -3.90470632e-03 -1.01143189e-02] [ 7.96586467e-04 3.90471244e-03 1.01143128e-02] [ 4.73201231e-04 -6.99378153e-03 5.77243665e-03] [-4.73206098e-04 6.99378036e-03 5.77239086e-03] [ 4.73199879e-04 6.99378754e-03 -5.77243720e-03] [-4.73203623e-04 -6.99379090e-03 -5.77241636e-03]] Final stress: [-4.58606656e-04 3.14403662e-04 -2.70757355e-05 8.69358188e-12 -6.18443420e-12 3.47460662e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-8.84458284e-10 -9.04143802e-04 1.30074865e-08] [-1.30804623e-09 9.04144445e-04 -2.81066038e-08] [ 4.11977376e-04 -4.17101244e-08 1.74868502e-08] [ 5.54407718e-05 -1.04022758e-04 5.14998523e-04] [ 5.53645939e-05 1.04066683e-04 -5.14961879e-04] [-4.11978238e-04 -4.97959514e-08 -2.02566311e-08] [-5.53461692e-05 1.04077846e-04 5.14953934e-04] [-5.53950190e-05 -1.04049155e-04 -5.14978147e-04] [-1.44250335e-04 -8.51077602e-05 2.66378188e-05] [ 1.44222093e-04 8.51245385e-05 2.66055290e-05] [-1.44255352e-04 8.51282464e-05 -2.65834556e-05] [ 1.44222471e-04 -8.51267781e-05 -2.66544549e-05]] Final stress: [6.23471730e-05 4.31750867e-05 1.58752239e-04 5.19480068e-11 1.60970217e-11 4.74526684e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.11721640e-10 -1.96438505e-03 -2.41917770e-08] [ 2.78804813e-10 1.96438374e-03 2.24138779e-07] [ 1.17010107e-03 8.68295469e-08 -3.54459938e-08] [-5.11761767e-05 3.62666437e-05 1.24999008e-03] [-5.10709885e-05 -3.63279337e-05 -1.25004123e-03] [-1.17010018e-03 -2.71685947e-08 -1.15045972e-08] [ 5.11551756e-05 -3.62782660e-05 1.25000040e-03] [ 5.10858588e-05 3.63179850e-05 -1.25003317e-03] [-3.78426702e-04 -1.10543257e-04 -1.30660677e-04] [ 3.78424478e-04 1.10524236e-04 -1.30755364e-04] [-3.78423676e-04 1.10531155e-04 1.30603991e-04] [ 3.78430655e-04 -1.10548919e-04 1.30742962e-04]] Final stress: [ 8.71638783e-05 -6.34578138e-06 -8.32485008e-05 -5.10046122e-12 -3.14069014e-11 2.62779759e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.67752265e-10 2.49595000e-02 -1.16758967e-08] [-1.45294134e-10 -2.49595002e-02 3.25261924e-09] [-2.22986403e-02 -1.85535500e-08 7.79213843e-09] [ 1.16747619e-02 3.41383169e-03 -1.33904563e-02] [ 1.16747225e-02 -3.41380902e-03 1.33904751e-02] [ 2.22986402e-02 -1.61442301e-08 -6.73957426e-09] [-1.16747252e-02 -3.41381051e-03 -1.33904737e-02] [-1.16747511e-02 3.41382538e-03 1.33904611e-02] [ 1.13362334e-02 4.54233275e-03 1.46318446e-04] [-1.13362374e-02 -4.54233315e-03 1.46287254e-04] [ 1.13362329e-02 -4.54233146e-03 -1.46293805e-04] [-1.13362365e-02 4.54232919e-03 -1.46310645e-04]] Final stress: [-1.44520676e-03 4.04741727e-04 1.91165562e-04 6.34154245e-12 -8.92822215e-12 1.07268334e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.42792675e-09 1.66184834e-03 -6.73880982e-08] [ 3.49122771e-09 -1.66184791e-03 4.45471800e-07] [-8.50464541e-04 1.14764230e-07 -4.77185377e-08] [ 3.68501761e-04 3.63114485e-04 -8.56075599e-04] [ 3.68792052e-04 -3.63280951e-04 8.55940313e-04] [ 8.50468411e-04 -6.52194500e-08 -2.66899577e-08] [-3.68652294e-04 -3.63200530e-04 -8.56007321e-04] [-3.68834613e-04 3.63304950e-04 8.55923785e-04] [ 7.10394733e-04 -2.86510467e-05 -1.53207998e-04] [-7.10301583e-04 2.86342168e-05 -1.53411037e-04] [ 7.10403985e-04 2.86128553e-05 1.53127404e-04] [-7.10313828e-04 -2.85839602e-05 1.53406778e-04]] Final stress: [-8.89723452e-05 -8.44280564e-06 -1.34822599e-04 -1.52188866e-10 1.10371407e-11 -1.84745734e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.26664656e-02 -2.24197727e-02 -2.57265450e-04] [-1.26664656e-02 2.24197727e-02 2.57263962e-04] [-2.21281500e-03 -6.87033834e-10 2.78591318e-10] [-3.69897369e-04 -2.43221706e-04 1.01049720e-02] [-3.69898384e-04 2.43222284e-04 -1.01049715e-02] [ 2.41127301e-02 3.11024062e-10 1.25579948e-10] [ 4.88706484e-03 -1.00946611e-02 -3.00021038e-02] [ 4.88706540e-03 1.00946607e-02 3.00021041e-02] [-6.92607928e-04 1.86951042e-02 -2.23817234e-02] [-2.10805131e-03 1.75169623e-03 -2.21730432e-02] [-6.92607898e-04 -1.86951042e-02 2.23817238e-02] [-2.10805133e-03 -1.75169612e-03 2.21730432e-02]] Final stress: [ 9.30600866e-05 -2.50036268e-04 5.21814906e-04 -1.39974535e-03 7.92500512e-14 -1.00187982e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.26620873e-02 -2.24119586e-02 2.57430518e-04] [ 1.26620873e-02 2.24119586e-02 -2.57429671e-04] [-2.41077511e-02 1.06003561e-09 -4.24031806e-10] [-4.88623340e-03 1.00930120e-02 -2.99934586e-02] [-4.88623144e-03 -1.00930132e-02 2.99934577e-02] [ 2.21074813e-03 2.22861635e-10 9.64880359e-11] [ 3.71010682e-04 2.44116572e-04 1.01012746e-02] [ 3.71010894e-04 -2.44116697e-04 -1.01012744e-02] [ 2.10697077e-03 -1.74915227e-03 -2.21671399e-02] [ 6.94664989e-04 -1.86854214e-02 -2.23753959e-02] [ 2.10697082e-03 1.74915217e-03 2.21671392e-02] [ 6.94664962e-04 1.86854215e-02 2.23753969e-02]] Final stress: [ 9.30455889e-05 -2.49928660e-04 5.21636828e-04 1.39932371e-03 -6.04909172e-14 -2.84048886e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.39638976e-03 1.83402476e-02 1.11382497e-04] [-8.39638976e-03 -1.83402476e-02 -1.11382246e-04] [ 3.40738621e-02 -4.87380196e-10 1.96334554e-10] [-2.14403205e-03 -1.21041496e-02 2.17558830e-02] [-2.14403242e-03 1.21041498e-02 -2.17558828e-02] [-6.38133730e-03 -5.48890406e-10 -2.24107093e-10] [ 2.31154376e-03 -3.55625572e-03 -7.34625945e-03] [ 2.31154298e-03 3.55625617e-03 7.34625907e-03] [-1.52671434e-03 -3.34499499e-03 1.01480543e-02] [-4.09066938e-03 1.21203436e-02 1.00379510e-02] [-1.52671436e-03 3.34499508e-03 -1.01480538e-02] [-4.09066943e-03 -1.21203433e-02 -1.00379515e-02]] Final stress: [ 2.67288043e-04 3.59863741e-04 5.37343992e-05 -1.05281166e-03 2.80528960e-13 -3.64070079e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.39638979e-03 1.83402477e-02 -1.11380736e-04] [ 8.39638977e-03 -1.83402477e-02 1.11383421e-04] [ 6.38133732e-03 6.03458807e-10 -2.50557574e-10] [-2.31154342e-03 3.55625592e-03 -7.34625931e-03] [-2.31154340e-03 -3.55625595e-03 7.34625926e-03] [-3.40738621e-02 -8.41137773e-10 -3.57432411e-10] [ 2.14403279e-03 1.21041501e-02 2.17558826e-02] [ 2.14403128e-03 -1.21041492e-02 -2.17558834e-02] [ 4.09066962e-03 -1.21203436e-02 1.00379510e-02] [ 1.52671431e-03 3.34499477e-03 1.01480537e-02] [ 4.09066963e-03 1.21203435e-02 -1.00379512e-02] [ 1.52671445e-03 -3.34499533e-03 -1.01480548e-02]] Final stress: [ 2.67288043e-04 3.59863743e-04 5.37343995e-05 1.05281166e-03 -3.48989767e-13 1.10081404e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.67631284e-12 -7.81962451e-03 7.51283716e-10] [-1.60310597e-11 3.34218670e-02 -2.52890919e-09] [-1.13348409e-02 -5.76933071e-03 2.61515478e-02] [ 8.85206666e-03 -9.43473920e-04 -2.03933147e-02] [-1.26415953e-02 -9.47793591e-03 1.98392687e-03] [ 1.13348409e-02 -5.76933153e-03 -2.61515481e-02] [ 1.26415958e-02 -9.47793562e-03 -1.98392703e-03] [-8.85206667e-03 -9.43473891e-04 2.03933148e-02] [ 1.24042371e-02 1.31481738e-02 -1.70075335e-02] [ 7.89480807e-03 -9.75855421e-03 -2.73222244e-02] [-7.89480838e-03 -9.75855405e-03 2.73222270e-02] [-1.24042372e-02 1.31481735e-02 1.70075331e-02]] Final stress: [-1.78527538e-05 -1.39766176e-04 5.16847737e-04 9.39420169e-14 -1.37870933e-03 9.41650586e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.94372925e-11 -3.34166682e-02 -1.86638142e-10] [-1.88776303e-11 7.81757547e-03 -8.41947522e-10] [-1.13300669e-02 5.77054247e-03 -2.61487530e-02] [-1.26426230e-02 9.47171957e-03 -1.98549960e-03] [ 8.84839195e-03 9.44152695e-04 2.03913764e-02] [ 1.13300669e-02 5.77054312e-03 2.61487533e-02] [-8.84839126e-03 9.44153099e-04 -2.03913767e-02] [ 1.26426238e-02 9.47171909e-03 1.98549997e-03] [-7.89477018e-03 9.75830876e-03 -2.73194576e-02] [-1.24028020e-02 -1.31451773e-02 -1.70045859e-02] [ 1.24028013e-02 -1.31451777e-02 1.70045866e-02] [ 7.89476941e-03 9.75830886e-03 2.73194576e-02]] Final stress: [-1.78012933e-05 -1.39753885e-04 5.16779795e-04 1.26091970e-12 1.37854523e-03 -1.14953951e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-7.36927462e-12 2.69595810e-02 3.92382264e-10] [-4.87684577e-12 -1.06594355e-02 7.53118222e-10] [ 2.04172715e-02 7.52222305e-03 1.48088935e-02] [ 2.78812168e-03 -1.47319347e-02 -3.14795945e-03] [-6.40696048e-03 -6.00538333e-03 -1.58236876e-02] [-2.04172715e-02 7.52222243e-03 -1.48088937e-02] [ 6.40696124e-03 -6.00538288e-03 1.58236872e-02] [-2.78812208e-03 -1.47319344e-02 3.14795925e-03] [ 6.26727040e-03 -3.46488410e-03 7.17656763e-03] [ 2.54263539e-03 8.52990634e-03 1.28437376e-02] [-2.54263558e-03 8.52990626e-03 -1.28437379e-02] [-6.26727057e-03 -3.46488412e-03 -7.17656763e-03]] Final stress: [ 2.02098268e-04 4.09053160e-04 4.90900850e-05 3.34095598e-13 -1.04123713e-03 -1.72230009e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.36813995e-11 1.06546148e-02 1.15056521e-10] [-1.56883083e-11 -2.69506738e-02 1.08599943e-09] [ 2.04066107e-02 -7.52029266e-03 -1.48048719e-02] [-6.40039542e-03 6.00577261e-03 1.58215161e-02] [ 2.78655743e-03 1.47252265e-02 3.14685891e-03] [-2.04066107e-02 -7.52029291e-03 1.48048718e-02] [-2.78655690e-03 1.47252268e-02 -3.14685918e-03] [ 6.40039564e-03 6.00577248e-03 -1.58215161e-02] [-2.54258499e-03 -8.52606623e-03 1.28430563e-02] [-6.26372690e-03 3.46338937e-03 7.17583473e-03] [ 6.26372654e-03 3.46338930e-03 -7.17583562e-03] [ 2.54258464e-03 -8.52606635e-03 -1.28430563e-02]] Final stress: [2.01971796e-04 4.08897186e-04 4.89984985e-05 5.41436264e-13 1.04097660e-03 1.14829700e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 45 steps. Minimization converged after 46 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.14164639e-02 -2.88131905e-03 -7.66345401e-05] [-2.14164639e-02 2.88131908e-03 7.66351080e-05] [ 8.21433233e-02 2.03640010e-10 -7.06258094e-11] [-1.09357192e-02 -6.70280159e-02 4.32390672e-02] [-1.09357186e-02 6.70280155e-02 -4.32390675e-02] [ 1.02996031e-01 -3.29423936e-11 -3.77368683e-11] [-1.60950818e-02 -5.56630214e-02 -3.58426097e-02] [-1.60950818e-02 5.56630214e-02 3.58426097e-02] [-2.48433609e-02 5.32038844e-03 -2.50566683e-02] [-1.92790517e-02 1.79961700e-02 -2.49082151e-02] [-2.48433609e-02 -5.32038835e-03 2.50566681e-02] [-1.92790517e-02 -1.79961699e-02 2.49082152e-02]] Final stress: [-2.98173352e-04 -7.57457165e-04 9.73570786e-04 -3.16432982e-03 1.56836541e-13 -5.14629190e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.14226882e-02 -2.88267430e-03 7.66913905e-05] [ 2.14226882e-02 2.88267431e-03 -7.66918214e-05] [-1.03025781e-01 3.54871456e-11 1.49833819e-12] [ 1.60982881e-02 5.56833025e-02 -3.58504696e-02] [ 1.60982880e-02 -5.56833025e-02 3.58504697e-02] [-8.21717997e-02 7.79060148e-11 4.78098173e-11] [ 1.09411706e-02 6.70464954e-02 4.32505513e-02] [ 1.09411708e-02 -6.70464955e-02 -4.32505512e-02] [ 1.92846349e-02 -1.80007822e-02 -2.49216065e-02] [ 2.48520083e-02 -5.31881238e-03 -2.50701759e-02] [ 1.92846349e-02 1.80007823e-02 2.49216065e-02] [ 2.48520083e-02 5.31881226e-03 2.50701761e-02]] Final stress: [-2.98073061e-04 -7.57587156e-04 9.74121503e-04 3.16514034e-03 -1.44492430e-13 3.25562821e-13] Minimization converged after 42 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.85687544e-12 2.42770773e-02 3.03783069e-11] [-3.89978707e-12 1.85247027e-02 2.01238575e-10] [-4.81266771e-03 4.87516340e-02 4.54407558e-02] [ 6.64080080e-02 -6.46283676e-02 -2.67026537e-02] [-5.63372194e-02 -4.96109872e-02 -1.93061961e-02] [ 4.81266773e-03 4.87516339e-02 -4.54407559e-02] [ 5.63372194e-02 -4.96109872e-02 1.93061960e-02] [-6.64080081e-02 -6.46283675e-02 2.67026536e-02] [ 1.44316660e-02 2.83627493e-02 -2.51670135e-02] [ 8.87750398e-03 1.57240815e-02 -2.47307865e-02] [-8.87750392e-03 1.57240815e-02 2.47307864e-02] [-1.44316659e-02 2.83627493e-02 2.51670136e-02]] Final stress: [-7.57098443e-04 -2.98457183e-04 9.72197688e-04 2.95582602e-15 -3.16230585e-03 1.70289003e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 8.54592739e-12 -1.85222787e-02 8.37318687e-11] [ 9.32951595e-12 -2.42733063e-02 5.33378313e-11] [-4.81366032e-03 -4.87439621e-02 -4.54352644e-02] [-5.63277618e-02 4.96019237e-02 1.93042512e-02] [ 6.63981096e-02 6.46195809e-02 2.66989017e-02] [ 4.81366031e-03 -4.87439624e-02 4.54352643e-02] [-6.63981096e-02 6.46195809e-02 -2.66989017e-02] [ 5.63277616e-02 4.96019238e-02 -1.93042513e-02] [-8.87750986e-03 -1.57220750e-02 -2.47241740e-02] [-1.44301484e-02 -2.83576749e-02 -2.51602421e-02] [ 1.44301484e-02 -2.83576748e-02 2.51602421e-02] [ 8.87750995e-03 -1.57220751e-02 2.47241740e-02]] Final stress: [-7.57033670e-04 -2.98506939e-04 9.71923752e-04 -2.00469013e-13 3.16190231e-03 3.03027925e-13] Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 0.00637272 0.00055334 -0.00026466] [-0.00637272 -0.00055334 -0.00026466] [ 0.00361144 -0.00017449 -0.00681611] [-0.01190195 -0.00119108 -0.00070492] [-0.01001872 0.00543389 0.00777915] [-0.00361144 0.00017449 -0.00681611] [ 0.01190194 0.00119108 -0.00070492] [ 0.01001872 -0.00543389 0.00777915] [-0.00919549 -0.00016243 0.00070244] [ 0.00919549 0.00016243 0.00070243] [-0.00851749 -0.00539316 -0.00069589] [ 0.00851749 0.00539316 -0.00069589]] Final stress: [ 2.66863467e-04 1.45669339e-04 2.61299642e-04 -2.56537940e-12 2.59962835e-12 -2.45192196e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-0.00636985 0.00055356 0.00026462] [ 0.00636985 -0.00055356 0.00026461] [ 0.00361016 0.00017451 0.0068166 ] [-0.01002496 -0.00543985 -0.00778256] [-0.01190889 0.00119602 0.00070787] [-0.00361016 -0.00017453 0.00681659] [ 0.01002498 0.00543986 -0.00778257] [ 0.01190886 -0.00119601 0.00070785] [-0.00852434 0.00539498 0.00069561] [ 0.00852434 -0.00539498 0.0006956 ] [-0.00920275 0.00016102 -0.00070211] [ 0.00920275 -0.00016102 -0.00070213]] Final stress: [ 2.66841746e-04 1.45525062e-04 2.61257885e-04 -5.16679703e-12 -1.99064360e-12 2.45137885e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.20517450e-02 6.25593303e-04 1.50849569e-05] [-1.20517449e-02 -6.25593277e-04 1.50817837e-05] [-1.01453731e-02 -4.00548880e-05 -6.11929236e-03] [-2.96152736e-03 -1.25200131e-02 -3.48998242e-04] [-5.87494847e-04 1.66289047e-02 6.44808229e-03] [ 1.01453732e-02 4.00546713e-05 -6.11929245e-03] [ 2.96152534e-03 1.25200119e-02 -3.48997343e-04] [ 5.87495037e-04 -1.66289048e-02 6.44808237e-03] [-6.09340092e-03 7.05363311e-04 -6.41737526e-04] [ 6.09340192e-03 -7.05362762e-04 -6.41735516e-04] [-7.01680519e-03 -4.91091012e-03 6.46861575e-04] [ 7.01680584e-03 4.91091104e-03 6.46860458e-04]] Final stress: [-6.42248315e-04 -6.93243355e-04 -3.22052475e-04 -1.45287580e-12 1.09602005e-12 -4.17949063e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.20509245e-02 6.25578905e-04 -1.50824416e-05] [ 1.20509245e-02 -6.25578974e-04 -1.50823618e-05] [-1.01453803e-02 3.98884551e-05 6.11895033e-03] [-5.87525223e-04 -1.66293375e-02 -6.44796845e-03] [-2.96183085e-03 1.25196433e-02 3.49223677e-04] [ 1.01453804e-02 -3.98897078e-05 6.11894974e-03] [ 5.87527450e-04 1.66293387e-02 -6.44796955e-03] [ 2.96182706e-03 -1.25196411e-02 3.49221945e-04] [-7.01787131e-03 4.91003922e-03 -6.47288259e-04] [ 7.01787178e-03 -4.91004044e-03 -6.47289990e-04] [-6.09267823e-03 -7.06189752e-04 6.42168605e-04] [ 6.09267923e-03 7.06188883e-04 6.42166765e-04]] Final stress: [-6.42245185e-04 -6.93246129e-04 -3.22049316e-04 -1.40666770e-12 -1.71806541e-12 4.17941623e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.34455658e-02 -1.15862194e-02 -8.04515261e-04] [ 5.34455658e-02 1.15862194e-02 8.04515203e-04] [-1.40154583e-01 5.50117133e-11 -1.51551737e-11] [-1.22193509e-02 -8.06549622e-04 -1.09738721e-02] [-1.22193509e-02 8.06549609e-04 1.09738721e-02] [-2.24538511e-02 -5.11130653e-12 -7.27873144e-12] [-4.57992782e-02 5.90306336e-02 1.69868636e-02] [-4.57992781e-02 -5.90306337e-02 -1.69868636e-02] [ 3.19716182e-02 1.74225321e-01 -4.14223617e-03] [ 5.39056619e-02 2.23033508e-01 -4.58344605e-03] [ 3.19716182e-02 -1.74225321e-01 4.14223620e-03] [ 5.39056619e-02 -2.23033508e-01 4.58344607e-03]] Final stress: [-1.79582523e-03 -3.22987534e-03 8.91350057e-04 -3.95411369e-03 -5.94785529e-14 1.79329313e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.34455649e-02 -1.15862193e-02 8.04515215e-04] [-5.34455650e-02 1.15862193e-02 -8.04515238e-04] [ 2.24538504e-02 -3.75537150e-11 1.77725563e-11] [ 4.57992781e-02 -5.90306326e-02 1.69868630e-02] [ 4.57992779e-02 5.90306327e-02 -1.69868629e-02] [ 1.40154581e-01 5.57181241e-11 1.77573312e-11] [ 1.22193511e-02 8.06550153e-04 -1.09738715e-02] [ 1.22193511e-02 -8.06550152e-04 1.09738715e-02] [-5.39056617e-02 -2.23033509e-01 -4.58344594e-03] [-3.19716181e-02 -1.74225322e-01 -4.14223611e-03] [-5.39056616e-02 2.23033509e-01 4.58344596e-03] [-3.19716181e-02 1.74225322e-01 4.14223601e-03]] Final stress: [-1.79582521e-03 -3.22987531e-03 8.91350047e-04 3.95411366e-03 -1.89296672e-13 -2.43619255e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.32943814e-02 -2.25479789e-02 5.23648564e-04] [ 1.18162395e-02 -2.25612864e-02 -5.23668992e-04] [-7.85859941e-03 3.47716165e-02 2.76366390e-03] [ 3.60479616e-02 -9.51167638e-02 8.57460755e-03] [-3.37811404e-02 4.06875655e-02 -8.64845782e-03] [ 7.71084853e-02 4.23578101e-02 -1.88824664e-02] [-1.44730991e-02 -1.05797446e-06 -4.90087388e-04] [-6.82663486e-02 -1.14805864e-02 1.66828535e-02] [ 6.62621270e-02 4.95642294e-02 -6.82482216e-03] [ 2.19323297e-02 7.25207017e-02 -9.40372175e-03] [-8.31768493e-02 -5.57258236e-02 9.02827344e-03] [-3.89054878e-02 -3.24684261e-02 7.20017762e-03]] Final stress: [-0.00259748 -0.00259679 0.00098508 -0.00364331 -0.00364335 -0.00074201] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.18162497e-02 2.25612548e-02 5.23665065e-04] [ 3.32943082e-02 2.25479473e-02 -5.23645228e-04] [-7.85850990e-03 -3.47714340e-02 -2.76371910e-03] [-3.37809410e-02 -4.06874397e-02 8.64852193e-03] [ 3.60480100e-02 9.51167232e-02 -8.57460091e-03] [ 7.71084975e-02 -4.23576419e-02 1.88824677e-02] [-6.82661637e-02 1.14807221e-02 -1.66828905e-02] [-1.44729589e-02 1.16259521e-06 4.90107754e-04] [-8.31764564e-02 5.57251844e-02 -9.02824371e-03] [-3.89052787e-02 3.24678509e-02 -7.20016145e-03] [ 6.62614284e-02 -4.95639594e-02 6.82480527e-03] [ 2.19318149e-02 -7.25203702e-02 9.40369317e-03]] Final stress: [-0.00259748 -0.00259678 0.00098507 -0.00364331 0.00364334 0.00074201] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.32944179e-02 -2.25479945e-02 -5.23649830e-04] [-1.18162345e-02 -2.25613021e-02 5.23670301e-04] [-7.71084793e-02 4.23578942e-02 1.88824657e-02] [ 6.82664413e-02 -1.14805184e-02 -1.66828348e-02] [ 1.44731692e-02 -1.00605034e-06 4.90077127e-04] [ 7.85864398e-03 3.47717065e-02 -2.76363675e-03] [ 3.37812397e-02 4.06876281e-02 8.64842594e-03] [-3.60479375e-02 -9.51167840e-02 -8.57461087e-03] [ 3.89055923e-02 -3.24687124e-02 -7.20018572e-03] [ 8.31770447e-02 -5.57261422e-02 -9.02828791e-03] [-2.19325864e-02 7.25208674e-02 9.40373645e-03] [-6.62624756e-02 4.95643637e-02 6.82483032e-03]] Final stress: [-0.00259748 -0.00259679 0.00098508 0.00364331 -0.00364335 0.00074201] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.18162243e-02 2.25613338e-02 -5.23672209e-04] [-3.32944913e-02 2.25480261e-02 5.23651260e-04] [-7.71084671e-02 -4.23580625e-02 -1.88824645e-02] [ 1.44733103e-02 9.01247997e-07 -4.90056517e-04] [ 6.82666275e-02 1.14803819e-02 1.66827973e-02] [ 7.85873385e-03 -3.47718890e-02 2.76358154e-03] [-3.60478888e-02 9.51168248e-02 8.57461743e-03] [ 3.37814392e-02 -4.06877541e-02 -8.64836182e-03] [-2.19331027e-02 -7.25212001e-02 -9.40376600e-03] [-6.62631768e-02 -4.95646343e-02 -6.82484620e-03] [ 3.89058022e-02 3.24692891e-02 7.20020290e-03] [ 8.31774380e-02 5.57267830e-02 9.02831689e-03]] Final stress: [-0.00259748 -0.00259679 0.00098509 0.00364332 0.00364335 -0.00074202] Minimization converged after 65 steps. Minimization converged after 63 steps. Minimization converged after 64 steps. Minimization converged after 64 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.25794958e-13 -4.18744315e-02 -3.75681967e-11] [-1.14576694e-12 -6.50190750e-02 -7.62685113e-11] [-2.61891241e-02 1.17421016e-02 -1.75064147e-02] [-3.58203377e-03 2.01416036e-02 3.70826338e-03] [ 5.49181085e-02 1.07441311e-01 9.69485827e-03] [ 2.61891241e-02 1.17421017e-02 1.75064148e-02] [-5.49181086e-02 1.07441311e-01 -9.69485823e-03] [ 3.58203391e-03 2.01416035e-02 -3.70826332e-03] [ 2.09522060e-01 -1.87018338e-02 -6.07167970e-03] [ 1.87732608e-01 -6.71764296e-02 -2.65364085e-03] [-1.87732608e-01 -6.71764296e-02 2.65364085e-03] [-2.09522060e-01 -1.87018338e-02 6.07167967e-03]] Final stress: [-3.22875886e-03 -1.79694337e-03 8.91351169e-04 7.57725690e-14 -3.95410510e-03 2.79474403e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.29809391e-12 6.50181957e-02 2.47945718e-11] [ 3.12864262e-12 4.18737793e-02 6.86594726e-11] [-2.61889704e-02 -1.17425632e-02 1.75057746e-02] [ 5.49172027e-02 -1.07440193e-01 -9.69455235e-03] [-3.58155206e-03 -2.01412143e-02 -3.70798764e-03] [ 2.61889704e-02 -1.17425632e-02 -1.75057746e-02] [ 3.58155201e-03 -2.01412144e-02 3.70798767e-03] [-5.49172028e-02 -1.07440193e-01 9.69455232e-03] [-1.87733353e-01 6.71760658e-02 -2.65356681e-03] [-2.09522587e-01 1.87019177e-02 -6.07155537e-03] [ 2.09522587e-01 1.87019177e-02 6.07155532e-03] [ 1.87733353e-01 6.71760658e-02 2.65356679e-03]] Final stress: [-3.22873130e-03 -1.79692963e-03 8.91341954e-04 -1.04626273e-13 3.95407767e-03 -8.59212417e-14] Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 66 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.23234994e-10 4.67172256e-03 -1.51813442e-08] [ 1.53778879e-10 -4.67172211e-03 -9.76507755e-08] [-1.28773625e-03 5.28172588e-08 -2.21101957e-08] [-6.47271560e-04 1.77963859e-03 -3.03613443e-03] [-6.47165375e-04 -1.77969961e-03 3.03608381e-03] [ 1.28773583e-03 1.07608089e-07 4.51620059e-08] [ 6.47128951e-04 -1.77972099e-03 -3.03606555e-03] [ 6.47320643e-04 1.77961037e-03 3.03615823e-03] [ 8.93616146e-04 -3.40316817e-04 -1.25102561e-03] [-8.93620983e-04 3.40323705e-04 -1.25087655e-03] [ 8.93615526e-04 3.40319627e-04 1.25093919e-03] [-8.93622750e-04 -3.40315741e-04 1.25101069e-03]] Final stress: [-5.08198485e-05 2.19385738e-04 8.96681108e-05 9.24933199e-12 1.51193351e-11 -1.05652649e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.16723109e-09 -5.23198081e-03 -5.20224428e-08] [-9.08752851e-10 5.23198059e-03 -3.32391628e-07] [ 1.28441126e-03 -1.10981989e-07 4.66987710e-08] [ 6.28194781e-04 -1.65112316e-03 3.31224434e-03] [ 6.27962009e-04 1.65125690e-03 -3.31213335e-03] [-1.28441173e-03 6.32619559e-08 2.65970526e-08] [-6.28163719e-04 1.65113969e-03 3.31222914e-03] [-6.28026035e-04 -1.65121867e-03 -3.31216379e-03] [-1.13171687e-03 2.74178769e-04 9.55717326e-04] [ 1.13173256e-03 -2.74186292e-04 9.55814768e-04] [-1.13172042e-03 -2.74163231e-04 -9.55615487e-04] [ 1.13173790e-03 2.74163944e-04 -9.55781827e-04]] Final stress: [ 9.09421811e-05 -2.20542892e-04 -2.98154927e-05 -2.57736408e-11 -3.65548585e-12 7.73788768e-11] Minimization converged after 2 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.24941399e-10 1.96962758e-03 3.01205549e-08] [-2.14951779e-10 -1.96962751e-03 -1.53988177e-07] [-5.44411041e-04 -1.14152428e-08 5.69811784e-09] [-1.84364361e-04 5.87930044e-04 -1.26157646e-03] [-1.84391203e-04 -5.87914506e-04 1.26159096e-03] [ 5.44410216e-04 1.66909623e-08 7.94778709e-09] [ 1.84368569e-04 -5.87928122e-04 -1.26157800e-03] [ 1.84407795e-04 5.87905613e-04 1.26159839e-03] [ 4.57865987e-04 1.25586683e-04 1.91925355e-04] [-4.57875375e-04 -1.25583490e-04 1.92016214e-04] [ 4.57864420e-04 -1.25581042e-04 -1.91891947e-04] [-4.57874567e-04 1.25579473e-04 -1.91974289e-04]] Final stress: [-1.04599413e-05 1.04390908e-04 1.07905214e-04 1.54150545e-11 2.24630079e-12 2.01354339e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-5.62628610e-10 1.05897934e-03 -1.04391713e-08] [-1.10602638e-11 -1.05897945e-03 7.60043812e-08] [-2.09560941e-04 1.12543099e-08 -5.35185124e-09] [-1.52379288e-04 3.86297426e-04 -6.52184091e-04] [-1.52331158e-04 -3.86324873e-04 6.52160938e-04] [ 2.09561064e-04 1.01945907e-08 3.52000617e-09] [ 1.52370671e-04 -3.86302016e-04 -6.52179667e-04] [ 1.52354771e-04 3.86310777e-04 6.52172099e-04] [ 2.44413532e-04 7.08460245e-05 -1.09120333e-04] [-2.44421104e-04 -7.08455276e-05 -1.09148229e-04] [ 2.44417951e-04 -7.08644751e-05 1.09091038e-04] [-2.44424925e-04 7.08613176e-05 1.09144512e-04]] Final stress: [-1.77777897e-06 4.90737451e-05 -4.96526495e-05 1.24361708e-11 -1.98841229e-12 -7.14464812e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 5.76231479e-10 -5.01769043e-03 -2.77068875e-08] [-2.17153906e-10 5.01769049e-03 -5.50435843e-08] [-7.84384641e-03 -1.45845837e-08 6.02553102e-09] [ 1.23755415e-02 -3.71011769e-03 6.81964227e-03] [ 1.23755111e-02 3.71013502e-03 -6.81962808e-03] [ 7.84384650e-03 2.77183205e-08 1.14808381e-08] [-1.23755626e-02 3.71010535e-03 6.81965209e-03] [-1.23755077e-02 -3.71013682e-03 -6.81962611e-03] [ 3.58419266e-03 7.25518341e-03 -3.78846562e-03] [-3.58418386e-03 -7.25518516e-03 -3.78844382e-03] [ 3.58419171e-03 -7.25517966e-03 3.78846914e-03] [-3.58418332e-03 7.25518238e-03 3.78846538e-03]] Final stress: [-3.37045368e-04 -7.22273130e-04 -2.75325762e-05 -1.46162081e-11 -7.67130024e-14 1.31391525e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.16367973e-10 -1.05407211e-03 -1.53020738e-08] [-1.57810759e-09 1.05407003e-03 1.78271245e-07] [ 2.29625614e-04 -4.14511581e-09 2.93907176e-09] [ 6.34004166e-05 -3.60159222e-04 6.06446028e-04] [ 6.32677951e-05 3.60234233e-04 -6.06385440e-04] [-2.29625629e-04 -1.19526677e-07 -5.02368165e-08] [-6.32093114e-05 3.60270006e-04 6.06355800e-04] [-6.33995501e-05 -3.60159967e-04 -6.06449098e-04] [-3.08803434e-04 -3.72142218e-05 -7.25958539e-05] [ 3.08767293e-04 3.71917168e-05 -7.27953797e-05] [-3.08805439e-04 3.72237116e-05 7.26628421e-05] [ 3.08784140e-04 -3.72604982e-05 7.26454301e-05]] Final stress: [-4.98666762e-06 -5.46929795e-05 -8.14849772e-05 4.81555078e-11 -4.85028043e-11 1.63077505e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.14593016e-03 3.96714370e-03 1.00903469e-04] [-2.14593016e-03 -3.96714369e-03 -1.00902383e-04] [ 4.81428660e-03 2.98643765e-10 -1.18410302e-10] [ 1.68531809e-03 -2.48689227e-03 6.51559076e-03] [ 1.68531886e-03 2.48689185e-03 -6.51559110e-03] [ 7.49199544e-04 -5.00156178e-10 -1.98899318e-10] [-1.81612454e-03 -7.91725908e-04 -1.28733956e-03] [-1.81612509e-03 7.91726238e-04 1.28733929e-03] [ 5.36449459e-04 -7.41956815e-04 -4.70482720e-03] [-1.04145597e-03 2.09192687e-03 -4.63248266e-03] [ 5.36449412e-04 7.41956980e-04 4.70482713e-03] [-1.04145604e-03 -2.09192675e-03 4.63248257e-03]] Final stress: [-4.15561082e-05 8.25438775e-06 9.32698018e-05 -2.73842352e-04 3.29198719e-13 1.47100155e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.14555556e-03 3.96564440e-03 -1.00906799e-04] [ 2.14555557e-03 -3.96564438e-03 1.00909240e-04] [-7.50316347e-04 1.08502430e-10 -8.12206659e-11] [ 1.81601912e-03 7.93083540e-04 -1.28681456e-03] [ 1.81601998e-03 -7.93084016e-04 1.28681411e-03] [-4.81291867e-03 -2.06835420e-10 -9.95071873e-11] [-1.68570263e-03 2.48511525e-03 6.51513555e-03] [-1.68570287e-03 -2.48511510e-03 -6.51513571e-03] [ 1.04135509e-03 -2.08753934e-03 -4.63494902e-03] [-5.35609884e-04 7.42618838e-04 -4.70730152e-03] [ 1.04135506e-03 2.08753939e-03 4.63494803e-03] [-5.35609987e-04 -7.42618481e-04 4.70730085e-03]] Final stress: [-4.15521324e-05 8.28624092e-06 9.33209901e-05 2.73830507e-04 4.63460184e-13 -6.37248518e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.13526841e-02 -3.54403414e-02 1.58300029e-03] [-1.13526841e-02 3.54403414e-02 -1.58300022e-03] [ 7.15678931e-03 3.08465535e-10 -1.32921040e-10] [-1.92794505e-03 1.10712667e-02 1.55971081e-02] [-1.92794436e-03 -1.10712671e-02 -1.55971085e-02] [ 7.62952387e-02 4.06451392e-10 1.66676791e-10] [ 2.27473108e-03 -6.03706691e-02 -3.25822052e-02] [ 2.27473186e-03 6.03706687e-02 3.25822055e-02] [-2.33320443e-02 -2.94818339e-02 1.54206043e-02] [-7.38807230e-03 -1.03044379e-02 1.76920650e-02] [-2.33320443e-02 2.94818340e-02 -1.54206049e-02] [-7.38807233e-03 1.03044380e-02 -1.76920645e-02]] Final stress: [ 1.03784592e-03 2.07856412e-04 3.48793026e-04 -2.52152608e-03 9.67853087e-14 -5.26336817e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.13526842e-02 -3.54403414e-02 -1.58300050e-03] [ 1.13526842e-02 3.54403414e-02 1.58300031e-03] [-7.62952388e-02 -5.66992630e-10 2.32551138e-10] [-2.27473088e-03 6.03706693e-02 -3.25822051e-02] [-2.27473218e-03 -6.03706685e-02 3.25822057e-02] [-7.15678931e-03 -1.03174162e-10 -5.69685046e-11] [ 1.92794484e-03 -1.10712668e-02 1.55971082e-02] [ 1.92794456e-03 1.10712670e-02 -1.55971084e-02] [ 7.38807231e-03 1.03044379e-02 1.76920650e-02] [ 2.33320444e-02 2.94818339e-02 1.54206041e-02] [ 7.38807234e-03 -1.03044380e-02 -1.76920647e-02] [ 2.33320444e-02 -2.94818340e-02 -1.54206049e-02]] Final stress: [ 1.03784592e-03 2.07856412e-04 3.48793027e-04 2.52152608e-03 -2.10602980e-13 3.13751889e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.25497709e-12 6.17980824e-03 1.74369675e-10] [ 9.83849572e-12 -1.90429835e-03 1.01670418e-09] [ 2.11029006e-03 2.13802950e-03 4.02260042e-03] [ 2.45608283e-03 -3.26364772e-03 -1.47483209e-04] [ 1.07223731e-03 -1.47663686e-03 -5.24969520e-03] [-2.11029005e-03 2.13802948e-03 -4.02260045e-03] [-1.07223706e-03 -1.47663673e-03 5.24969507e-03] [-2.45608342e-03 -3.26364739e-03 1.47482923e-04] [ 1.51170871e-03 -1.06034474e-03 -5.42781167e-03] [-1.68593476e-04 1.52484462e-03 -3.90379852e-03] [ 1.68593700e-04 1.52484445e-03 3.90379776e-03] [-1.51170860e-03 -1.06034448e-03 5.42781170e-03]] Final stress: [-4.62533538e-05 1.23626746e-05 9.30985311e-05 -2.62607558e-13 -2.74551409e-04 -8.85877801e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.57816621e-12 1.90410863e-03 4.18942345e-10] [-3.88471508e-12 -6.17929995e-03 7.21813713e-11] [ 2.11089790e-03 -2.13829613e-03 -4.02253514e-03] [ 1.07163982e-03 1.47741554e-03 5.24969205e-03] [ 2.45672627e-03 3.26430615e-03 1.47388172e-04] [-2.11089790e-03 -2.13829680e-03 4.02253488e-03] [-2.45672606e-03 3.26430628e-03 -1.47388274e-04] [-1.07164002e-03 1.47741566e-03 -5.24969215e-03] [ 1.71043232e-04 -1.52433561e-03 -3.90552598e-03] [-1.50996557e-03 1.05850592e-03 -5.42949858e-03] [ 1.50996550e-03 1.05850612e-03 5.42949872e-03] [-1.71043179e-04 -1.52433582e-03 3.90552580e-03]] Final stress: [-4.62556253e-05 1.23804837e-05 9.31325563e-05 2.92663601e-14 2.74568316e-04 8.16739530e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 2.90499553e-12 -2.00882334e-02 -6.01927183e-10] [-2.81847959e-12 4.37344425e-02 4.00320899e-10] [-3.07186947e-02 1.70094796e-02 2.86431996e-02] [ 2.32489568e-02 4.63803590e-03 -2.76387426e-02] [-2.38552058e-02 -6.44315249e-02 -3.23585624e-03] [ 3.07186947e-02 1.70094802e-02 -2.86431994e-02] [ 2.38552051e-02 -6.44315253e-02 3.23585652e-03] [-2.32489563e-02 4.63803556e-03 2.76387428e-02] [-2.41792807e-02 1.32814233e-02 1.78785317e-02] [-1.55132073e-02 1.76794817e-02 1.53183628e-02] [ 1.55132073e-02 1.76794818e-02 -1.53183635e-02] [ 2.41792808e-02 1.32814232e-02 -1.78785315e-02]] Final stress: [ 7.79722095e-04 4.68775162e-04 3.47975439e-04 8.37764964e-15 -2.48717604e-03 3.15702849e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.88297149e-12 -4.37344425e-02 1.36559497e-10] [-5.51096886e-12 2.00882334e-02 -4.66060161e-10] [-3.07186947e-02 -1.70094796e-02 -2.86431996e-02] [-2.38552055e-02 6.44315251e-02 3.23585634e-03] [ 2.32489567e-02 -4.63803580e-03 2.76387426e-02] [ 3.07186947e-02 -1.70094797e-02 2.86431996e-02] [-2.32489566e-02 -4.63803578e-03 -2.76387427e-02] [ 2.38552057e-02 6.44315250e-02 -3.23585625e-03] [ 1.55132072e-02 -1.76794817e-02 1.53183630e-02] [ 2.41792807e-02 -1.32814233e-02 1.78785320e-02] [-2.41792808e-02 -1.32814233e-02 -1.78785315e-02] [-1.55132073e-02 -1.76794818e-02 -1.53183631e-02]] Final stress: [7.79722096e-04 4.68775162e-04 3.47975439e-04 2.62840097e-13 2.48717604e-03 3.03892134e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.78750587e-02 9.34489719e-03 -2.95524948e-05] [-1.78750591e-02 -9.34489772e-03 -2.95615227e-05] [ 9.85433880e-03 1.17770554e-02 -1.56433223e-02] [-9.29450151e-03 1.51249850e-03 -2.05489840e-03] [-2.12110009e-02 1.51250309e-03 1.77121457e-02] [-9.85433898e-03 -1.17770816e-02 -1.56433336e-02] [ 9.29453980e-03 -1.51247649e-03 -2.05491652e-03] [ 2.12109720e-02 -1.51248661e-03 1.77121318e-02] [ 3.82899681e-04 5.61572938e-03 7.85571855e-03] [-3.82905569e-04 -5.61573427e-03 7.85570004e-03] [-1.33692118e-02 -5.27596422e-03 -7.84004209e-03] [ 1.33692087e-02 5.27595742e-03 -7.84006918e-03]] Final stress: [ 3.17424261e-04 8.08947628e-04 3.24698508e-04 1.04714408e-11 -1.20991472e-11 -5.74992174e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.77081187e-02 9.26206390e-03 3.00284351e-05] [ 1.77081174e-02 -9.26206575e-03 3.00790905e-05] [ 9.70570868e-03 -1.14682780e-02 1.54284309e-02] [-2.09774862e-02 -1.55419846e-03 -1.75517334e-02] [-9.39802313e-03 -1.43959454e-03 2.10830963e-03] [-9.70570875e-03 1.14682967e-02 1.54284376e-02] [ 2.09775199e-02 1.55421802e-03 -1.75517484e-02] [ 9.39801998e-03 1.43959557e-03 2.10830810e-03] [-1.32866567e-02 5.33159428e-03 7.69967096e-03] [ 1.32866376e-02 -5.33160936e-03 7.69964172e-03] [ 2.17228039e-04 -5.46694055e-03 -7.71472175e-03] [-2.17238155e-04 5.46691825e-03 -7.71470296e-03]] Final stress: [ 3.13579680e-04 7.98987690e-04 3.20969447e-04 2.54201737e-11 -3.49902402e-11 5.70738822e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.39068612e-02 -6.40510806e-03 -7.32148324e-05] [-1.39068573e-02 6.40510983e-03 -7.29639927e-05] [-1.18270181e-03 5.26766435e-03 -1.31911499e-02] [-7.55442185e-03 -5.79965941e-03 6.85877521e-03] [-6.34894696e-03 1.88617972e-02 6.42481226e-03] [ 1.18270336e-03 -5.26756293e-03 -1.31911076e-02] [ 7.55430545e-03 5.79959226e-03 6.85882943e-03] [ 6.34898227e-03 -1.88618185e-02 6.42483130e-03] [-1.21701406e-02 6.17058266e-03 7.66700198e-03] [ 1.21701767e-02 -6.17059914e-03 7.66694431e-03] [-9.16711081e-03 -1.73732075e-03 -7.68646847e-03] [ 9.16715040e-03 1.73732255e-03 -7.68628973e-03]] Final stress: [ 1.70045923e-05 -5.64185664e-04 -1.08563238e-04 -7.88035659e-11 -1.39175192e-11 -4.00680023e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.38925266e-02 -6.39820536e-03 7.28188140e-05] [ 1.38925256e-02 6.39820417e-03 7.27321283e-05] [-1.16917395e-03 -5.26449152e-03 1.31735654e-02] [-6.35253178e-03 -1.88487065e-02 -6.42235296e-03] [-7.56176072e-03 5.78730972e-03 -6.84347715e-03] [ 1.16917357e-03 5.26436357e-03 1.31735106e-02] [ 6.35270745e-03 1.88488071e-02 -6.42243626e-03] [ 7.56160891e-03 -5.78722250e-03 -6.84355014e-03] [-9.13394926e-03 1.74290571e-03 7.74811996e-03] [ 9.13393084e-03 -1.74293177e-03 7.74805000e-03] [-1.21920139e-02 -6.19031333e-03 -7.72841454e-03] [ 1.21920099e-02 6.19028069e-03 -7.72856582e-03]] Final stress: [ 1.76966689e-05 -5.62871948e-04 -1.09396042e-04 5.21907486e-12 -3.63684236e-11 4.00069262e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.44609211e-10 -4.98568516e-03 -2.25180324e-08] [-1.05249737e-09 4.98568540e-03 -1.11252764e-07] [ 2.70620503e-03 -3.48712098e-08 1.44747326e-08] [-1.90873964e-04 -2.46756906e-04 3.21008694e-03] [-1.90935114e-04 2.46792136e-04 -3.21005771e-03] [-2.70620570e-03 3.01052068e-08 1.26700944e-08] [ 1.90889964e-04 2.46766069e-04 3.21007996e-03] [ 1.90955824e-04 -2.46803886e-04 -3.21004866e-03] [-1.13865059e-03 -2.76979994e-05 -9.62051352e-04] [ 1.13863420e-03 2.77058548e-05 -9.62009428e-04] [-1.13865240e-03 2.77055521e-05 9.62074265e-04] [ 1.13863425e-03 -2.77063007e-05 9.62032605e-04]] Final stress: [ 2.35747256e-04 -6.40834837e-05 8.58059252e-05 3.04174041e-11 5.84387031e-12 1.61854170e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.60293795e-10 5.00477358e-03 -1.16975782e-08] [-2.22806398e-10 -5.00477292e-03 1.03573504e-07] [-2.96121853e-03 4.53965487e-08 -2.04302862e-08] [ 9.33401450e-05 4.80892942e-04 -3.21797650e-03] [ 9.34583562e-05 -4.80960692e-04 3.21791838e-03] [ 2.96121889e-03 4.78819093e-08 1.89678107e-08] [-9.34339203e-05 -4.80946413e-04 -3.21793147e-03] [-9.33582244e-05 4.80902640e-04 3.21796629e-03] [ 9.43709298e-04 -4.86558892e-04 9.15492966e-04] [-9.43710283e-04 4.86568459e-04 9.15508042e-04] [ 9.43710382e-04 4.86554833e-04 -9.15595862e-04] [-9.43715530e-04 -4.86546816e-04 -9.15472264e-04]] Final stress: [-2.08929903e-04 7.83239893e-05 -2.97013866e-05 6.12928109e-12 1.89331866e-11 -5.41294654e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.32860445e-10 -1.98271396e-03 4.94649566e-08] [-6.42591924e-10 1.98271564e-03 -1.93640622e-07] [ 9.34845852e-04 -3.64543563e-08 1.60109434e-08] [-5.75042048e-05 -1.90920238e-04 1.25857592e-03] [-5.75401264e-05 1.90941288e-04 -1.25855586e-03] [-9.34846811e-04 -1.62605707e-08 -4.76423671e-09] [ 5.75142120e-05 1.90925724e-04 1.25857092e-03] [ 5.75446309e-05 -1.90942493e-04 -1.25855487e-03] [-5.09248217e-04 -1.81452744e-04 1.97084357e-04] [ 5.09247575e-04 1.81477757e-04 1.97185854e-04] [-5.09255978e-04 1.81484732e-04 -1.97023031e-04] [ 5.09243843e-04 -1.81462987e-04 -1.97150364e-04]] Final stress: [ 1.06134598e-04 -1.20417468e-05 1.07838163e-04 1.19397799e-11 3.92245936e-11 3.58092536e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-6.57606580e-10 -1.07023281e-03 3.57047870e-08] [-7.28764826e-10 1.07023364e-03 9.96969791e-08] [ 6.11649931e-04 4.79552842e-08 -1.98945455e-08] [-5.04184227e-05 -2.68954065e-05 6.58595606e-04] [-5.03236870e-05 2.68408689e-05 -6.58640522e-04] [-6.11650198e-04 -3.67191799e-08 -1.45878330e-08] [ 5.04082962e-05 2.68903564e-05 6.58600927e-04] [ 5.03758603e-05 -2.68712358e-05 -6.58616496e-04] [-2.50734777e-04 -7.87624918e-05 -1.15458311e-04] [ 2.50717514e-04 7.87792225e-05 -1.15470246e-04] [-2.50739039e-04 7.87795233e-05 1.15419930e-04] [ 2.50715908e-04 -7.87728982e-05 1.15468194e-04]] Final stress: [ 4.97060930e-05 -2.31083243e-06 -4.95108559e-05 3.41607759e-11 1.94620182e-11 2.22452909e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-6.22146334e-10 4.87295875e-03 -2.31146116e-08] [-3.25630314e-10 -4.87295880e-03 -2.17793366e-08] [-1.33312331e-02 -1.89544358e-09 9.64889085e-10] [-4.92447619e-03 -1.30169935e-02 -8.13049792e-03] [-4.92448839e-03 1.30170004e-02 8.13050362e-03] [ 1.33312329e-02 1.44529307e-08 6.15372452e-09] [ 4.92448130e-03 1.30169964e-02 -8.13049971e-03] [ 4.92451336e-03 -1.30170151e-02 8.13051506e-03] [-5.96427586e-03 -1.13600712e-02 -4.94294533e-03] [ 5.96426128e-03 1.13600744e-02 -4.94293838e-03] [-5.96427683e-03 1.13600752e-02 4.94294593e-03] [ 5.96426254e-03 -1.13600792e-02 4.94295450e-03]] Final stress: [-7.58244254e-04 -4.71492509e-04 -2.14898400e-05 2.30197305e-11 1.86363700e-14 1.87203796e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.12562745e-09 1.03278366e-03 -9.00103267e-08] [-8.27244481e-10 -1.03278712e-03 1.07339336e-07] [-5.48616963e-04 -3.14614543e-08 1.22438796e-08] [ 1.57060028e-04 1.62812717e-04 -5.73555630e-04] [ 1.56983997e-04 -1.62769097e-04 5.73589709e-04] [ 5.48616737e-04 5.00808844e-08 1.75104292e-08] [-1.56945323e-04 -1.62746346e-04 -5.73607922e-04] [-1.57015848e-04 1.62785070e-04 5.73574313e-04] [ 3.65785433e-04 2.64890538e-05 -7.56679338e-05] [-3.65837433e-04 -2.65278930e-05 -7.57935013e-05] [ 3.65806632e-04 -2.65751502e-05 7.56768583e-05] [-3.65834308e-04 2.65164874e-05 7.57370234e-05]] Final stress: [-5.41674771e-05 -4.19106068e-06 -8.11262243e-05 6.72426929e-11 -8.30486948e-11 -1.55661845e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.14779978e-03 -4.04276047e-03 -1.01223649e-04] [-2.14779979e-03 4.04276047e-03 1.01223410e-04] [-1.51084053e-04 1.06294503e-10 -4.92670612e-11] [-1.41658480e-03 -1.43319593e-03 1.34439337e-03] [-1.41658469e-03 1.43319587e-03 -1.34439344e-03] [ 5.65605536e-03 1.94826936e-10 8.42853356e-11] [ 1.49999475e-03 -1.70640935e-03 -6.52788977e-03] [ 1.49999544e-03 1.70640895e-03 6.52789010e-03] [-1.27349308e-03 2.04369579e-03 -4.61761774e-03] [ 5.85396884e-04 -6.03853007e-04 -4.68954107e-03] [-1.27349313e-03 -2.04369559e-03 4.61761743e-03] [ 5.85396891e-04 6.03852967e-04 4.68954133e-03]] Final stress: [ 1.29714155e-05 -4.70561316e-05 9.28240786e-05 -2.74027807e-04 1.30257953e-13 4.95272030e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.14770289e-03 -4.04298945e-03 1.01213967e-04] [ 2.14770290e-03 4.04298946e-03 -1.01214341e-04] [-5.66004111e-03 -1.07167811e-10 5.67886064e-11] [-1.50008445e-03 1.70900565e-03 -6.52812123e-03] [-1.50008421e-03 -1.70900578e-03 6.52812115e-03] [ 1.50431689e-04 -2.32533798e-10 -8.67258520e-11] [ 1.41679992e-03 1.43335555e-03 1.34449526e-03] [ 1.41679960e-03 -1.43335535e-03 -1.34449540e-03] [-5.85285928e-04 6.05344415e-04 -4.69153768e-03] [ 1.27567235e-03 -2.03962863e-03 -4.61962551e-03] [-5.85285953e-04 -6.05344380e-04 4.69153811e-03] [ 1.27567229e-03 2.03962886e-03 4.61962570e-03]] Final stress: [ 1.29889219e-05 -4.70638461e-05 9.28627471e-05 2.74070752e-04 2.44818987e-13 -4.34310511e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-1.18221645e-02 3.16179586e-02 -1.66009379e-03] [-1.18221645e-02 -3.16179586e-02 1.66009262e-03] [ 9.42128329e-02 -4.76539126e-10 1.96365341e-10] [-9.84492885e-03 -4.25021385e-02 3.78084991e-02] [-9.84492978e-03 4.25021390e-02 -3.78084986e-02] [-6.51605105e-03 8.64595189e-11 3.08958115e-11] [ 8.94444512e-03 -7.45742754e-03 -1.31764862e-02] [ 8.94444545e-03 7.45742734e-03 1.31764863e-02] [-1.11998748e-02 -1.76373940e-02 1.76568310e-02] [-1.99258676e-02 -2.20361559e-02 1.55432240e-02] [-1.11998748e-02 1.76373941e-02 -1.76568306e-02] [-1.99258676e-02 2.20361558e-02 -1.55432241e-02]] Final stress: [ 4.69762683e-04 7.79160812e-04 3.48131054e-04 -2.48751929e-03 1.62981091e-13 3.73116234e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.18221728e-02 3.16179011e-02 1.66009871e-03] [ 1.18221728e-02 -3.16179011e-02 -1.66009859e-03] [ 6.51597096e-03 1.33069826e-10 -5.80049990e-11] [-8.94443934e-03 7.45747345e-03 -1.31764663e-02] [-8.94443919e-03 -7.45747353e-03 1.31764662e-02] [-9.42125538e-02 -1.92887222e-11 -1.96733767e-12] [ 9.84491539e-03 4.25019765e-02 3.78085277e-02] [ 9.84491534e-03 -4.25019765e-02 -3.78085277e-02] [ 1.99257084e-02 2.20361900e-02 1.55432725e-02] [ 1.11999342e-02 1.76373618e-02 1.76568845e-02] [ 1.99257083e-02 -2.20361900e-02 -1.55432725e-02] [ 1.11999342e-02 -1.76373619e-02 -1.76568844e-02]] Final stress: [4.69762370e-04 7.79161190e-04 3.48130792e-04 2.48752120e-03 5.21379326e-14 1.31177601e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-4.36305215e-12 -1.81967146e-03 -4.23812363e-10] [-7.52996303e-12 6.13258149e-03 2.90241681e-10] [-2.83897637e-03 -2.53157425e-04 5.02960152e-03] [ 1.08225596e-03 -1.20762562e-03 -4.48085606e-03] [-3.97010272e-03 -1.43932030e-03 8.22544189e-04] [ 2.83897637e-03 -2.53157545e-04 -5.02960156e-03] [ 3.97010273e-03 -1.43932028e-03 -8.22544198e-04] [-1.08225563e-03 -1.20762580e-03 4.48085620e-03] [-1.69740212e-04 1.82099545e-03 -3.89552215e-03] [ 1.60138271e-03 -1.07734695e-03 -5.41640022e-03] [-1.60138292e-03 -1.07734685e-03 5.41639990e-03] [ 1.69740096e-04 1.82099528e-03 3.89552250e-03]] Final stress: [ 8.80440713e-06 -4.23369597e-05 9.29834954e-05 2.78846988e-13 -2.73554235e-04 5.12848141e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.41050439e-12 -6.13266557e-03 -1.64090267e-10] [ 1.43878614e-11 1.81980810e-03 6.66712126e-11] [-2.83961267e-03 2.52815249e-04 -5.02967397e-03] [-3.97061549e-03 1.44033117e-03 -8.22519291e-04] [ 1.08268958e-03 1.20773321e-03 4.48093457e-03] [ 2.83961268e-03 2.52815939e-04 5.02967422e-03] [-1.08268991e-03 1.20773301e-03 -4.48093443e-03] [ 3.97061525e-03 1.44033130e-03 8.22519186e-04] [-1.60081745e-03 1.07652898e-03 -5.41704975e-03] [ 1.71054674e-04 -1.82098024e-03 -3.89620109e-03] [-1.71054327e-04 -1.82098048e-03 3.89620089e-03] [ 1.60081764e-03 1.07652934e-03 5.41704975e-03]] Final stress: [ 8.80979087e-06 -4.23395769e-05 9.29962504e-05 -4.54191538e-13 2.73569748e-04 -1.23628258e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[-2.35093257e-12 4.67995170e-02 4.00565412e-11] [-1.53964370e-12 -2.40842470e-02 -5.70695157e-10] [ 5.41297165e-02 1.18387187e-02 2.84097597e-02] [ 1.85939286e-02 -4.56471137e-02 -4.71362349e-03] [-3.36595790e-02 -8.37458037e-03 -2.19654319e-02] [-5.41297165e-02 1.18387189e-02 -2.84097596e-02] [ 3.36595791e-02 -8.37458028e-03 2.19654318e-02] [-1.85939286e-02 -4.56471137e-02 4.71362349e-03] [-1.18421624e-02 2.48066389e-02 1.50744033e-02] [-2.79136491e-02 6.01870137e-03 1.80337841e-02] [ 2.79136490e-02 6.01870119e-03 -1.80337836e-02] [ 1.18421623e-02 2.48066391e-02 -1.50744033e-02]] Final stress: [ 2.08464378e-04 1.03653160e-03 3.48334884e-04 6.39470267e-14 -2.52025525e-03 -6.15632068e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 8 steps. Final forces: [[ 1.04754391e-11 2.40842470e-02 -1.86352861e-10] [ 4.52265489e-12 -4.67995170e-02 -6.30613278e-10] [ 5.41297165e-02 -1.18387188e-02 -2.84097596e-02] [-3.36595788e-02 8.37458047e-03 2.19654320e-02] [ 1.85939283e-02 4.56471139e-02 4.71362361e-03] [-5.41297165e-02 -1.18387184e-02 2.84097598e-02] [-1.85939292e-02 4.56471134e-02 -4.71362324e-03] [ 3.36595793e-02 8.37458019e-03 -2.19654318e-02] [ 2.79136492e-02 -6.01870129e-03 1.80337837e-02] [ 1.18421623e-02 -2.48066391e-02 1.50744035e-02] [-1.18421622e-02 -2.48066389e-02 -1.50744032e-02] [-2.79136490e-02 -6.01870139e-03 -1.80337839e-02]] Final stress: [ 2.08464378e-04 1.03653160e-03 3.48334884e-04 -2.35628926e-13 2.52025525e-03 4.86235892e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 7.53472202e-03 -3.51018231e-03 -3.02526133e-05] [-7.53472162e-03 3.51018219e-03 -3.02404133e-05] [ 3.13506930e-03 9.99440349e-03 -8.38355435e-03] [-6.47665056e-05 3.22754022e-03 4.87675412e-03] [-8.71080917e-03 1.95788235e-03 3.54395514e-03] [-3.13506912e-03 -9.99440945e-03 -8.38355696e-03] [ 6.47704120e-05 -3.22753804e-03 4.87675206e-03] [ 8.71079400e-03 -1.95787362e-03 3.54394811e-03] [-1.28480471e-03 4.55232579e-03 3.63630247e-03] [ 1.28480945e-03 -4.55232958e-03 3.63629058e-03] [-7.18568800e-03 4.25389859e-03 -3.64319886e-03] [ 7.18569394e-03 -4.25389963e-03 -3.64319927e-03]] Final stress: [ 3.48302816e-04 6.97540726e-05 8.24925262e-05 -8.91657230e-12 -3.79036957e-12 -1.74497857e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.54926650e-03 -3.51607786e-03 3.03173693e-05] [ 7.54926624e-03 3.51607756e-03 3.03666238e-05] [ 3.14387232e-03 -1.00211684e-02 8.40130661e-03] [-8.75316311e-03 -1.97170953e-03 -3.56102535e-03] [-8.25750399e-05 -3.22522540e-03 -4.87756270e-03] [-3.14387228e-03 1.00211529e-02 8.40130003e-03] [ 8.75318444e-03 1.97172214e-03 -3.56103542e-03] [ 8.25646333e-05 3.22523117e-03 -4.87756784e-03] [-7.22211726e-03 -4.26225897e-03 3.65037477e-03] [ 7.22211162e-03 4.26225904e-03 3.65034016e-03] [-1.30418003e-03 -4.56957396e-03 -3.64341300e-03] [ 1.30417498e-03 4.56957131e-03 -3.64340125e-03]] Final stress: [ 3.49389809e-04 6.97480811e-05 8.28297184e-05 8.00366818e-12 -2.37517788e-12 1.75036176e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.51450888e-02 8.15894161e-03 -7.20833183e-05] [-1.51450897e-02 -8.15893895e-03 -7.19984806e-05] [-7.15082934e-03 -7.57481067e-03 -8.90061990e-03] [-1.29743561e-02 -7.62247792e-03 -4.92892657e-03] [-2.30848507e-03 1.13143293e-02 1.39080835e-02] [ 7.15082959e-03 7.57480974e-03 -8.90061881e-03] [ 1.29743159e-02 7.62245559e-03 -4.92890774e-03] [ 2.30853962e-03 -1.13143607e-02 1.39081087e-02] [-8.56498828e-03 -6.53689985e-03 7.95040864e-03] [ 8.56498772e-03 6.53692767e-03 7.95039210e-03] [-5.95938706e-03 -1.17634229e-02 -7.95695092e-03] [ 5.95937387e-03 1.17634471e-02 -7.95688712e-03]] Final stress: [-4.83846822e-04 -7.46012663e-05 -1.07905410e-04 1.07118428e-11 4.92764350e-11 -5.83422495e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.51483716e-02 8.16059580e-03 7.21880797e-05] [ 1.51483750e-02 -8.16059482e-03 7.22245950e-05] [-7.15189151e-03 7.57431147e-03 8.90396545e-03] [-2.30754575e-03 -1.13152103e-02 -1.39108960e-02] [-1.29731160e-02 7.62221270e-03 4.92826435e-03] [ 7.15189277e-03 -7.57435785e-03 8.90394698e-03] [ 2.30749979e-03 1.13151835e-02 -1.39108765e-02] [ 1.29730573e-02 -7.62217775e-03 4.92823760e-03] [-5.95876068e-03 1.17648370e-02 7.95691730e-03] [ 5.95881533e-03 -1.17648309e-02 7.95688690e-03] [-8.56255535e-03 6.53764318e-03 -7.95043105e-03] [ 8.56260074e-03 -6.53761209e-03 -7.95042769e-03]] Final stress: [-4.83953841e-04 -7.45920282e-05 -1.07884742e-04 -8.59584107e-11 3.43467289e-11 5.83516718e-04] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.60896663e-02 -1.13625504e-03 -2.66219238e-05] [ 1.60896663e-02 1.13625504e-03 2.66219172e-05] [ 5.31299874e-02 -6.88053612e-11 3.62725108e-11] [-2.37033227e-02 1.08001514e-02 -1.70988427e-03] [-2.37033224e-02 -1.08001515e-02 1.70988418e-03] [-7.75374231e-03 1.55749773e-10 5.23773451e-11] [ 9.65437788e-03 -4.51382697e-02 3.36120755e-03] [ 9.65437816e-03 4.51382695e-02 -3.36120744e-03] [-1.36700175e-02 -1.10627175e-02 1.04861395e-02] [-1.10588268e-02 -6.45072307e-03 1.05236015e-02] [-1.36700174e-02 1.10627176e-02 -1.04861397e-02] [-1.10588269e-02 6.45072328e-03 -1.05236015e-02]] Final stress: [ 1.98255752e-03 1.82697367e-03 8.53851854e-04 -1.96905038e-03 9.94886748e-14 -3.74907953e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.60896540e-02 -1.13625395e-03 2.66222899e-05] [-1.60896540e-02 1.13625396e-03 -2.66220872e-05] [ 7.75352163e-03 2.69494926e-11 -1.42246075e-11] [-9.65467270e-03 4.51381359e-02 3.36106821e-03] [-9.65467252e-03 -4.51381360e-02 -3.36106829e-03] [-5.31301069e-02 2.10313177e-10 8.10965961e-11] [ 2.37029741e-02 -1.08001929e-02 -1.70974115e-03] [ 2.37029742e-02 1.08001928e-02 1.70974123e-03] [ 1.10592285e-02 6.45093796e-03 1.05233441e-02] [ 1.36704166e-02 1.10629308e-02 1.04858826e-02] [ 1.10592284e-02 -6.45093809e-03 -1.05233444e-02] [ 1.36704166e-02 -1.10629307e-02 -1.04858826e-02]] Final stress: [ 1.98255356e-03 1.82696972e-03 8.53854164e-04 1.96905091e-03 1.60273000e-13 -5.66788689e-13] Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.08419517e-12 -1.49551099e-02 -9.19330689e-12] [-1.36011585e-12 -1.72278777e-02 2.26826586e-10] [ 3.32724114e-02 1.69137004e-02 -2.97165841e-03] [ 2.00860547e-03 1.44329928e-02 5.95097536e-04] [-3.23646215e-02 -3.99854832e-02 2.24782199e-03] [-3.32724114e-02 1.69137002e-02 2.97165835e-03] [ 3.23646217e-02 -3.99854830e-02 -2.24782211e-03] [-2.00860555e-03 1.44329928e-02 -5.95097577e-04] [-7.45142127e-03 1.46699809e-02 1.04534766e-02] [-1.00628811e-02 1.00603030e-02 1.05598264e-02] [ 1.00628810e-02 1.00603029e-02 -1.05598265e-02] [ 7.45142122e-03 1.46699809e-02 -1.04534765e-02]] Final stress: [ 1.82723042e-03 1.98283437e-03 8.53995697e-04 2.02332795e-13 -1.96928489e-03 -2.24729887e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 7.00848470e-14 1.72278311e-02 2.16463067e-10] [-4.25708766e-12 1.49550709e-02 -1.98239801e-10] [ 3.32722215e-02 -1.69123988e-02 2.97108806e-03] [-3.23642260e-02 3.99860988e-02 -2.24754361e-03] [ 2.00838806e-03 -1.44320639e-02 -5.94805531e-04] [-3.32722215e-02 -1.69123990e-02 -2.97108813e-03] [-2.00838790e-03 -1.44320638e-02 5.94805465e-04] [ 3.23642260e-02 3.99860988e-02 2.24754360e-03] [ 1.00636258e-02 -1.00617073e-02 1.05589267e-02] [ 7.45217490e-03 -1.46713797e-02 1.04525766e-02] [-7.45217495e-03 -1.46713797e-02 -1.04525763e-02] [-1.00636259e-02 -1.00617074e-02 -1.05589268e-02]] Final stress: [1.82721659e-03 1.98282052e-03 8.54003789e-04 2.18180705e-13 1.96928677e-03 2.43559201e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 9.99456996e-03 5.51053371e-04 -6.13109115e-05] [-9.99456954e-03 -5.51053199e-04 -6.13077469e-05] [ 4.95663596e-03 -8.74497703e-04 -7.76046026e-03] [-1.40728523e-02 3.34287785e-04 -5.34504073e-04] [-1.00738983e-02 5.19653975e-03 8.35930305e-03] [-4.95663576e-03 8.74496644e-04 -7.76046060e-03] [ 1.40728436e-02 -3.34292865e-04 -5.34500144e-04] [ 1.00738954e-02 -5.19653790e-03 8.35930179e-03] [-1.00579099e-02 5.32735011e-04 1.56954977e-03] [ 1.00579160e-02 -5.32734446e-04 1.56954946e-03] [-8.52645373e-03 -5.06434684e-03 -1.57258152e-03] [ 8.52645865e-03 5.06435039e-03 -1.57257881e-03]] Final stress: [ 3.44494020e-04 2.16570965e-04 2.32774986e-04 -9.89662799e-12 3.62126535e-12 -2.92036542e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-9.98887564e-03 5.50933146e-04 6.12969078e-05] [ 9.98887589e-03 -5.50933330e-04 6.13260992e-05] [ 4.95865467e-03 8.77743464e-04 7.75608550e-03] [-1.00676253e-02 -5.19777742e-03 -8.35587379e-03] [-1.40758674e-02 -3.42598667e-04 5.35457489e-04] [-4.95865451e-03 -8.77764838e-04 7.75607651e-03] [ 1.00676411e-02 5.19778665e-03 -8.35588155e-03] [ 1.40758448e-02 3.42611720e-04 5.35446707e-04] [-8.52674959e-03 5.05717403e-03 1.57426594e-03] [ 8.52675278e-03 -5.05717514e-03 1.57423777e-03] [-1.00524897e-02 -5.38350951e-04 -1.57121844e-03] [ 1.00524930e-02 5.38351336e-04 -1.57121914e-03]] Final stress: [ 3.44610512e-04 2.16723325e-04 2.32798999e-04 -6.73085087e-12 -6.22364882e-13 2.92023548e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 8.26537174e-03 4.95331667e-04 -2.22095626e-05] [-8.26537178e-03 -4.95331767e-04 -2.21870721e-05] [-4.83576056e-03 1.28284611e-03 -5.20637316e-03] [-5.46733320e-03 -1.90579084e-03 2.03370588e-04] [ 5.31154024e-04 1.50676740e-02 5.02136290e-03] [ 4.83576061e-03 -1.28283326e-03 -5.20636800e-03] [ 5.46733025e-03 1.90578914e-03 2.03372146e-04] [-5.31150097e-04 -1.50676764e-02 5.02136493e-03] [-1.19685779e-02 6.47976614e-03 -1.60811483e-02] [ 1.19685763e-02 -6.47977028e-03 -1.60811543e-02] [ 2.64158230e-03 2.37203170e-03 1.60849773e-02] [-2.64158174e-03 -2.37203617e-03 1.60849926e-02]] Final stress: [-3.69130956e-04 -4.03779734e-04 1.10105383e-04 9.22084218e-14 -6.61919509e-12 -2.65583875e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-8.27231145e-03 4.95419449e-04 2.22022565e-05] [ 8.27231169e-03 -4.95419351e-04 2.21879150e-05] [-4.83493743e-03 -1.28022831e-03 5.20688513e-03] [ 5.32258643e-04 -1.50681893e-02 -5.02185492e-03] [-5.47007187e-03 1.90482737e-03 -2.03393015e-04] [ 4.83493747e-03 1.28022970e-03 5.20688568e-03] [-5.32263609e-04 1.50681864e-02 -5.02185273e-03] [ 5.47006818e-03 -1.90482514e-03 -2.03394615e-04] [ 2.64583393e-03 -2.37139736e-03 -1.60845196e-02] [-2.64582980e-03 2.37139589e-03 -1.60845122e-02] [-1.19735808e-02 -6.47970607e-03 1.60806862e-02] [ 1.19735851e-02 6.47970679e-03 1.60806800e-02]] Final stress: [-3.69089985e-04 -4.03735153e-04 1.10130587e-04 -7.00751673e-12 1.05027348e-13 2.65649844e-04] Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.09493335e-03 -1.34720312e-03 1.09346456e-04] [-2.39848276e-03 -1.34911581e-03 -1.09348833e-04] [ 3.02842500e-02 4.16921119e-02 1.63782091e-02] [ 4.45739390e-02 -1.12247252e-01 9.68901920e-03] [-4.81664903e-02 3.40233135e-02 -2.54864474e-02] [ 9.34734534e-02 4.66697619e-02 -2.46199647e-02] [ 1.16111552e-02 -5.01673325e-02 -5.56316680e-03] [-7.83902312e-02 -1.33571239e-02 2.96023591e-02] [ 9.85547763e-03 2.50694165e-02 -4.12174789e-04] [-6.19902878e-03 3.46698902e-02 -1.02886088e-03] [-3.78968522e-02 -6.64817732e-03 8.78482906e-04] [-2.18421234e-02 2.99171067e-03 5.62546588e-04]] Final stress: [-1.91006648e-03 -1.91001611e-03 -5.83743900e-05 -2.47893719e-03 -2.47894070e-03 -2.93950174e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.39849088e-03 1.34910821e-03 1.09347838e-04] [ 5.09492628e-03 1.34719552e-03 -1.09348294e-04] [ 3.02840493e-02 -4.16917997e-02 -1.63783023e-02] [-4.81660694e-02 -3.40231838e-02 2.54865704e-02] [ 4.45739549e-02 1.12247044e-01 -9.68904900e-03] [ 9.34733375e-02 -4.66694401e-02 2.46200489e-02] [-7.83898493e-02 1.33573240e-02 -2.96024763e-02] [ 1.16111251e-02 5.01670485e-02 5.56320239e-03] [-3.78972297e-02 6.64832426e-03 -8.78448604e-04] [-2.18424980e-02 -2.99156218e-03 -5.62510136e-04] [ 9.85562690e-03 -2.50697934e-02 4.12139379e-04] [-6.19888262e-03 -3.46702655e-02 1.02882572e-03]] Final stress: [-1.91006870e-03 -1.91001833e-03 -5.83766338e-05 -2.47893430e-03 2.47893780e-03 2.93950155e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.09491746e-03 -1.34718614e-03 -1.09347849e-04] [ 2.39850084e-03 -1.34909882e-03 1.09346125e-04] [-9.34731935e-02 4.66690455e-02 2.46201512e-02] [ 7.83893743e-02 -1.33575727e-02 -2.96026221e-02] [-1.16110848e-02 -5.01666992e-02 5.56324485e-03] [-3.02838012e-02 4.16914148e-02 -1.63784168e-02] [ 4.81655497e-02 3.40230235e-02 2.54867220e-02] [-4.45739739e-02 -1.12246787e-01 -9.68908549e-03] [ 2.18429596e-02 2.99137885e-03 -5.62466626e-04] [ 3.78976951e-02 -6.64850492e-03 -8.78403895e-04] [ 6.19870225e-03 3.46707277e-02 1.02878213e-03] [-9.85581084e-03 2.50702583e-02 4.12096377e-04]] Final stress: [-1.91007143e-03 -1.91002106e-03 -5.83794148e-05 2.47893071e-03 -2.47893421e-03 2.93950123e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.39848279e-03 1.34911581e-03 -1.09349937e-04] [-5.09493335e-03 1.34720314e-03 1.09347576e-04] [-9.34734534e-02 -4.66697620e-02 -2.46199647e-02] [-1.16111550e-02 5.01673326e-02 -5.56316674e-03] [ 7.83902316e-02 1.33571237e-02 2.96023589e-02] [-3.02842500e-02 -4.16921118e-02 1.63782092e-02] [-4.45739394e-02 1.12247252e-01 9.68901938e-03] [ 4.81664901e-02 -3.40233134e-02 -2.54864475e-02] [ 6.19902901e-03 -3.46698903e-02 -1.02886040e-03] [-9.85547792e-03 -2.50694164e-02 -4.12175224e-04] [ 2.18421237e-02 -2.99171066e-03 5.62545946e-04] [ 3.78968519e-02 6.64817736e-03 8.78483479e-04]] Final stress: [-1.91006648e-03 -1.91001610e-03 -5.83743900e-05 2.47893719e-03 2.47894070e-03 -2.93950174e-04] Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 65 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 68 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 68 steps. Minimization converged after 39 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-9.72609548e-10 1.28416553e-03 -6.51305194e-08] [ 4.03851660e-10 -1.28416559e-03 2.05877108e-07] [-3.59226648e-04 2.68419242e-08 -1.41049556e-08] [-4.84047362e-05 4.39864151e-04 -7.43699345e-04] [-4.82822917e-05 -4.39933900e-04 7.43638093e-04] [ 3.59227469e-04 7.53760506e-08 2.85387947e-08] [ 4.83227107e-05 -4.39910419e-04 -7.43659733e-04] [ 4.83734766e-05 4.39880172e-04 7.43682087e-04] [ 3.66736647e-04 5.64808851e-05 -1.29286613e-04] [-3.66741611e-04 -5.64808283e-05 -1.29348006e-04] [ 3.66747225e-04 -5.65248510e-05 1.29162331e-04] [-3.66751673e-04 5.65226292e-05 1.29356005e-04]] Final stress: [ 4.66345229e-06 6.55321087e-05 3.23767527e-05 8.42487993e-12 -6.55388054e-13 -1.79023859e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.51325002e-09 -1.40908308e-03 2.43226502e-08] [ 1.38939121e-09 1.40908370e-03 8.66104752e-08] [ 1.92712614e-04 2.48330453e-08 -1.24339644e-08] [ 1.92149567e-04 -5.27532504e-04 8.31112957e-04] [ 1.92144824e-04 5.27534622e-04 -8.31117098e-04] [-1.92711169e-04 1.41749070e-08 4.29544002e-09] [-1.92256567e-04 5.27470465e-04 8.31161935e-04] [-1.92151992e-04 -5.27529808e-04 -8.31118500e-04] [-3.61278642e-04 -4.08178607e-05 7.72703106e-05] [ 3.61335273e-04 4.08130950e-05 7.72746223e-05] [-3.61289465e-04 4.08617876e-05 -7.73750212e-05] [ 3.61341654e-04 -4.08394266e-05 -7.73120012e-05]] Final stress: [ 2.73438112e-06 -6.61735678e-05 -9.98682321e-06 -9.24055322e-11 1.42730730e-11 1.45915649e-10] Minimization converged after 2 steps. Minimization converged after 23 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-4.68253075e-11 -9.16663417e-03 2.49835189e-08] [ 3.39718365e-10 9.16663293e-03 2.63631974e-08] [ 5.63547209e-03 2.91298630e-08 -1.18039973e-08] [ 3.59247362e-04 1.57391949e-02 1.17348470e-02] [ 3.59243681e-04 -1.57391937e-02 -1.17348471e-02] [-5.63547196e-03 3.18315418e-09 6.94190334e-10] [-3.59244736e-04 -1.57391938e-02 1.17348461e-02] [-3.59253380e-04 1.57391991e-02 -1.17348511e-02] [-4.22798889e-03 -2.18836141e-02 -1.06826714e-02] [ 4.22798754e-03 2.18835945e-02 -1.06826680e-02] [-4.22798788e-03 2.18836058e-02 1.06826498e-02] [ 4.22799587e-03 -2.18836238e-02 1.06826545e-02]] Final stress: [ 1.36664816e-03 -1.02860572e-04 6.70420015e-04 -5.76048650e-12 -3.04532561e-11 4.09942879e-11] Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 1.99496331e-09 2.80512618e-04 6.13905815e-10] [ 1.80068190e-09 -2.80509880e-04 2.90357355e-07] [-1.05926768e-04 -9.54686752e-09 2.65911984e-09] [ 1.44517641e-04 1.32268100e-04 -8.27290699e-05] [ 1.44564695e-04 -1.32294487e-04 8.27065350e-05] [ 1.05928898e-04 -1.45391150e-07 -6.00398259e-08] [-1.44512110e-04 -1.32263614e-04 -8.27354067e-05] [-1.44686218e-04 1.32365082e-04 8.26493256e-05] [ 2.22032257e-04 8.47959332e-05 4.32050846e-05] [-2.21967740e-04 -8.47708852e-05 4.30026404e-05] [ 2.22021782e-04 -8.47534661e-05 -4.32014793e-05] [-2.21976234e-04 8.48055376e-05 -4.31312203e-05]] Final stress: [ 1.73043318e-05 2.81083974e-05 6.76329152e-05 -9.15802213e-11 6.43445277e-11 1.59153653e-11] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.64147631e-10 -4.47776317e-03 -3.52066791e-07] [ 1.71187537e-08 4.47774571e-03 3.27785259e-06] [ 7.90823418e-03 6.33919959e-07 -2.62704916e-07] [-2.63069272e-03 5.27299587e-03 2.52026547e-03] [-2.62996401e-03 -5.27341924e-03 -2.52062875e-03] [-7.90822270e-03 -6.70669052e-07 -2.89956028e-07] [ 2.63115284e-03 -5.27272010e-03 2.52004562e-03] [ 2.62943558e-03 5.27370505e-03 -2.52086860e-03] [-5.52284520e-04 -1.29831488e-03 -3.93887878e-04] [ 5.52242396e-04 1.29805554e-03 -3.95849461e-04] [-5.52213304e-04 1.29800851e-03 3.93547924e-04] [ 5.52294565e-04 -1.29825653e-03 3.95002550e-04]] Final stress: [ 6.39537760e-04 1.47698132e-04 2.75097599e-04 -8.73017491e-11 -3.88611009e-10 -2.12175567e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-3.99162009e-10 -4.48597303e-04 -4.94528785e-08] [-3.70032782e-10 4.48596534e-04 -1.89347933e-07] [ 9.30490274e-05 -6.05118806e-08 2.66962120e-08] [ 3.19092493e-05 -1.62787477e-04 2.65321688e-04] [ 3.17884736e-05 1.62856953e-04 -2.65261313e-04] [-9.30497250e-05 2.13211580e-08 9.77570476e-09] [-3.18442684e-05 1.62824346e-04 2.65291239e-04] [-3.18312603e-05 -1.62832070e-04 -2.65282167e-04] [-1.31919092e-04 -5.16896078e-05 -2.21744325e-05] [ 1.31906060e-04 5.16812808e-05 -2.21443560e-05] [-1.31916025e-04 5.16764579e-05 2.22766076e-05] [ 1.31908330e-04 -5.16899229e-05 2.21750634e-05]] Final stress: [-8.53706842e-06 -2.14530307e-05 -4.66568332e-05 1.75502703e-11 -1.79753785e-11 -9.90674289e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.46095966e-03 1.01925872e-02 2.26365138e-05] [-6.46095964e-03 -1.01925872e-02 -2.26343875e-05] [ 6.72212870e-03 1.57634988e-09 -6.37448231e-10] [ 1.97338676e-03 -4.28654960e-03 1.50676584e-02] [ 1.97338978e-03 4.28654787e-03 -1.50676598e-02] [ 5.82278061e-04 5.02260932e-10 2.08550300e-10] [ 1.14790143e-03 1.92046469e-03 -5.31820777e-03] [ 1.14790056e-03 -1.92046423e-03 5.31820743e-03] [-3.14063657e-03 1.41763674e-03 -1.00868961e-02] [ 2.82810346e-03 1.40067062e-02 -1.01572819e-02] [-3.14063631e-03 -1.41763768e-03 1.00868952e-02] [ 2.82810341e-03 -1.40067060e-02 1.01572829e-02]] Final stress: [-9.47497936e-05 -4.59594581e-05 1.92579992e-04 -6.55392454e-04 -6.89850641e-13 -2.17161280e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.46429600e-03 1.01973981e-02 -2.25122431e-05] [ 6.46429604e-03 -1.01973980e-02 2.25151777e-05] [-5.84409277e-04 7.94964097e-10 -3.49880318e-10] [-1.15108025e-03 -1.92263948e-03 -5.32188566e-03] [-1.15107574e-03 1.92263690e-03 5.32188360e-03] [-6.72588380e-03 -4.23443205e-10 -1.47844646e-10] [-1.97399797e-03 4.28988780e-03 1.50750546e-02] [-1.97399868e-03 -4.28988739e-03 -1.50750549e-02] [-2.82988355e-03 -1.40094706e-02 -1.01665997e-02] [ 3.14581059e-03 -1.41758185e-03 -1.00960213e-02] [-2.82988357e-03 1.40094706e-02 1.01665986e-02] [ 3.14581020e-03 1.41758359e-03 1.00960223e-02]] Final stress: [-9.48454909e-05 -4.60298304e-05 1.92740377e-04 6.55757465e-04 1.39072141e-12 -3.68327451e-12] Minimization converged after 42 steps. Minimization converged after 41 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.45607296e-11 1.69868273e-02 1.56439682e-09] [ 4.84154965e-11 -4.18103150e-03 -3.95752119e-10] [ 3.46196974e-03 3.09099046e-04 1.11454779e-02] [ 5.65096588e-04 -6.74216832e-03 -1.78430721e-03] [ 4.24832709e-04 -1.59593653e-04 -1.08337742e-02] [-3.46196974e-03 3.09099004e-04 -1.11454779e-02] [-4.24832811e-04 -1.59593749e-04 1.08337742e-02] [-5.65098694e-04 -6.74216711e-03 1.78430626e-03] [ 5.06034856e-03 -5.48930785e-03 -1.11205748e-02] [ 1.04564106e-02 5.67907210e-03 -9.05007820e-03] [-1.04564094e-02 5.67907182e-03 9.05007900e-03] [-5.06034764e-03 -5.48930707e-03 1.11205737e-02]] Final stress: [-1.19766938e-04 -2.13633784e-05 1.91697261e-04 -1.67439768e-12 -6.55360600e-04 -2.09210828e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.01600558e-11 4.17994608e-03 1.91806796e-10] [-2.03215443e-11 -1.69806464e-02 9.81527006e-10] [ 3.46222984e-03 -3.08818449e-04 -1.11411121e-02] [ 4.23527524e-04 1.57918065e-04 1.08288157e-02] [ 5.63397698e-04 6.74011068e-03 1.78417562e-03] [-3.46222985e-03 -3.08819257e-04 1.11411118e-02] [-5.63396428e-04 6.74011142e-03 -1.78417621e-03] [-4.23527671e-04 1.57918144e-04 -1.08288158e-02] [-1.04555706e-02 -5.67868806e-03 -9.04210708e-03] [-5.06160106e-03 5.48982807e-03 -1.11114090e-02] [ 5.06160052e-03 5.48982793e-03 1.11114086e-02] [ 1.04555700e-02 -5.67868818e-03 9.04210735e-03]] Final stress: [-1.19634041e-04 -2.13572253e-05 1.91547139e-04 8.70891301e-13 6.55036419e-04 -9.68749388e-15] Minimization converged after 35 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.47742577e-04 3.66356818e-04 -4.08615966e-06] [-7.47742568e-04 -3.66356786e-04 -4.06875995e-06] [ 4.19844212e-05 7.43310471e-05 -5.24095801e-04] [ 1.57408056e-05 5.87981220e-04 1.49779575e-04] [ 1.84356388e-04 -1.24333008e-04 3.78771481e-04] [-4.19844180e-05 -7.43250754e-05 -5.24093323e-04] [-1.57468320e-05 -5.87984575e-04 1.49782406e-04] [-1.84351284e-04 1.24329997e-04 3.78773940e-04] [ 3.76189977e-04 -1.00870046e-04 -3.12104482e-05] [-3.76189424e-04 1.00870201e-04 -3.12146087e-05] [ 2.04976911e-04 -6.38059083e-05 3.08247321e-05] [-2.04976553e-04 6.38061157e-05 3.08369662e-05]] Final stress: [ 2.00781179e-05 3.46333123e-05 2.46001806e-05 -3.62891016e-13 5.87569252e-13 -1.03984267e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.41288727e-04 3.62995174e-04 4.08584671e-06] [ 7.41288781e-04 -3.62995115e-04 4.06129918e-06] [ 4.68361625e-05 -7.40873369e-05 5.22297084e-04] [ 1.85886670e-04 1.31413931e-04 -3.75336357e-04] [ 1.98870449e-05 -5.90012924e-04 -1.51409659e-04] [-4.68361454e-05 7.40788814e-05 5.22293561e-04] [-1.85880600e-04 -1.31410568e-04 -3.75339295e-04] [-1.98937945e-05 5.90016972e-04 -1.51412954e-04] [ 2.05344858e-04 6.81852512e-05 -4.05202145e-05] [-2.05344502e-04 -6.81850026e-05 -4.05137815e-05] [ 3.86363465e-04 1.02212765e-04 4.09055784e-05] [-3.86363212e-04 -1.02212029e-04 4.08888918e-05]] Final stress: [ 2.02194403e-05 3.48180601e-05 2.48487990e-05 -1.35413084e-12 5.95468897e-13 1.03781137e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.01883245e-02 -4.94077162e-03 1.08629835e-05] [-1.01883246e-02 4.94077165e-03 1.08368931e-05] [-5.36452364e-03 -1.83815052e-04 -7.63255210e-03] [ 9.44894079e-04 -5.43269246e-03 6.44692117e-03] [ 5.38117158e-03 1.27155301e-02 1.17053902e-03] [ 5.36452358e-03 1.83779960e-04 -7.63256667e-03] [-9.44869094e-04 5.43270692e-03 6.44690907e-03] [-5.38119781e-03 -1.27155147e-02 1.17052630e-03] [-1.65696426e-03 -9.49594188e-04 1.96348608e-03] [ 1.65696570e-03 9.49596554e-04 1.96347774e-03] [-2.18852028e-03 -1.81656632e-03 -1.95920382e-03] [ 2.18852021e-03 1.81656916e-03 -1.95923666e-03]] Final stress: [-2.58061083e-04 -6.67558027e-04 -1.32998282e-04 2.15553767e-12 5.72185663e-12 -4.02334754e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.01888986e-02 -4.94112757e-03 -1.08778704e-05] [ 1.01888990e-02 4.94112777e-03 -1.08816423e-05] [-5.35310011e-03 2.43575058e-04 7.61172721e-03] [ 5.40673404e-03 -1.27476459e-02 -1.16825306e-03] [ 8.90731944e-04 5.44636982e-03 -6.42835349e-03] [ 5.35310017e-03 -2.43609003e-04 7.61171321e-03] [-5.40671418e-03 1.27476573e-02 -1.16826285e-03] [-8.90762793e-04 -5.44635194e-03 -6.42836815e-03] [-2.10751587e-03 1.88054478e-03 1.93884983e-03] [ 2.10752162e-03 -1.88054371e-03 1.93883151e-03] [-1.75439383e-03 9.25254028e-04 -1.94305142e-03] [ 1.75439863e-03 -9.25250671e-04 -1.94307328e-03]] Final stress: [-2.58674272e-04 -6.67615488e-04 -1.32841285e-04 -1.16345895e-11 5.33998283e-12 4.01805317e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.94266545e-09 -1.27855641e-03 -7.59331428e-08] [ 2.92703095e-09 1.27855419e-03 2.58340235e-07] [ 6.81184326e-04 7.70430519e-09 -4.40407247e-09] [ 2.99582095e-05 -8.39527750e-05 8.21775194e-04] [ 2.99562079e-05 8.39537886e-05 -8.21777170e-04] [-6.81181749e-04 -5.33792921e-09 -5.02614957e-09] [-2.99710894e-05 8.39450978e-05 8.21779343e-04] [-3.00801211e-05 -8.38834099e-05 -8.21832942e-04] [-2.42841058e-04 -1.15025835e-04 -1.15454388e-04] [ 2.42897955e-04 1.14978304e-04 -1.15639076e-04] [-2.42827675e-04 1.14971179e-04 1.15423050e-04] [ 2.42900125e-04 -1.14986497e-04 1.15553012e-04]] Final stress: [ 6.63063702e-05 6.14780857e-06 3.26798288e-05 -1.10363688e-10 -5.20584590e-11 -9.63269529e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.50714879e-09 1.37061464e-03 1.86202509e-08] [ 4.74055811e-09 -1.37061163e-03 2.48628529e-07] [-8.33528980e-04 3.58811605e-08 -1.85126911e-08] [ 1.71663438e-04 6.63250166e-05 -7.96566546e-04] [ 1.71881149e-04 -6.64487591e-05 7.96461648e-04] [ 8.33532511e-04 5.61767599e-09 9.78096340e-10] [-1.71902488e-04 -6.64627529e-05 -7.96457736e-04] [-1.71893270e-04 6.64575078e-05 7.96459642e-04] [ 3.96826919e-04 2.71372571e-05 9.22939766e-05] [-3.96696654e-04 -2.71248813e-05 9.22519684e-05] [ 3.96826715e-04 -2.71379765e-05 -9.24334763e-05] [-3.96717588e-04 2.72100776e-05 -9.22591904e-05]] Final stress: [-6.51939675e-05 2.76001983e-06 -1.00329172e-05 -2.00377008e-10 7.30225905e-11 -1.79503736e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 9.16549919e-10 -3.20569897e-04 3.01578662e-09] [-1.13182963e-10 3.20571328e-04 2.54416024e-07] [ 9.79300841e-05 5.59039659e-08 -2.49751394e-08] [ 2.11160455e-04 7.75000741e-05 2.50770576e-04] [ 2.11237432e-04 -7.75447612e-05 -2.50811970e-04] [-9.79290653e-05 -5.23876993e-08 -2.23891001e-08] [-2.11212710e-04 -7.75289009e-05 2.50794529e-04] [-2.11208661e-04 7.75277566e-05 -2.50797994e-04] [ 1.05100438e-04 -2.88360101e-05 -1.74632185e-05] [-1.05084455e-04 2.88538564e-05 -1.75602154e-05] [ 1.05087615e-04 2.88879956e-05 1.73593258e-05] [-1.05081936e-04 -2.88649587e-05 1.74988995e-05]] Final stress: [ 2.46285975e-05 2.20463069e-05 6.90142248e-05 -1.79591492e-11 3.45407707e-11 1.31109142e-10] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.21235699e-09 4.11234891e-03 -6.64019256e-07] [-5.84037027e-09 -4.11236085e-03 3.22826088e-06] [ 4.63254657e-03 8.27383178e-07 -3.34220477e-07] [-3.78136701e-03 6.27546374e-03 -2.30989679e-03] [-3.78014046e-03 -6.27617552e-03 2.30931896e-03] [-4.63252769e-03 -6.82522084e-07 -2.81230135e-07] [ 3.78130117e-03 -6.27549388e-03 -2.30986920e-03] [ 3.77971197e-03 6.27640740e-03 2.30912882e-03] [ 3.15937435e-04 4.17604946e-04 -7.64893600e-04] [-3.15741187e-04 -4.17829039e-04 -7.66780269e-04] [ 3.15993823e-04 -4.17826656e-04 7.64634474e-04] [-3.15714004e-04 4.17716079e-04 7.66408817e-04]] Final stress: [ 1.64604702e-04 6.04794633e-04 2.76668656e-04 -3.28723175e-10 -2.94546492e-10 -2.34860478e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.70085954e-10 4.38426335e-04 -3.99918549e-08] [ 4.67695119e-11 -4.38426443e-04 -2.08931393e-07] [-2.37225765e-04 -1.26706196e-07 5.16646131e-08] [ 4.75498691e-05 4.41086877e-05 -2.57989750e-04] [ 4.73400955e-05 -4.39874232e-05 2.58088884e-04] [ 2.37225120e-04 4.34785443e-08 1.68539422e-08] [-4.74708089e-05 -4.40636637e-05 -2.58027523e-04] [-4.74106215e-05 4.40287234e-05 2.58054647e-04] [ 1.37891327e-04 3.63782229e-05 -6.00291378e-06] [-1.37895482e-04 -3.63787843e-05 -5.97934962e-06] [ 1.37893295e-04 -3.63865383e-05 6.08591660e-06] [-1.37896805e-04 3.63841106e-05 5.95049387e-06]] Final stress: [-2.08490925e-05 -8.53960538e-06 -4.68052300e-05 6.23547341e-12 -2.61618630e-12 -2.83716677e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.40455849e-03 -1.05799063e-02 -2.54958067e-05] [-6.40455847e-03 1.05799062e-02 2.54958094e-05] [-1.80196285e-03 1.27081952e-09 -5.13322811e-10] [ 1.98087163e-03 5.79756175e-04 5.56144912e-03] [ 1.98087311e-03 -5.79757012e-04 -5.56144982e-03] [ 8.74338599e-03 1.45311736e-09 5.91899432e-10] [ 1.37941340e-03 -2.70228562e-03 -1.46855416e-02] [ 1.37941374e-03 2.70228541e-03 1.46855418e-02] [ 2.36633576e-03 1.33833414e-02 -1.01077090e-02] [-2.79277496e-03 2.17738275e-03 -1.00353707e-02] [ 2.36633602e-03 -1.33833427e-02 1.01077081e-02] [-2.79277490e-03 -2.17738317e-03 1.00353719e-02]] Final stress: [-2.04016025e-05 -1.20522590e-04 1.91420205e-04 -6.54483994e-04 -1.16501124e-12 -1.57970118e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.40772948e-03 -1.05849064e-02 2.53935289e-05] [ 6.40772946e-03 1.05849064e-02 -2.53894786e-05] [-8.74883814e-03 1.53178280e-09 -6.60492144e-10] [-1.37967729e-03 2.70381035e-03 -1.46924750e-02] [-1.37967481e-03 -2.70381179e-03 1.46924737e-02] [ 1.80202913e-03 -5.92682472e-10 -2.40581086e-10] [-1.98401339e-03 -5.80083428e-04 5.56493871e-03] [-1.98401270e-03 5.80083055e-04 -5.56493843e-03] [ 2.79687240e-03 -2.17792101e-03 -1.00443743e-02] [-2.36750816e-03 -1.33850129e-02 -1.01168946e-02] [ 2.79687217e-03 2.17792194e-03 1.00443721e-02] [-2.36750815e-03 1.33850128e-02 1.01168945e-02]] Final stress: [-2.04380612e-05 -1.20648155e-04 1.91578536e-04 6.54845916e-04 9.03011496e-13 2.15460829e-12] Minimization converged after 42 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.81084702e-11 -3.73040552e-03 -4.89170968e-10] [ 5.38560866e-12 1.66361639e-02 7.59998517e-10] [-4.87557144e-03 -2.31167488e-03 1.22980390e-02] [ 2.62941489e-03 -8.58098256e-04 -1.02675978e-02] [-1.62981806e-03 -3.91068834e-03 -5.85885637e-04] [ 4.87557143e-03 -2.31167528e-03 -1.22980392e-02] [ 1.62981633e-03 -3.91068933e-03 5.85886377e-04] [-2.62941442e-03 -8.58098536e-04 1.02675980e-02] [ 1.07223882e-02 6.62070078e-03 -9.06122560e-03] [ 4.79398936e-03 -5.99311777e-03 -1.11047152e-02] [-4.79398891e-03 -5.99311684e-03 1.11047141e-02] [-1.07223874e-02 6.62070008e-03 9.06122567e-03]] Final stress: [-4.65193358e-05 -9.44581180e-05 1.91484922e-04 -8.34460691e-13 -6.51690638e-04 3.50911863e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.74361094e-11 -1.66331252e-02 6.25593480e-11] [ 1.75223579e-11 3.72988118e-03 6.44342829e-10] [-4.87466698e-03 2.31149018e-03 -1.22955915e-02] [-1.62837784e-03 3.91022574e-03 5.86247995e-04] [ 2.62900491e-03 8.56803965e-04 1.02651408e-02] [ 4.87466700e-03 2.31149012e-03 1.22955915e-02] [-2.62900542e-03 8.56803673e-04 -1.02651406e-02] [ 1.62837744e-03 3.91022599e-03 -5.86248200e-04] [-4.79451292e-03 5.99317039e-03 -1.11002989e-02] [-1.07225294e-02 -6.62006833e-03 -9.05740191e-03] [ 1.07225298e-02 -6.62006816e-03 9.05740131e-03] [ 4.79451338e-03 5.99317046e-03 1.11002988e-02]] Final stress: [-4.65061518e-05 -9.44003546e-05 1.91413066e-04 -8.20544009e-13 6.51525721e-04 1.81420968e-13] Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.33018844e-04 -3.73723379e-04 -4.07904863e-06] [-7.33018806e-04 3.73723416e-04 -4.06644577e-06] [ 3.19402113e-04 -1.90044430e-04 -4.21859259e-04] [-7.59952274e-05 3.70274386e-04 5.06025892e-04] [ 3.28195813e-04 -2.73060955e-05 -7.97028808e-05] [-3.19402100e-04 1.90044199e-04 -4.21859342e-04] [ 7.59941865e-05 -3.70274865e-04 5.06026326e-04] [-3.28196212e-04 2.73063182e-05 -7.97030528e-05] [ 1.66870948e-04 -3.55057299e-04 -5.23120226e-05] [-1.66870120e-04 3.55057407e-04 -5.23178625e-05] [ 5.00545295e-05 -1.77667526e-04 5.19208352e-05] [-5.00539694e-05 1.77667869e-04 5.19268602e-05]] Final stress: [ 3.07761230e-05 2.29532899e-05 2.47415908e-05 -8.97020995e-13 7.73561686e-13 -1.18570566e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.24679789e-04 -3.69886605e-04 4.05426229e-06] [ 7.24679804e-04 3.69886677e-04 4.04068924e-06] [ 3.14053489e-04 1.88715919e-04 4.22105308e-04] [ 3.38560778e-04 3.21536155e-05 8.40391940e-05] [-6.23850741e-05 -3.72006867e-04 -5.10577649e-04] [-3.14053584e-04 -1.88722653e-04 4.22102534e-04] [-3.38556552e-04 -3.21511425e-05 8.40371260e-05] [ 6.23798776e-05 3.72009951e-04 -5.10580153e-04] [ 6.25517462e-05 1.80651151e-04 -5.28533952e-05] [-6.25510687e-05 -1.80650624e-04 -5.28508439e-05] [ 1.70357187e-04 3.58152591e-04 5.32465744e-05] [-1.70356814e-04 -3.58152010e-04 5.32363533e-05]] Final stress: [ 3.03699043e-05 2.28928288e-05 2.46462975e-05 -4.24571250e-13 1.12467414e-12 1.16694163e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.11463377e-02 5.72919299e-03 1.10669575e-05] [-1.11463377e-02 -5.72919333e-03 1.10397501e-05] [-9.56867265e-03 -1.19696475e-03 -7.53020201e-03] [ 7.88391841e-04 -4.84412962e-03 -1.42379206e-04] [ 4.72000981e-03 9.22055426e-03 7.65599330e-03] [ 9.56867257e-03 1.19695582e-03 -7.53020584e-03] [-7.88379140e-04 4.84413672e-03 -1.42385146e-04] [-4.72001869e-03 -9.22054909e-03 7.65598905e-03] [ 2.47481241e-03 -2.10912022e-03 1.91412590e-03] [-2.47481479e-03 2.10911900e-03 1.91413145e-03] [-1.22759605e-03 -5.08018634e-03 -1.90857707e-03] [ 1.22759473e-03 5.08018455e-03 -1.90859714e-03]] Final stress: [-7.05982292e-04 -2.31264320e-04 -1.32678474e-04 3.06067706e-12 -4.28817511e-12 -4.80060824e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.11308278e-02 5.72133768e-03 -1.10717999e-05] [ 1.11308283e-02 -5.72133757e-03 -1.11012681e-05] [-9.58731669e-03 1.21685352e-03 7.52556551e-03] [ 4.75041345e-03 -9.22937885e-03 -7.65032763e-03] [ 7.69298923e-04 4.80705286e-03 1.41361117e-04] [ 9.58731666e-03 -1.21683294e-03 7.52557402e-03] [-4.75043136e-03 9.22936837e-03 -7.65031902e-03] [-7.69291159e-04 -4.80705717e-03 1.41365120e-04] [-1.22297310e-03 5.05894334e-03 1.91129787e-03] [ 1.22297741e-03 -5.05894761e-03 1.91132296e-03] [ 2.46006885e-03 2.09904854e-03 -1.91683212e-03] [-2.46006350e-03 -2.09905017e-03 -1.91683475e-03]] Final stress: [-7.05908146e-04 -2.31302310e-04 -1.32751879e-04 -6.94886240e-12 -2.20343537e-12 4.79907632e-04] Minimization converged after 2 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.31027736e-02 -2.39059549e-03 -5.82006605e-05] [-2.31027736e-02 2.39059551e-03 5.82009423e-05] [ 7.99691787e-02 2.10624456e-10 -4.22890750e-11] [ 1.88900082e-03 -5.37346924e-02 4.71234188e-02] [ 1.88900106e-03 5.37346923e-02 -4.71234189e-02] [ 9.44137539e-02 8.55569118e-11 -8.29927917e-13] [-8.69753750e-04 -4.65163877e-02 -4.09100532e-02] [-8.69753745e-04 4.65163876e-02 4.09100533e-02] [-3.49612267e-02 1.58149052e-02 -2.81760774e-02] [-3.01467131e-02 2.63624812e-02 -2.80711561e-02] [-3.49612268e-02 -1.58149052e-02 2.81760772e-02] [-3.01467132e-02 -2.63624813e-02 2.80711561e-02]] Final stress: [-1.89037913e-04 -5.80184203e-04 9.03638186e-04 -2.82667472e-03 8.52631182e-14 1.55885253e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.31025093e-02 -2.39059998e-03 5.82011345e-05] [ 2.31025093e-02 2.39060000e-03 -5.82011798e-05] [-9.44151881e-02 -8.06810856e-11 5.18643890e-11] [ 8.71702390e-04 4.65197201e-02 -4.09090487e-02] [ 8.71702461e-04 -4.65197200e-02 4.09090487e-02] [-7.99721937e-02 -6.23352380e-11 -4.60300914e-12] [-1.88620682e-03 5.37366656e-02 4.71224947e-02] [-1.88620697e-03 -5.37366655e-02 -4.71224947e-02] [ 3.01455588e-02 -2.63594870e-02 -2.80698158e-02] [ 3.49601273e-02 -1.58118352e-02 -2.81747422e-02] [ 3.01455588e-02 2.63594870e-02 2.80698159e-02] [ 3.49601273e-02 1.58118352e-02 2.81747421e-02]] Final stress: [-1.88986249e-04 -5.80135006e-04 9.03644199e-04 2.82671552e-03 1.25004811e-13 -1.47830048e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.15623259e-02 -4.35385009e-03 -1.87223341e-04] [ 6.15623259e-02 4.35385012e-03 1.87223194e-04] [-6.95420834e-02 -1.57340180e-11 4.70528453e-11] [ 5.29434432e-02 3.27295884e-02 -7.50132967e-03] [ 5.29434432e-02 -3.27295884e-02 7.50132969e-03] [-1.26678707e-02 -1.72983935e-11 -3.96378718e-11] [ 3.45564017e-02 6.50807861e-02 1.12529252e-02] [ 3.45564017e-02 -6.50807862e-02 -1.12529253e-02] [-5.81479314e-02 -1.31486329e-02 4.21087940e-02] [-4.98092624e-02 4.76536949e-03 4.22763873e-02] [-5.81479314e-02 1.31486330e-02 -4.21087939e-02] [-4.98092625e-02 -4.76536951e-03 -4.22763873e-02]] Final stress: [-8.82782828e-04 -1.43593856e-03 -7.18194429e-04 -3.29408780e-03 2.63666870e-13 2.48262918e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.15635628e-02 -4.35404227e-03 1.87235709e-04] [-6.15635628e-02 4.35404229e-03 -1.87235652e-04] [ 1.26687696e-02 2.35002185e-11 1.07283682e-11] [-3.45575327e-02 -6.50819262e-02 1.12530733e-02] [-3.45575325e-02 6.50819260e-02 -1.12530734e-02] [ 6.95435225e-02 -1.50680872e-11 -2.64402235e-11] [-5.29444147e-02 -3.27309982e-02 -7.50133261e-03] [-5.29444146e-02 3.27309981e-02 7.50133267e-03] [ 4.98101686e-02 -4.76686494e-03 4.22791715e-02] [ 5.81491954e-02 1.31479093e-02 4.21115696e-02] [ 4.98101686e-02 4.76686504e-03 -4.22791715e-02] [ 5.81491954e-02 -1.31479091e-02 -4.21115695e-02]] Final stress: [-8.82760267e-04 -1.43594005e-03 -7.18211850e-04 3.29415025e-03 2.08343164e-13 -7.93540068e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.22671541e-11 2.54918952e-02 2.24758384e-10] [ 7.42793708e-12 2.07131239e-02 1.58578413e-10] [-2.68022363e-03 2.83409267e-02 5.06763576e-02] [ 5.37393963e-02 -6.32397292e-02 -2.86713393e-02] [-4.65964152e-02 -5.33100683e-02 -2.24521222e-02] [ 2.68022367e-03 2.83409266e-02 -5.06763577e-02] [ 4.65964152e-02 -5.33100682e-02 2.24521222e-02] [-5.37393964e-02 -6.32397291e-02 2.86713392e-02] [ 2.34927584e-02 3.78193022e-02 -2.82955204e-02] [ 1.86796245e-02 2.72870589e-02 -2.79491975e-02] [-1.86796246e-02 2.72870590e-02 2.79491974e-02] [-2.34927583e-02 3.78193022e-02 2.82955203e-02]] Final stress: [-5.80124948e-04 -1.89017712e-04 9.03639195e-04 -7.90617146e-14 -2.82670671e-03 7.79019987e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.54082847e-11 -2.07129697e-02 1.02548534e-10] [-1.96539346e-11 -2.54917461e-02 1.42251967e-11] [-2.67977912e-03 -2.83430784e-02 -5.06757418e-02] [-4.65980981e-02 5.33108515e-02 2.24517918e-02] [ 5.37406655e-02 6.32397367e-02 2.86710541e-02] [ 2.67977901e-03 -2.83430784e-02 5.06757418e-02] [-5.37406654e-02 6.32397367e-02 -2.86710542e-02] [ 4.65980982e-02 5.33108514e-02 -2.24517917e-02] [-1.86778881e-02 -2.72864332e-02 -2.79484126e-02] [-2.34910525e-02 -3.78187187e-02 -2.82947357e-02] [ 2.34910526e-02 -3.78187186e-02 2.82947355e-02] [ 1.86778880e-02 -2.72864332e-02 2.79484127e-02]] Final stress: [-5.80097582e-04 -1.88988962e-04 9.03641800e-04 -9.45602002e-14 2.82672964e-03 4.12820406e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-7.17455902e-12 -5.72105501e-02 1.34133332e-11] [-5.75732222e-13 -6.59161039e-02 -9.94508007e-11] [-1.53364232e-02 -7.19510029e-02 -1.11743338e-02] [-3.62926920e-02 -8.94441181e-03 3.18562181e-03] [ 6.16670292e-02 3.44999851e-02 6.94776998e-03] [ 1.53364233e-02 -7.19510028e-02 1.11743339e-02] [-6.16670294e-02 3.44999850e-02 -6.94776996e-03] [ 3.62926919e-02 -8.94441168e-03 -3.18562187e-03] [-2.88522472e-05 6.29103935e-02 4.17364631e-02] [-8.35228022e-03 4.50483629e-02 4.26529005e-02] [ 8.35228024e-03 4.50483630e-02 -4.26529005e-02] [ 2.88524140e-05 6.29103936e-02 -4.17364631e-02]] Final stress: [-1.43575715e-03 -8.82947682e-04 -7.18207688e-04 -4.55588365e-13 -3.29412814e-03 -5.19088825e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.06237463e-11 6.59150343e-02 9.60995200e-13] [-1.91145346e-11 5.72097680e-02 -4.58608348e-11] [-1.53366466e-02 7.19496679e-02 1.11742513e-02] [ 6.16660219e-02 -3.44995840e-02 -6.94769959e-03] [-3.62917818e-02 8.94464902e-03 -3.18566080e-03] [ 1.53366466e-02 7.19496679e-02 -1.11742514e-02] [ 3.62917818e-02 8.94464903e-03 3.18566083e-03] [-6.16660218e-02 -3.44995841e-02 6.94769966e-03] [ 8.35297901e-03 -4.50478388e-02 4.26507949e-02] [ 2.98178661e-05 -6.29092952e-02 4.17344024e-02] [-2.98179868e-05 -6.29092952e-02 -4.17344024e-02] [-8.35297902e-03 -4.50478388e-02 -4.26507949e-02]] Final stress: [-1.43575607e-03 -8.82964580e-04 -7.18194618e-04 1.26525093e-13 3.29408141e-03 -2.94468120e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.23294791e-03 1.24686210e-05 1.38739844e-05] [-1.23294792e-03 -1.24686204e-05 1.38836425e-05] [ 3.83653888e-04 -1.22590921e-04 -8.48088572e-04] [-6.32199845e-04 5.35371269e-04 3.40698763e-04] [-7.70506938e-05 1.15431769e-04 4.94375224e-04] [-3.83653867e-04 1.22591833e-04 -8.48088246e-04] [ 6.32199015e-04 -5.35371708e-04 3.40699086e-04] [ 7.70514390e-05 -1.15432226e-04 4.94375529e-04] [-7.41377472e-05 -2.75208292e-04 9.45782656e-06] [ 7.41378338e-05 2.75208236e-04 9.45368763e-06] [-2.38663880e-04 -3.64378889e-04 -1.03229578e-05] [ 2.38663865e-04 3.64378928e-04 -1.03179662e-05]] Final stress: [ 3.58388076e-05 3.37343626e-05 7.31151682e-05 -1.95333138e-13 2.03468453e-13 -3.08292216e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.24293307e-03 1.24966569e-05 -1.38889859e-05] [ 1.24293303e-03 -1.24967141e-05 -1.38593723e-05] [ 3.83818233e-04 1.05877301e-04 8.49971799e-04] [-9.98370924e-05 -9.52793829e-05 -4.95837126e-04] [-6.11809253e-04 -5.14193400e-04 -3.41126106e-04] [-3.83818128e-04 -1.05868216e-04 8.49975558e-04] [ 9.98305020e-05 9.52756982e-05 -4.95833949e-04] [ 6.11816814e-04 5.14188903e-04 -3.41122447e-04] [-2.56974753e-04 3.77920240e-04 1.79658289e-05] [ 2.56974153e-04 -3.77920601e-04 1.79574644e-05] [-5.80030486e-05 2.88209629e-04 -1.71110566e-05] [ 5.80026167e-05 -2.88210115e-04 -1.70916072e-05]] Final stress: [ 3.58822104e-05 3.37602633e-05 7.29960307e-05 7.24500314e-13 -7.06791560e-13 3.09960615e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 4.70057301e-04 -2.02243804e-04 1.39348410e-05] [-4.70058880e-04 2.02243134e-04 1.39013510e-05] [ 4.79221217e-03 2.52515611e-04 9.17542181e-04] [ 8.39268578e-03 1.01355384e-02 4.14147340e-03] [ 8.23075765e-03 -9.97140131e-03 -5.09676411e-03] [-4.79221285e-03 -2.52529259e-04 9.17536100e-04] [-8.39264084e-03 -1.01355124e-02 4.14145264e-03] [-8.23075980e-03 9.97140234e-03 -5.09676587e-03] [ 1.14957665e-02 -2.34960464e-03 1.07091837e-04] [-1.14957883e-02 2.34960327e-03 1.07092503e-04] [ 9.48952929e-03 1.67062766e-03 -8.32320428e-05] [-9.48954802e-03 -1.67063907e-03 -8.32628288e-05]] Final stress: [ 1.81267967e-04 3.81026275e-04 1.34440455e-04 3.56150964e-11 -1.01245082e-11 -2.43731747e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-4.79388426e-04 -2.02297692e-04 -1.39035760e-05] [ 4.79389362e-04 2.02297110e-04 -1.39270366e-05] [ 4.78983568e-03 -2.56898511e-04 -9.06347970e-04] [ 8.22893793e-03 9.97283794e-03 5.09164698e-03] [ 8.39900948e-03 -1.01314035e-02 -4.14750719e-03] [-4.78983542e-03 2.56913864e-04 -9.06342073e-04] [-8.22894438e-03 -9.97284218e-03 5.09165003e-03] [-8.39902743e-03 1.01314138e-02 -4.14751509e-03] [ 9.49880983e-03 -1.66343043e-03 7.54941733e-05] [-9.49880096e-03 1.66341710e-03 7.55057442e-05] [ 1.14885944e-02 2.35728672e-03 -9.93717233e-05] [-1.14885801e-02 -2.35729423e-03 -9.93822634e-05]] Final stress: [ 1.81093441e-04 3.80867048e-04 1.34494252e-04 -1.92963592e-11 -1.70615144e-11 2.43647465e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.49272516e-03 -1.61701667e-03 -4.52092332e-05] [-3.49272516e-03 1.61701667e-03 4.52087042e-05] [ 3.63028273e-02 -1.95344057e-10 8.71469966e-11] [-1.06244212e-02 -6.49220502e-02 2.08542989e-02] [-1.06244218e-02 6.49220505e-02 -2.08542986e-02] [ 8.33286633e-02 1.72896626e-10 6.41755298e-11] [-2.95833260e-02 -2.74688480e-02 -1.78894317e-02] [-2.95833257e-02 2.74688478e-02 1.78894319e-02] [-1.03248255e-02 2.69257995e-02 3.32148236e-03] [-5.79044736e-03 3.37040008e-02 3.37291753e-03] [-1.03248255e-02 -2.69257995e-02 -3.32148228e-03] [-5.79044729e-03 -3.37040009e-02 -3.37291765e-03]] Final stress: [-1.16090559e-03 -1.41994527e-03 -2.89855010e-04 -2.22553252e-03 -2.49204961e-13 3.03985978e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.49256896e-03 -1.61703192e-03 4.52094695e-05] [ 3.49256896e-03 1.61703192e-03 -4.52091756e-05] [-8.33290058e-02 -2.43445163e-11 -7.20168505e-12] [ 2.95815874e-02 2.74673046e-02 -1.78901436e-02] [ 2.95815875e-02 -2.74673047e-02 1.78901435e-02] [-3.63022836e-02 2.26145895e-10 8.16097723e-11] [ 1.06222636e-02 6.49212288e-02 2.08550389e-02] [ 1.06222641e-02 -6.49212291e-02 -2.08550387e-02] [ 5.79241124e-03 -3.37042093e-02 3.37299055e-03] [ 1.03268132e-02 -2.69259397e-02 3.32155454e-03] [ 5.79241122e-03 3.37042093e-02 -3.37299097e-03] [ 1.03268132e-02 2.69259398e-02 -3.32155461e-03]] Final stress: [-1.16092943e-03 -1.41997157e-03 -2.89867570e-04 2.22553560e-03 2.45415827e-13 -4.83957516e-15] Minimization converged after 65 steps. Minimization converged after 66 steps. Minimization converged after 69 steps. Minimization converged after 68 steps. Minimization converged after 68 steps. Minimization converged after 66 steps. Minimization converged after 68 steps. Minimization converged after 66 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.84317696e-12 5.10897688e-03 -4.28166696e-10] [-6.27867489e-13 1.87555825e-03 -1.08168107e-09] [-2.01073089e-02 4.66983182e-02 2.22935050e-02] [ 5.85567501e-02 -5.22060556e-02 -1.27456129e-02] [-3.38944135e-02 -1.41093429e-02 -9.77947729e-03] [ 2.01073089e-02 4.66983188e-02 -2.22935048e-02] [ 3.38944134e-02 -1.41093430e-02 9.77947740e-03] [-5.85567498e-02 -5.22060558e-02 1.27456131e-02] [ 3.25828217e-02 1.14479524e-02 3.25473227e-03] [ 2.80479152e-02 4.67686022e-03 3.44003893e-03] [-2.80479152e-02 4.67686008e-03 -3.44003815e-03] [-3.25828219e-02 1.14479525e-02 -3.25473208e-03]] Final stress: [-1.42001013e-03 -1.16097410e-03 -2.89890764e-04 -9.43433885e-14 -2.22553082e-03 -5.30472929e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.96559113e-12 -1.87580397e-03 -2.06177432e-10] [ 8.94345181e-12 -5.10920704e-03 -1.97761908e-09] [-2.01067631e-02 -4.67016597e-02 -2.22926759e-02] [-3.38964517e-02 1.41095189e-02 9.77905861e-03] [ 5.85582017e-02 5.22052345e-02 1.27451999e-02] [ 2.01067631e-02 -4.67016588e-02 2.22926763e-02] [-5.85582024e-02 5.22052341e-02 -1.27451995e-02] [ 3.38964522e-02 1.41095186e-02 -9.77905833e-03] [-2.80477046e-02 -4.67478037e-03 3.43995004e-03] [-3.25825715e-02 -1.14458079e-02 3.25464728e-03] [ 3.25825716e-02 -1.14458080e-02 -3.25464594e-03] [ 2.80477047e-02 -4.67478025e-03 -3.43995028e-03]] Final stress: [-1.41997597e-03 -1.16094160e-03 -2.89871690e-04 1.05346453e-13 2.22553631e-03 -5.14160499e-13] Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 67 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Summary of completed elastic constants calculation: Method: energy-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.39552 194.86754 7.38396 -0. 0. 0. ] [194.86754 0.30402 -1.44986 0. 0. -0. ] [ 7.38396 -1.44986 2.25773 0. 0. -0. ] [ -0. 0. 0. -0.61804 -0. 0. ] [ 0. 0. 0. -0. -0.26902 -0. ] [ 0. -0. -0. 0. -0. 1.58724]] 95%% Error estimate [ASE units]: [[120.91138 198.28815 24.21372 0. 0. 0. ] [198.28815 124.96554 2.18524 0. 0. 0. ] [ 24.21372 2.18524 0. 0. 0. 0.00003] [ 0. 0. 0. 43.08856 0. 0. ] [ 0. 0. 0. 0. 49.30591 0. ] [ 0. 0. 0.00003 0. 0. 38.89732]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 99.144074 is too big compared to maximum elastic constant component 194.867543 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 98.823247 WARNING: Maximum deviation from material symmetry according to space group 182 is too big compared to maximum elastic constant component 194.867543 [ASE units] and requested fractional tolerance 0.010000. Unable to compute elastic constants with method energy-condensed, escalating to method stress-condensed Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.74133818e-10 1.57077382e-02 1.26054789e-08] [ 1.92613106e-10 -1.57077382e-02 -3.02028656e-08] [-6.01585483e-03 -3.94538113e-09 1.88344410e-09] [-3.69270558e-03 7.76847672e-03 -1.04658589e-02] [-3.69272197e-03 -7.76846732e-03 1.04658669e-02] [ 6.01585461e-03 -3.32985522e-09 -1.25189592e-09] [ 3.69271391e-03 -7.76847206e-03 -1.04658630e-02] [ 3.69271344e-03 7.76847235e-03 1.04658628e-02] [ 9.11006007e-05 -1.01495369e-02 -9.25525176e-03] [-9.11008590e-05 1.01495358e-02 -9.25523751e-03] [ 9.10999398e-05 1.01495398e-02 9.25526226e-03] [-9.10996213e-05 -1.01495411e-02 9.25523623e-03]] Final stress: [-7.76719444e-05 5.84612325e-04 4.05516259e-04 -6.78795070e-13 -3.00435526e-12 1.76651853e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.43584347e-10 -1.81302931e-02 2.27600255e-08] [-4.12369139e-10 1.81302927e-02 -4.30356698e-08] [ 7.02311574e-03 2.57464483e-09 -6.67899430e-10] [ 2.03507400e-03 -4.71615294e-03 1.13389614e-02] [ 2.03506968e-03 4.71615531e-03 -1.13389589e-02] [-7.02311592e-03 3.98009137e-09 1.80286658e-09] [-2.03506910e-03 4.71615539e-03 1.13389594e-02] [-2.03507236e-03 -4.71615359e-03 -1.13389603e-02] [-2.11621980e-03 7.18003015e-03 7.75535665e-03] [ 2.11621784e-03 -7.18003513e-03 7.75538717e-03] [-2.11621841e-03 -7.18003569e-03 -7.75534742e-03] [ 2.11621898e-03 7.18003032e-03 -7.75537886e-03]] Final stress: [ 3.99061650e-04 -5.23194645e-04 -4.64688409e-05 2.98032626e-12 -8.04380334e-12 -1.73941560e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 3.61694202e-10 -1.67468265e-02 -1.18649622e-08] [ 2.42860898e-10 1.67468262e-02 2.04345728e-08] [ 1.15265370e-02 -1.78340454e-09 8.09663780e-10] [-1.68015122e-04 -2.59944078e-04 1.08015992e-02] [-1.68035754e-04 2.59955782e-04 -1.08015899e-02] [-1.15265368e-02 -6.63472499e-09 -2.94018254e-09] [ 1.68025732e-04 2.59950197e-04 1.08015939e-02] [ 1.68014736e-04 -2.59943870e-04 -1.08015996e-02] [-1.49912681e-03 7.92721342e-03 -9.19170710e-03] [ 1.49913043e-03 -7.92721924e-03 -9.19173214e-03] [-1.49912678e-03 -7.92721309e-03 9.19171191e-03] [ 1.49913281e-03 7.92720961e-03 9.19171732e-03]] Final stress: [ 6.62771244e-04 -1.52143055e-04 4.05904474e-04 -9.06077842e-12 -6.05537060e-12 2.07104922e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.12541532e-10 1.67912429e-02 -1.28355337e-08] [-1.70599403e-10 -1.67912432e-02 3.01323452e-08] [-1.13416162e-02 -1.10617850e-08 4.67455988e-09] [-1.12445491e-03 4.05791693e-03 -1.08292144e-02] [-1.12448741e-03 -4.05789834e-03 1.08292296e-02] [ 1.13416165e-02 -1.93647001e-08 -8.25168223e-09] [ 1.12448424e-03 -4.05790005e-03 -1.08292286e-02] [ 1.12444822e-03 4.05792078e-03 1.08292110e-02] [ 4.50685406e-04 -9.77435480e-03 7.85790884e-03] [-4.50681587e-04 9.77434930e-03 7.85786471e-03] [ 4.50685761e-04 9.77435355e-03 -7.85789055e-03] [-4.50679948e-04 -9.77435661e-03 -7.85789432e-03]] Final stress: [-4.30849804e-04 3.08262546e-04 -5.01050732e-05 -6.75002379e-12 -1.15469545e-11 1.27574574e-11] Minimization converged after 6 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.95435997e-02 -4.85243138e-03 -2.19918926e-04] [ 2.95435997e-02 4.85243138e-03 2.19919213e-04] [-7.00620805e-02 7.34903060e-11 -3.09032308e-11] [-5.30324254e-03 -2.57477436e-02 1.12454066e-03] [-5.30324236e-03 2.57477434e-02 -1.12454074e-03] [ 1.54067077e-02 -6.32191192e-12 -5.85957749e-12] [-3.72863154e-02 3.21207515e-02 2.27774824e-03] [-3.72863153e-02 -3.21207516e-02 -2.27774822e-03] [ 1.54097115e-02 1.16357545e-01 3.67529574e-03] [ 2.49639331e-02 1.36292129e-01 3.59424235e-03] [ 1.54097114e-02 -1.16357545e-01 -3.67529590e-03] [ 2.49639331e-02 -1.36292129e-01 -3.59424237e-03]] Final stress: [-1.82939930e-03 -2.44051948e-03 -1.92479215e-04 -2.67841890e-03 5.57649089e-15 -8.59689726e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.95445465e-02 -4.85252426e-03 2.19925297e-04] [-2.95445465e-02 4.85252426e-03 -2.19925468e-04] [-1.54059725e-02 -2.06670711e-10 8.63017331e-11] [ 3.72865509e-02 -3.21221613e-02 2.27835631e-03] [ 3.72865505e-02 3.21221615e-02 -2.27835610e-03] [ 7.00643967e-02 -1.33341226e-10 -6.21710003e-11] [ 5.30290614e-03 2.57473454e-02 1.12395705e-03] [ 5.30290598e-03 -2.57473453e-02 -1.12395714e-03] [-2.49642605e-02 -1.36291946e-01 3.59420261e-03] [-1.54098619e-02 -1.16357001e-01 3.67525605e-03] [-2.49642605e-02 1.36291946e-01 -3.59420235e-03] [-1.54098618e-02 1.16357001e-01 -3.67525629e-03]] Final stress: [-1.82943325e-03 -2.44056438e-03 -1.92483158e-04 2.67844974e-03 -6.97746775e-14 9.20076372e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 8.86961955e-13 -2.46943630e-02 -4.70934628e-11] [ 3.61113534e-12 -3.43935311e-02 5.56468374e-10] [-2.98372880e-02 1.93096178e-02 -1.04100831e-03] [ 1.70766050e-02 -8.59760169e-03 -1.74248353e-03] [ 2.34939365e-02 5.92057537e-02 1.65681109e-03] [ 2.98372879e-02 1.93096176e-02 1.04100820e-03] [-2.34939364e-02 5.92057538e-02 -1.65681114e-03] [-1.70766052e-02 -8.59760159e-03 1.74248343e-03] [ 1.31090803e-01 -1.02483081e-02 3.17274140e-03] [ 1.21558341e-01 -3.01255147e-02 4.09680590e-03] [-1.21558341e-01 -3.01255147e-02 -4.09680630e-03] [-1.31090803e-01 -1.02483081e-02 -3.17274125e-03]] Final stress: [-2.44036115e-03 -1.82957643e-03 -1.92480354e-04 5.21076568e-14 -2.67842389e-03 2.30870229e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-8.07291163e-13 3.43940513e-02 -3.71173397e-11] [-1.26567506e-13 2.46947903e-02 -1.75436043e-10] [-2.98375439e-02 -1.93093299e-02 1.04135754e-03] [ 2.34945716e-02 -5.92065650e-02 -1.65698424e-03] [ 1.70763351e-02 8.59741218e-03 1.74232255e-03] [ 2.98375439e-02 -1.93093297e-02 -1.04135748e-03] [-1.70763352e-02 8.59741209e-03 -1.74232248e-03] [-2.34945714e-02 -5.92065651e-02 1.65698432e-03] [-1.21558115e-01 3.01257239e-02 4.09679254e-03] [-1.31090665e-01 1.02483380e-02 3.17271510e-03] [ 1.31090665e-01 1.02483380e-02 -3.17271503e-03] [ 1.21558115e-01 3.01257239e-02 -4.09679260e-03]] Final stress: [-2.44038361e-03 -1.82959342e-03 -1.92482327e-04 1.56982395e-14 2.67843932e-03 8.70673468e-14] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.24920329e-10 4.19122045e-03 -1.89661138e-08] [-5.49812834e-11 -4.19122005e-03 -5.44583957e-08] [-1.16456980e-03 2.98772531e-08 -1.25738689e-08] [-5.78430847e-04 1.44050345e-03 -2.69475032e-03] [-5.78355120e-04 -1.44054687e-03 2.69471473e-03] [ 1.16456945e-03 6.87760097e-08 2.89114083e-08] [ 5.78345302e-04 -1.44055273e-03 -2.69470883e-03] [ 5.78460521e-04 1.44048613e-03 2.69476498e-03] [ 7.60679805e-04 -3.84536561e-04 -7.26726186e-04] [-7.60687956e-04 3.84544407e-04 -7.26639738e-04] [ 7.60680343e-04 3.84534357e-04 7.26674679e-04] [-7.60691114e-04 -3.84531234e-04 7.26727780e-04]] Final stress: [-4.61598358e-05 1.88609593e-04 7.03675579e-05 1.54803801e-11 1.26108964e-11 -3.18512499e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.72624104e-10 -4.66961287e-03 -2.76968813e-08] [-9.90568405e-10 4.66961349e-03 -3.88301684e-07] [ 1.13653549e-03 -8.72333641e-08 3.56093702e-08] [ 5.79799462e-04 -1.48769987e-03 2.92695475e-03] [ 5.79669464e-04 1.48777507e-03 -2.92689281e-03] [-1.13653649e-03 1.41819728e-07 5.88610415e-08] [-5.79866790e-04 1.48765972e-03 2.92698720e-03] [-5.79609498e-04 -1.48780799e-03 -2.92686442e-03] [-9.67158048e-04 3.55417719e-04 7.52027604e-04] [ 9.67164867e-04 -3.55409893e-04 7.52241324e-04] [-9.67159581e-04 -3.55411310e-04 -7.52003243e-04] [ 9.67161841e-04 3.55421358e-04 -7.52128866e-04]] Final stress: [ 7.84846066e-05 -1.95159828e-04 -2.56538760e-05 -4.71293295e-12 1.26617321e-11 -1.15136942e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 7.19136764e-10 -4.31812123e-03 -3.03325058e-08] [ 1.65464586e-10 4.31812169e-03 -1.17599534e-07] [ 2.35152179e-03 -3.65994444e-08 1.51503501e-08] [-6.73077863e-05 -2.66047073e-04 2.75271687e-03] [-6.73648013e-05 2.66080036e-04 -2.75268940e-03] [-2.35152170e-03 3.48518654e-08 1.47481676e-08] [ 6.72812099e-05 2.66031341e-04 2.75272893e-03] [ 6.73587553e-05 -2.66075844e-04 -2.75269195e-03] [-8.61221221e-04 3.43927743e-04 -7.52985186e-04] [ 8.61238643e-04 -3.43925248e-04 -7.52939390e-04] [-8.61223491e-04 -3.43918332e-04 7.53007205e-04] [ 8.61237717e-04 3.43928665e-04 7.52970955e-04]] Final stress: [ 1.96112529e-04 -5.18845580e-05 7.14255564e-05 -2.63088461e-11 1.04313075e-11 1.20647456e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.19041407e-09 4.48439648e-03 7.57793743e-08] [-1.31094852e-09 -4.48439869e-03 -1.90632698e-07] [-2.63431875e-03 -1.83954869e-08 8.55630042e-09] [ 7.93448761e-05 4.20517520e-04 -2.84556120e-03] [ 7.92828439e-05 -4.20482020e-04 2.84559159e-03] [ 2.63431641e-03 4.37435066e-08 1.75332387e-08] [-7.92462886e-05 -4.20461464e-04 -2.84560517e-03] [-7.92552760e-05 4.20465556e-04 2.84560325e-03] [ 8.18897579e-04 -5.53981472e-04 7.57491271e-04] [-8.18965536e-04 5.53965099e-04 7.57604253e-04] [ 8.18908966e-04 5.53935089e-04 -7.57448898e-04] [-8.18961327e-04 -5.53981439e-04 -7.57586332e-04]] Final stress: [-1.84476636e-04 6.91942556e-05 -2.57026484e-05 9.77572201e-11 -5.42451189e-11 -6.24823185e-11] Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.22222982e-03 -1.40251071e-02 -1.11304850e-03] [ 5.22222982e-03 1.40251070e-02 1.11304095e-03] [ 5.07874629e-02 -1.14293754e-09 5.36653399e-10] [ 8.93267798e-03 -8.93159020e-02 5.89150641e-02] [ 8.93267350e-03 8.93159046e-02 -5.89150618e-02] [ 1.56442777e-01 8.46903638e-10 3.91027740e-10] [-8.69658107e-03 -3.22797147e-02 -3.69161184e-02] [-8.69658007e-03 3.22797142e-02 3.69161189e-02] [-7.12882906e-02 2.26614778e-02 -2.36265032e-02] [-3.77851546e-02 8.09991160e-02 -2.23618328e-02] [-7.12882905e-02 -2.26614781e-02 2.36265061e-02] [-3.77851542e-02 -8.09991174e-02 2.23618338e-02]] Final stress: [-1.28570630e-03 -3.38019654e-03 2.04839699e-03 -6.24761462e-03 6.59653546e-13 2.54903134e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-5.19693831e-03 -1.40252792e-02 1.11302443e-03] [-5.19693831e-03 1.40252791e-02 -1.11302964e-03] [-1.56464091e-01 -1.58909008e-09 7.77969754e-10] [ 8.68870602e-03 3.23302856e-02 -3.69323468e-02] [ 8.68870150e-03 -3.23302830e-02 3.69323491e-02] [-5.08611368e-02 -1.05666715e-09 -4.06853311e-10] [-8.91658944e-03 8.93252683e-02 5.89351859e-02] [-8.91659472e-03 -8.93252653e-02 -5.89351882e-02] [ 3.77927180e-02 -8.10368884e-02 -2.23655745e-02] [ 7.12947222e-02 -2.27003657e-02 -2.36302054e-02] [ 3.77927184e-02 8.10368865e-02 2.23655799e-02] [ 7.12947224e-02 2.27003646e-02 2.36302048e-02]] Final stress: [-1.28417783e-03 -3.37875452e-03 2.04938609e-03 6.24766179e-03 -4.98701136e-12 -1.95225001e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.10926829e-11 8.77043896e-03 -1.45013613e-10] [-5.16401610e-11 -1.92312416e-02 -4.74670381e-09] [-2.12590024e-02 3.39548885e-02 5.33452593e-02] [ 8.93874508e-02 -1.04438730e-01 -4.07072849e-02] [-3.29281843e-02 -3.33446125e-02 -1.85943623e-02] [ 2.12590024e-02 3.39548902e-02 -5.33452585e-02] [ 3.29281835e-02 -3.33446131e-02 1.85943627e-02] [-8.93874481e-02 -1.04438732e-01 4.07072862e-02] [ 6.85697651e-02 8.34289520e-02 -2.54231888e-02] [ 3.50993201e-02 2.56299039e-02 -2.05604452e-02] [-3.50993210e-02 2.56299037e-02 2.05604486e-02] [-6.85697659e-02 8.34289517e-02 2.54231878e-02]] Final stress: [-3.37960795e-03 -1.28709655e-03 2.04807732e-03 8.72438959e-14 -6.24734897e-03 3.29200787e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.82031659e-12 1.92263009e-02 -1.42827904e-09] [ 4.98087035e-11 -8.77559512e-03 -5.48731448e-09] [-2.12506637e-02 -3.39666108e-02 -5.33508449e-02] [-3.29533257e-02 3.33772896e-02 1.85955678e-02] [ 8.94045062e-02 1.04454877e-01 4.07118574e-02] [ 2.12506637e-02 -3.39666075e-02 5.33508463e-02] [-8.94045080e-02 1.04454876e-01 -4.07118563e-02] [ 3.29533274e-02 3.33772887e-02 -1.85955670e-02] [-3.50678235e-02 -2.56455594e-02 -2.05646578e-02] [-6.85388285e-02 -8.34453501e-02 -2.54275488e-02] [ 6.85388288e-02 -8.34453506e-02 2.54275525e-02] [ 3.50678234e-02 -2.56455587e-02 2.05646578e-02]] Final stress: [-3.37915241e-03 -1.28655764e-03 2.04849329e-03 1.58213837e-12 6.24777762e-03 -2.38233502e-12] Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 3.06871573e-09 1.12117652e-03 6.20249474e-09] [ 3.41044215e-09 -1.12117589e-03 2.39889474e-07] [-3.01121938e-04 1.89377305e-08 -9.51357429e-09] [ 5.33297480e-07 4.09796805e-04 -6.36542204e-04] [ 6.11029163e-07 -4.09841138e-04 6.36503586e-04] [ 3.01124876e-04 -5.02970755e-08 -2.21368777e-08] [-6.21513654e-07 -4.09847890e-04 -6.36504032e-04] [-7.20708146e-07 4.09905026e-04 6.36454535e-04] [ 3.77724036e-04 2.61960950e-05 -1.08334779e-04] [-3.77627525e-04 -2.62106019e-05 -1.08456974e-04] [ 3.77725578e-04 -2.62028094e-05 1.08283920e-04] [-3.77633612e-04 2.62352445e-05 1.08381507e-04]] Final stress: [ 5.00428471e-06 5.86942191e-05 2.97816632e-05 -1.57680353e-10 1.51409434e-11 -6.55127748e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 1.42526939e-09 -6.67574697e-04 -2.91086300e-09] [ 7.48134388e-10 6.67577137e-04 -3.78517072e-07] [ 6.83694087e-05 -5.31386810e-08 2.18619548e-08] [ 2.48479104e-05 -2.86489324e-04 3.44325842e-04] [ 2.47974760e-05 2.86519110e-04 -3.44300342e-04] [-6.83699791e-05 1.12045946e-07 4.82620335e-08] [-2.49967597e-05 2.86402349e-04 3.44395496e-04] [-2.47174564e-05 -2.86562698e-04 -3.44261707e-04] [-2.55607002e-04 -6.76895348e-05 5.95369125e-05] [ 2.55649254e-04 6.77160146e-05 5.97842377e-05] [-2.55618183e-04 6.77363461e-05 -5.95314788e-05] [ 2.55643158e-04 -6.76936113e-05 -5.96376567e-05]] Final stress: [-1.00455381e-05 -3.06518252e-05 -4.81723531e-06 -5.52360346e-11 5.76377202e-11 5.16432397e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 4.87238236e-10 -1.14215097e-03 -2.70906411e-08] [ 1.16446741e-09 1.14214867e-03 2.23653204e-07] [ 5.51417250e-04 2.21184340e-08 -9.22901622e-09] [-1.99074624e-05 -8.54193718e-05 6.97469016e-04] [-1.99026131e-05 8.54161393e-05 -6.97472773e-04] [-5.51415957e-04 -4.09952499e-08 -1.87867966e-08] [ 1.99613280e-05 8.54504102e-05 6.97442947e-04] [ 1.98046945e-05 -8.53610619e-05 -6.97517906e-04] [-2.82639630e-04 -6.87260842e-05 -9.57028819e-05] [ 2.82652042e-04 6.86884926e-05 -9.58631935e-05] [-2.82628079e-04 6.86792269e-05 9.57002699e-05] [ 2.82656775e-04 -6.87065819e-05 9.57759752e-05]] Final stress: [ 5.88339590e-05 5.55102188e-06 2.97311548e-05 -3.53332383e-11 -5.41214701e-11 -5.97743561e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.13561627e-09 6.53197629e-04 -5.02418764e-08] [-9.39438215e-10 -6.53200118e-04 -2.51479233e-07] [-4.95575312e-04 -9.09857039e-08 3.77652676e-08] [ 3.36974776e-05 1.69158428e-05 -3.83490975e-04] [ 3.34775675e-05 -1.67896997e-05 3.83593769e-04] [ 4.95574007e-04 9.81893809e-08 3.89516827e-08] [-3.36067993e-05 -1.68647522e-05 -3.83532188e-04] [-3.35028601e-05 1.68038442e-05 3.83581186e-04] [ 9.58927131e-05 -2.16599162e-05 -5.24096194e-05] [-9.59325391e-05 2.16324967e-05 -5.23425147e-05] [ 9.59017921e-05 2.16238832e-05 5.24738049e-05] [-9.59239717e-05 -2.16664136e-05 5.23515414e-05]] Final stress: [-2.98359315e-05 -1.34892384e-05 -3.44073508e-06 5.11268475e-11 -5.98717697e-11 -4.22415813e-12] Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 41 steps. Minimization converged after 39 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.54086110e-10 2.69314625e-03 -1.25664077e-08] [-2.33019298e-10 -2.69314727e-03 -1.27041954e-07] [-7.82108847e-04 -5.03041810e-08 2.13875463e-08] [-2.88865027e-04 8.18892660e-04 -1.78564515e-03] [-2.88974256e-04 -8.18829842e-04 1.78569762e-03] [ 7.82108170e-04 1.96129756e-08 7.84952007e-09] [ 2.88932425e-04 -8.18854329e-04 -1.78567655e-03] [ 2.88936147e-04 8.18851787e-04 1.78567904e-03] [ 5.59499232e-04 -7.30767972e-05 -3.32818650e-04] [-5.59516636e-04 7.30659553e-05 -3.32798103e-04] [ 5.59503249e-04 7.30602567e-05 3.32879642e-04] [-5.59513669e-04 -7.30779814e-05 3.32792524e-04]] Final stress: [-4.49472901e-05 1.14811857e-04 3.67252778e-05 2.25514114e-11 -2.50097581e-11 -9.17868392e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-4.63510341e-11 -2.39347207e-03 3.98626510e-08] [-2.20813368e-11 2.39347216e-03 -1.65426627e-08] [ 1.06774753e-04 -1.46812352e-08 6.15418297e-09] [ 2.29112688e-03 -9.65671165e-04 1.74024647e-03] [ 2.29110198e-03 9.65685964e-04 -1.74023432e-03] [-1.06775290e-04 -2.56878745e-08 -1.08246160e-08] [-2.29109208e-03 9.65691421e-04 1.74022959e-03] [-2.29113680e-03 -9.65665592e-04 -1.74025131e-03] [ 1.34657151e-03 2.98473945e-03 -2.10231346e-03] [-1.34657093e-03 -2.98473856e-03 -2.10231374e-03] [ 1.34657153e-03 -2.98473961e-03 2.10233567e-03] [-1.34657149e-03 2.98473838e-03 2.10228246e-03]] Final stress: [-5.34613117e-05 -1.22224601e-04 6.51021821e-06 4.35227752e-12 2.08730151e-12 6.57628974e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.96366987e-09 -2.72630496e-03 6.50082363e-08] [-2.96243363e-10 2.72630060e-03 -2.21634985e-07] [ 1.33920837e-03 -6.14998699e-08 2.71379358e-08] [-2.46151833e-05 -2.51122558e-04 1.79856337e-03] [-2.47344660e-05 2.51191258e-04 -1.79850327e-03] [-1.33920985e-03 4.81212661e-08 1.83602841e-08] [ 2.47676170e-05 2.51208344e-04 1.79849312e-03] [ 2.46371394e-05 -2.51135671e-04 -1.79854971e-03] [-6.04237972e-04 3.32926370e-06 -3.30753418e-04] [ 6.04196848e-04 -3.38470321e-06 -3.30684226e-04] [-6.04209056e-04 -3.44640103e-06 3.30872939e-04] [ 6.04198819e-04 3.37820542e-06 3.30672320e-04]] Final stress: [ 1.17358874e-04 -4.73407082e-05 3.67226819e-05 4.48384326e-11 -1.01470239e-10 -2.29699738e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-5.10569365e-11 2.26289050e-03 2.61038635e-09] [ 1.83606935e-10 -2.26289060e-03 -8.78189673e-08] [-2.65924404e-03 -3.58944314e-08 1.50070180e-08] [-9.48268498e-04 -1.12787724e-03 -1.64746461e-03] [-9.48331164e-04 1.12791304e-03 1.64749478e-03] [ 2.65924372e-03 1.23747028e-08 4.93336607e-09] [ 9.48290811e-04 1.12788970e-03 -1.64747548e-03] [ 9.48309895e-04 -1.12790053e-03 1.64748425e-03] [-1.33760800e-03 -2.89311101e-03 -1.97049230e-03] [ 1.33760739e-03 2.89311056e-03 -1.97046650e-03] [-1.33760818e-03 2.89310948e-03 1.97052222e-03] [ 1.33760794e-03 -2.89311038e-03 1.97046292e-03]] Final stress: [-1.15291305e-04 -5.19402292e-05 5.92284326e-06 7.19089335e-13 -1.81819104e-12 -4.75243726e-12] Minimization converged after 6 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.49314569e-03 -4.57351267e-05 -6.91540432e-07] [-3.49314569e-03 4.57351351e-05 6.91149824e-07] [ 3.57070989e-03 -3.76917674e-10 1.48203351e-10] [-5.83994333e-04 -7.12087850e-03 5.18832055e-03] [-5.83994667e-04 7.12087870e-03 -5.18832039e-03] [ 9.13627219e-03 2.71036810e-10 9.75597806e-11] [-2.83420582e-03 -2.18980800e-03 -5.26537758e-03] [-2.83420536e-03 2.18980773e-03 5.26537777e-03] [ 1.68335827e-05 1.54158237e-03 -3.00465501e-03] [ 5.41021200e-04 1.68637215e-03 -3.00401688e-03] [ 1.68335699e-05 -1.54158238e-03 3.00465492e-03] [ 5.41021134e-04 -1.68637198e-03 3.00401676e-03]] Final stress: [-1.59821047e-04 -1.71413800e-04 -4.34814352e-06 -3.89631147e-04 2.10102574e-13 -3.60140767e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.49370510e-03 -4.57390951e-05 6.91075978e-07] [ 3.49370509e-03 4.57390699e-05 -6.91810887e-07] [-9.13563869e-03 -5.05855014e-10 2.14174621e-10] [ 2.82980473e-03 2.18644092e-03 -5.26776397e-03] [ 2.82980302e-03 -2.18643994e-03 5.26776476e-03] [-3.56954209e-03 -1.99360310e-10 -8.65568351e-11] [ 5.79357494e-04 7.11798754e-03 5.19069426e-03] [ 5.79356740e-04 -7.11798712e-03 -5.19069461e-03] [-5.37248149e-04 -1.69199295e-03 -3.00259747e-03] [-1.30276539e-05 -1.54720450e-03 -3.00323651e-03] [-5.37248076e-04 1.69199274e-03 3.00259830e-03] [-1.30275298e-05 1.54720405e-03 3.00323584e-03]] Final stress: [-1.59831305e-04 -1.71424920e-04 -4.37842060e-06 3.89593615e-04 -6.33675612e-13 5.04383009e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.18229977e-11 3.53832262e-03 -1.04153197e-10] [-1.87198012e-11 3.44688098e-03 -5.37831209e-10] [-2.66869499e-03 4.39988720e-03 6.03207897e-03] [ 6.25667558e-03 -5.91880021e-03 -2.97807370e-03] [-3.05540258e-03 -1.40766946e-03 -3.05517305e-03] [ 2.66869498e-03 4.39988714e-03 -6.03207899e-03] [ 3.05540268e-03 -1.40766940e-03 3.05517301e-03] [-6.25667481e-03 -5.91880066e-03 2.97807405e-03] [ 1.87033596e-03 -2.10639870e-04 -3.00697857e-03] [ 1.34614687e-03 -3.55379133e-04 -3.00588591e-03] [-1.34614734e-03 -3.55379014e-04 3.00588629e-03] [-1.87033634e-03 -2.10640189e-04 3.00697853e-03]] Final stress: [-1.71375830e-04 -1.59785107e-04 -4.29614799e-06 6.67033151e-13 -3.89613583e-04 9.35828503e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-9.60850893e-12 -3.44632442e-03 -4.26345835e-10] [ 1.44757669e-12 -3.53775858e-03 -5.01987876e-10] [-2.66844013e-03 -4.40627372e-03 -6.02933547e-03] [-3.05873188e-03 1.40701546e-03 3.05379455e-03] [ 6.25971785e-03 5.91771920e-03 2.97670904e-03] [ 2.66844011e-03 -4.40627246e-03 6.02933595e-03] [-6.25971831e-03 5.91771893e-03 -2.97670883e-03] [ 3.05873256e-03 1.40701506e-03 -3.05379424e-03] [-1.34054691e-03 3.59160615e-04 -3.00728853e-03] [-1.86470267e-03 2.14419692e-04 -3.00838064e-03] [ 1.86470263e-03 2.14419371e-04 3.00838063e-03] [ 1.34054675e-03 3.59160863e-04 3.00728846e-03]] Final stress: [-1.71365248e-04 -1.59775359e-04 -4.26635840e-06 2.24121501e-13 3.89652235e-04 -1.19751762e-12] Minimization converged after 42 steps. Minimization converged after 42 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.07342801e-09 6.92443014e-04 1.77764570e-08] [ 1.07000139e-09 -6.92443513e-04 1.53773698e-07] [-2.75158030e-04 4.71203632e-08 -1.98366706e-08] [ 3.09670856e-04 3.97568591e-04 -3.06882993e-04] [ 3.09742827e-04 -3.97610259e-04 3.06847546e-04] [ 2.75159170e-04 -2.60000005e-08 -1.13945030e-08] [-3.09708842e-04 -3.97590560e-04 -3.06865873e-04] [-3.09770207e-04 3.97625782e-04 3.06835947e-04] [ 4.82634370e-04 -1.34775028e-04 -6.06162267e-05] [-4.82605113e-04 1.34760281e-04 -6.06729069e-05] [ 4.82636613e-04 1.34766113e-04 6.05714534e-05] [-4.82603787e-04 -1.34765542e-04 6.06427349e-05]] Final stress: [-1.96622878e-06 3.20505217e-05 1.83818733e-05 -5.17888630e-11 -1.19933385e-11 -7.65489877e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 4.81923469e-09 -6.13305344e-03 3.64944200e-07] [-5.87599894e-08 6.13306375e-03 -2.49925517e-06] [-5.60094457e-03 2.06123602e-08 1.33052258e-09] [-4.18233025e-04 -8.75927647e-03 2.44689837e-03] [-4.20457204e-04 8.76052985e-03 -2.44591334e-03] [ 5.60092151e-03 -6.46850227e-08 -8.90021615e-09] [ 4.18563387e-04 8.75946791e-03 2.44676164e-03] [ 4.21254603e-04 -8.76098271e-03 -2.44555990e-03] [-6.50753328e-03 -4.27098855e-03 3.09267562e-03] [ 6.50704731e-03 4.27127265e-03 3.09413511e-03] [-6.50790979e-03 4.27252861e-03 -3.09280691e-03] [ 6.50734500e-03 -4.27251754e-03 -3.09404870e-03]] Final stress: [ 1.08575491e-05 -7.85445153e-04 -1.85226270e-04 9.89054491e-10 2.39524144e-10 5.73211073e-09] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.16807274e-09 -6.99141055e-04 1.66802353e-08] [-8.93639773e-10 6.99142070e-04 3.24369844e-07] [ 3.53695866e-04 3.74303011e-08 -1.57025891e-08] [-3.50568821e-04 -3.42299922e-04 3.10927034e-04] [-3.50470868e-04 3.42243785e-04 -3.10972904e-04] [-3.53695569e-04 -1.41133988e-07 -5.82623667e-08] [ 3.50663872e-04 3.42356738e-04 3.10881784e-04] [ 3.50438842e-04 -3.42226571e-04 -3.10989792e-04] [-4.87736860e-04 1.34927289e-04 -5.36474161e-05] [ 4.87709799e-04 -1.34905299e-04 -5.38470082e-05] [-4.87739555e-04 -1.34916752e-04 5.36456407e-05] [ 4.87705355e-04 1.34923421e-04 5.37355774e-05]] Final stress: [ 3.25117742e-05 -2.07964848e-06 1.83427700e-05 5.15905656e-11 2.44969882e-11 -1.57464620e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-1.65531922e-09 5.36113133e-03 9.76231895e-09] [-8.52575575e-09 -5.36111908e-03 -3.99895289e-07] [-7.77866400e-03 -3.78370748e-08 2.20021095e-08] [-1.28868592e-03 -4.52253496e-03 -4.05638070e-03] [-1.28895933e-03 4.52268390e-03 4.05651279e-03] [ 7.77865990e-03 -3.21082258e-07 -1.19913397e-07] [ 1.28884759e-03 4.52262976e-03 -4.05645739e-03] [ 1.28915226e-03 -4.52279435e-03 4.05659264e-03] [-3.05736198e-03 -2.49952292e-03 -1.46433670e-03] [ 3.05722999e-03 2.49974330e-03 -1.46421825e-03] [-3.05748018e-03 2.49999436e-03 1.46452095e-03] [ 3.05727186e-03 -2.49985240e-03 1.46425469e-03]] Final stress: [-4.35748069e-04 -1.36927255e-04 -7.91172155e-05 2.62437993e-10 2.75827593e-10 1.18556472e-09] Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 41 steps. Minimization converged after 42 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 2.08018696e-03 5.25761557e-05 3.93508421e-06] [-2.08018704e-03 -5.25763281e-05 3.94068678e-06] [ 8.43987061e-04 -3.85076180e-04 -1.42912944e-03] [-1.95416985e-03 4.85391529e-04 2.36361442e-04] [-9.81241876e-04 4.14612062e-04 1.18976104e-03] [-8.43987091e-04 3.85069708e-04 -1.42913228e-03] [ 1.95418129e-03 -4.85384958e-04 2.36356054e-04] [ 9.81232781e-04 -4.14606951e-04 1.18975670e-03] [-5.49686454e-04 -4.25610769e-04 -1.76065157e-04] [ 5.49684627e-04 4.25608628e-04 -1.76074357e-04] [-1.47952976e-03 -9.65258018e-04 1.75147090e-04] [ 1.47952935e-03 9.65255121e-04 1.75143142e-04]] Final stress: [ 6.05406279e-05 4.52173572e-05 3.97806731e-05 2.41809481e-12 -4.55224230e-12 -7.51094125e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-2.08245133e-03 5.27398717e-05 -3.92425157e-06] [ 2.08245117e-03 -5.27399383e-05 -3.91828555e-06] [ 8.45639046e-04 3.81402377e-04 1.43189161e-03] [-9.87170800e-04 -4.17944644e-04 -1.19302266e-03] [-1.95826658e-03 -4.86290707e-04 -2.35874096e-04] [-8.45639069e-04 -3.81398649e-04 1.43189311e-03] [ 9.87171724e-04 4.17945200e-04 -1.19302298e-03] [ 1.95827117e-03 4.86287993e-04 -2.35871988e-04] [-1.48039151e-03 9.63170775e-04 -1.76519062e-04] [ 1.48038868e-03 -9.63170761e-04 -1.76520153e-04] [-5.56977980e-04 4.21476802e-04 1.77442105e-04] [ 5.56975477e-04 -4.21478320e-04 1.77446654e-04]] Final stress: [ 6.06594105e-05 4.52703077e-05 3.98496642e-05 4.84456083e-12 -1.23020878e-12 7.51045131e-05] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.12910771e-03 -3.11691332e-06 -1.71397594e-09] [-1.12910771e-03 3.11691618e-06 1.63330472e-09] [ 1.97143944e-03 2.37972848e-10 -1.03176252e-10] [ 7.98855148e-05 -1.34677585e-03 1.79324305e-03] [ 7.98856968e-05 1.34677574e-03 -1.79324316e-03] [ 2.27422309e-03 2.23171037e-10 9.30955762e-11] [-6.90311634e-05 -1.09819999e-03 -1.78332058e-03] [-6.90304368e-05 1.09819958e-03 1.78332091e-03] [-5.03897957e-04 9.56856079e-04 -1.67452111e-03] [-5.00680393e-04 9.76180918e-04 -1.67451829e-03] [-5.03898014e-04 -9.56855900e-04 1.67452071e-03] [-5.00680360e-04 -9.76181045e-04 1.67451856e-03]] Final stress: [-7.91293274e-06 -8.43764121e-06 3.54901570e-05 -9.28844509e-05 7.13776630e-14 6.16961223e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.12911932e-03 -3.11692309e-06 1.62142362e-09] [ 1.12911932e-03 3.11692663e-06 -1.74105413e-09] [-2.27420356e-03 -1.54360740e-10 7.05530367e-11] [ 6.89231569e-05 1.09811867e-03 -1.78337174e-03] [ 6.89228252e-05 -1.09811847e-03 1.78337192e-03] [-1.97141101e-03 -2.66794099e-10 -1.08916892e-10] [-7.99978174e-05 1.34670230e-03 1.79329415e-03] [-7.99980690e-05 -1.34670214e-03 -1.79329428e-03] [ 5.00772709e-04 -9.76251904e-04 -1.67450204e-03] [ 5.03990234e-04 -9.56926957e-04 -1.67450477e-03] [ 5.00772668e-04 9.76252011e-04 1.67450235e-03] [ 5.03990230e-04 9.56926911e-04 1.67450457e-03]] Final stress: [-7.91313929e-06 -8.43784905e-06 3.54897665e-05 9.28837405e-05 1.17088360e-13 3.17548492e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 5.31536466e-12 1.13175295e-03 7.51040848e-11] [ 1.82477314e-12 1.12552823e-03 8.00701058e-10] [-1.42619817e-04 6.96757294e-04 2.06354936e-03] [ 1.29103319e-03 -1.54403585e-03 -1.03673969e-03] [-1.14594647e-03 -1.28337083e-03 -1.02682981e-03] [ 1.42619825e-04 6.96757091e-04 -2.06354946e-03] [ 1.14594657e-03 -1.28337079e-03 1.02682975e-03] [-1.29103344e-03 -1.54403571e-03 1.03673956e-03] [ 9.65355160e-04 5.10661146e-04 -1.67897541e-03] [ 9.62147375e-04 4.91347640e-04 -1.67896518e-03] [-9.62147285e-04 4.91347667e-04 1.67896455e-03] [-9.65355105e-04 5.10661154e-04 1.67897546e-03]] Final stress: [-8.44802822e-06 -7.92405285e-06 3.55631955e-05 -1.16195763e-13 -9.28094721e-05 9.41669682e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.98622055e-12 -1.12578816e-03 1.37294934e-12] [-2.49064008e-12 -1.13201882e-03 -8.81164423e-10] [-1.42801876e-04 -6.98783169e-04 -2.06454034e-03] [-1.14838248e-03 1.28556845e-03 1.02732112e-03] [ 1.29365649e-03 1.54655022e-03 1.03723953e-03] [ 1.42801873e-04 -6.98782637e-04 2.06454056e-03] [-1.29365674e-03 1.54655007e-03 -1.03723940e-03] [ 1.14838291e-03 1.28556820e-03 -1.02732091e-03] [-9.63619035e-04 -4.92555520e-04 -1.67615851e-03] [-9.66832794e-04 -5.11876545e-04 -1.67616870e-03] [ 9.66832724e-04 -5.11876631e-04 1.67616928e-03] [ 9.63618931e-04 -4.92555473e-04 1.67615826e-03]] Final stress: [-8.44965305e-06 -7.92519739e-06 3.55133003e-05 1.45512594e-13 9.28606049e-05 -2.67572164e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 9.45919072e-04 -7.63529913e-06 8.10215339e-07] [-9.45919080e-04 7.63540248e-06 7.86196425e-07] [ 2.13170989e-04 -7.65029866e-05 -6.81179955e-04] [ 3.29579789e-05 6.16761986e-04 4.82360872e-04] [ 4.03738397e-04 -1.32055153e-04 1.97890349e-04] [-2.13171131e-04 7.65229568e-05 -6.81171587e-04] [-3.29777081e-05 -6.16773427e-04 4.82370343e-04] [-4.03718312e-04 1.32043642e-04 1.97899940e-04] [ 4.31960378e-04 -3.07663395e-04 -1.09364370e-04] [-4.31960264e-04 3.07665022e-04 -1.09338756e-04] [ 2.03309576e-04 -1.62262102e-04 1.09466857e-04] [-2.03309896e-04 1.62263353e-04 1.09469895e-04]] Final stress: [ 1.58354972e-05 2.14084591e-05 2.00744020e-05 6.80517851e-13 1.86240486e-12 -2.90006413e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-9.46085817e-04 -7.82838119e-06 -7.85300188e-07] [ 9.46085866e-04 7.82852453e-06 -7.98325799e-07] [ 2.25652221e-04 8.97905847e-05 6.82045653e-04] [ 4.11573614e-04 1.46016841e-04 -1.95624019e-04] [ 2.48709956e-05 -6.31831898e-04 -4.85513414e-04] [-2.25652258e-04 -8.97905127e-05 6.82045763e-04] [-4.11577489e-04 -1.46019055e-04 -1.95622230e-04] [-2.48686298e-05 6.31830653e-04 -4.85512308e-04] [ 2.15612941e-04 1.70640173e-04 -1.11719807e-04] [-2.15611766e-04 -1.70638722e-04 -1.11712073e-04] [ 4.31584033e-04 3.18837265e-04 1.11600308e-04] [-4.31583710e-04 -3.18835472e-04 1.11595754e-04]] Final stress: [ 1.65239424e-05 2.21983077e-05 2.04658917e-05 -1.19157310e-12 2.92742388e-12 2.91041847e-05] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-6.35387964e-03 -1.93709646e-04 -1.32990463e-06] [-6.35387964e-03 1.93709616e-04 1.32985186e-06] [ 2.05711559e-02 7.70898081e-11 -2.33309329e-11] [-1.53395847e-03 -1.77022469e-02 1.16357252e-02] [-1.53395832e-03 1.77022468e-02 -1.16357253e-02] [ 2.66391504e-02 4.53088009e-11 4.86876905e-11] [-4.20665630e-03 -1.28726227e-02 -1.11486574e-02] [-4.20665586e-03 1.28726224e-02 1.11486576e-02] [-5.94900506e-03 5.76214764e-03 2.62012044e-03] [-5.56165394e-03 6.59488537e-03 2.62242119e-03] [-5.94900511e-03 -5.76214740e-03 -2.62012065e-03] [-5.56165398e-03 -6.59488534e-03 -2.62242113e-03]] Final stress: [-1.39361961e-04 -1.70085553e-04 -6.75616242e-05 -8.02067701e-04 1.66950009e-13 5.15204734e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.35376200e-03 -1.93701296e-04 1.32971336e-06] [ 6.35376200e-03 1.93701297e-04 -1.33018827e-06] [-2.66382019e-02 -4.00464204e-11 1.72028669e-11] [ 4.20736929e-03 1.28723186e-02 -1.11481264e-02] [ 4.20736921e-03 -1.28723186e-02 1.11481264e-02] [-2.05700283e-02 -8.05503580e-11 -6.80506212e-12] [ 1.53456775e-03 1.77021155e-02 1.16351655e-02] [ 1.53456757e-03 -1.77021154e-02 -1.16351656e-02] [ 5.56054066e-03 -6.59540527e-03 2.62278540e-03] [ 5.94787549e-03 -5.76270724e-03 2.62048502e-03] [ 5.56054069e-03 6.59540521e-03 -2.62278512e-03] [ 5.94787550e-03 5.76270725e-03 -2.62048486e-03]] Final stress: [-1.39367179e-04 -1.70089236e-04 -6.75719520e-05 8.02044510e-04 -1.09737865e-13 -4.09361817e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.31205750e-11 6.54744011e-03 -1.16233957e-11] [-8.97666519e-12 6.16005683e-03 -4.18172189e-10] [-2.66808458e-03 1.16945483e-02 1.31506257e-02] [ 1.68028859e-02 -1.73015326e-02 -6.82371267e-03] [-1.37735261e-02 -1.22549069e-02 -6.33664521e-03] [ 2.66808459e-03 1.16945485e-02 -1.31506256e-02] [ 1.37735260e-02 -1.22549071e-02 6.33664526e-03] [-1.68028857e-02 -1.73015327e-02 6.82371282e-03] [ 6.37294651e-03 6.17036753e-03 2.61802468e-03] [ 5.98562589e-03 5.33777523e-03 2.62548311e-03] [-5.98562599e-03 5.33777528e-03 -2.62548295e-03] [-6.37294653e-03 6.17036746e-03 -2.61802468e-03]] Final stress: [-1.70089596e-04 -1.39368170e-04 -6.75748862e-05 7.12641550e-14 -8.02037509e-04 -5.19400212e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.03449177e-11 -6.16021736e-03 -5.09465186e-11] [-1.62533572e-12 -6.54762510e-03 -4.65153295e-10] [-2.66793151e-03 -1.16937623e-02 -1.31515499e-02] [-1.37739119e-02 1.22563663e-02 6.33708684e-03] [ 1.68031394e-02 1.73027522e-02 6.82419640e-03] [ 2.66793152e-03 -1.16937624e-02 1.31515499e-02] [-1.68031394e-02 1.73027523e-02 -6.82419647e-03] [ 1.37739120e-02 1.22563663e-02 -6.33708687e-03] [-5.98482169e-03 -5.33939202e-03 2.62494871e-03] [-6.37216585e-03 -6.17204294e-03 2.61748978e-03] [ 6.37216585e-03 -6.17204292e-03 -2.61748915e-03] [ 5.98482165e-03 -5.33939208e-03 -2.62494872e-03]] Final stress: [-1.70084193e-04 -1.39360513e-04 -6.75597257e-05 1.64168868e-13 8.02071555e-04 2.59126799e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 1 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.06568581e-02 -3.32488675e-04 -2.88579642e-06] [-1.06568581e-02 3.32488662e-04 2.88863857e-06] [ 7.32272201e-04 -4.12091081e-12 -1.23248621e-10] [-8.63063851e-04 -8.46559579e-03 1.32484317e-02] [-8.63064091e-04 8.46559580e-03 -1.32484319e-02] [ 1.01051364e-02 8.62954777e-10 3.09001094e-10] [-5.03033473e-03 -1.20129106e-03 -1.26932307e-02] [-5.03033353e-03 1.20129032e-03 1.26932313e-02] [ 5.30359436e-03 1.47423642e-02 -2.88073945e-02] [ 5.82795742e-03 1.59984061e-02 -2.88058736e-02] [ 5.30359435e-03 -1.47423644e-02 2.88073919e-02] [ 5.82795766e-03 -1.59984061e-02 2.88058726e-02]] Final stress: [-3.26584690e-04 -3.69548055e-04 4.19058600e-04 -8.47886665e-04 -8.59846321e-13 -7.07694081e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.06559644e-02 -3.32446604e-04 2.88510197e-06] [ 1.06559643e-02 3.32446590e-04 -2.88664958e-06] [-1.01055632e-02 -3.87265020e-10 1.42827027e-10] [ 5.03005446e-03 1.20122053e-03 -1.26924184e-02] [ 5.03005138e-03 -1.20121885e-03 1.26924197e-02] [-7.32606057e-04 5.98504124e-10 2.28069075e-10] [ 8.62671634e-04 8.46571543e-03 1.32475592e-02] [ 8.62672988e-04 -8.46571636e-03 -1.32475585e-02] [-5.82695177e-03 -1.59961947e-02 -2.88037933e-02] [-5.30265349e-03 -1.47403108e-02 -2.88053143e-02] [-5.82695162e-03 1.59961950e-02 2.88037931e-02] [-5.30265306e-03 1.47403095e-02 2.88053138e-02]] Final stress: [-3.26585902e-04 -3.69543998e-04 4.19014613e-04 8.47844101e-04 -1.55587229e-12 3.37186410e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.10860770e-11 1.09937752e-02 3.94576478e-10] [ 1.03573175e-11 1.03284409e-02 -6.17944615e-10] [-4.02037377e-03 5.73563826e-03 1.49761167e-02] [ 7.10404004e-03 -6.53642238e-03 -7.77476979e-03] [-2.56426570e-03 1.28035864e-03 -7.21922603e-03] [ 4.02037373e-03 5.73563827e-03 -1.49761167e-02] [ 2.56426835e-03 1.28036018e-03 7.21922496e-03] [-7.10404074e-03 -6.53642200e-03 7.77476951e-03] [ 1.56428076e-02 -4.94205404e-03 -2.88230979e-02] [ 1.51182137e-02 -6.19862928e-03 -2.88099872e-02] [-1.51182144e-02 -6.19863046e-03 2.88099884e-02] [-1.56428087e-02 -4.94205329e-03 2.88230982e-02]] Final stress: [-3.69565317e-04 -3.26578029e-04 4.19268790e-04 1.44992638e-12 -8.48088881e-04 -4.00661304e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.06158719e-11 -1.03269248e-02 1.27334502e-09] [ 2.86750776e-11 -1.09921093e-02 -2.61850166e-09] [-4.02063300e-03 -5.73514051e-03 -1.49743626e-02] [-2.56426335e-03 -1.27986137e-03 7.21840053e-03] [ 7.10418690e-03 6.53717116e-03 7.77383432e-03] [ 4.02063298e-03 -5.73513971e-03 1.49743630e-02] [-7.10418613e-03 6.53717153e-03 -7.77383460e-03] [ 2.56426197e-03 -1.27986052e-03 -7.21840111e-03] [-1.51144892e-02 6.19682160e-03 -2.88062669e-02] [-1.56389727e-02 4.94052498e-03 -2.88193709e-02] [ 1.56389733e-02 4.94052422e-03 2.88193735e-02] [ 1.51144892e-02 6.19682272e-03 2.88062661e-02]] Final stress: [-3.69559556e-04 -3.26581588e-04 4.19189475e-04 -8.47543701e-13 8.48013294e-04 -3.81063293e-12] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.75066915e-02 -6.84230753e-04 -8.43369383e-06] [-1.75066915e-02 6.84230435e-04 8.43749461e-06] [-7.75971080e-05 7.41788124e-09 -3.06850492e-09] [-9.86148801e-06 2.15971573e-03 2.27135755e-02] [-9.85620753e-06 -2.15971898e-03 -2.27135783e-02] [-1.13842424e-03 5.69807555e-09 2.29466312e-09] [ 1.61998551e-03 -5.57212772e-04 -2.17767753e-02] [ 1.61999077e-03 5.57209601e-04 2.17767778e-02] [ 7.68681088e-03 4.70249897e-02 6.23820101e-03] [ 8.81776106e-03 4.96456364e-02 6.23522061e-03] [ 7.68681157e-03 -4.70249921e-02 -6.23820797e-03] [ 8.81776231e-03 -4.96456404e-02 -6.23521639e-03]] Final stress: [ 1.51674444e-04 6.39133073e-05 7.15280020e-05 -9.92990399e-04 -6.67192460e-12 3.45255677e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.75128326e-02 -6.84656960e-04 8.44450509e-06] [ 1.75128325e-02 6.84657064e-04 -8.43572193e-06] [ 1.14118482e-03 4.11028595e-09 -1.73655967e-09] [-1.61887901e-03 5.58252540e-04 -2.17828146e-02] [-1.61886821e-03 -5.58258758e-04 2.17828095e-02] [ 7.89557368e-05 -1.02676591e-09 -2.93364503e-10] [ 1.23396524e-05 -2.16103587e-03 2.27201695e-02] [ 1.23399633e-05 2.16103580e-03 -2.27201692e-02] [-8.82400194e-03 -4.96642432e-02 6.23244449e-03] [-7.69236667e-03 -4.70419423e-02 6.23543496e-03] [-8.82400217e-03 4.96642442e-02 -6.23244874e-03] [-7.69236731e-03 4.70419443e-02 -6.23543264e-03]] Final stress: [ 1.51764718e-04 6.39496769e-05 7.16845273e-05 9.93276588e-04 3.19865245e-12 -1.82984848e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.38953673e-11 1.82022285e-02 -2.35844530e-09] [ 1.91766400e-11 1.68324413e-02 9.16994488e-09] [ 1.93835932e-03 -1.26420343e-03 2.56787184e-02] [-1.21973471e-03 9.19779159e-04 -1.33356660e-02] [ 3.81685011e-04 -6.37648872e-04 -1.23978477e-02] [-1.93835925e-03 -1.26420325e-03 -2.56787185e-02] [-3.81679533e-04 -6.37645675e-04 1.23978452e-02] [ 1.21973369e-03 9.19779630e-04 1.33356654e-02] [ 4.89322603e-02 -6.95629127e-03 6.21268185e-03] [ 4.78004545e-02 -9.57897192e-03 6.25337883e-03] [-4.78004563e-02 -9.57897422e-03 -6.25338589e-03] [-4.89322630e-02 -6.95628995e-03 -6.21267828e-03]] Final stress: [ 6.40200263e-05 1.51871336e-04 7.18047197e-05 3.86250319e-12 -9.93509377e-04 -7.67667375e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.20465859e-11 -1.68299301e-02 4.77584269e-10] [-7.55721618e-11 -1.81993177e-02 2.83626862e-09] [ 1.93713767e-03 1.27015122e-03 -2.56772143e-02] [ 3.84251873e-04 6.39153986e-04 1.23972083e-02] [-1.22138342e-03 -9.16708862e-04 1.33347691e-02] [-1.93713758e-03 1.27014876e-03 2.56772134e-02] [ 1.22138584e-03 -9.16707410e-04 -1.33347702e-02] [-3.84250556e-04 6.39153321e-04 -1.23972077e-02] [-4.77925819e-02 9.57196173e-03 6.25371177e-03] [-4.89240814e-02 6.95006709e-03 6.21303204e-03] [ 4.89240793e-02 6.95006745e-03 -6.21303405e-03] [ 4.77925803e-02 9.57196052e-03 -6.25371154e-03]] Final stress: [6.39714691e-05 1.51798133e-04 7.17314258e-05 2.51797327e-12 9.93365038e-04 3.17234654e-12] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.0001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.97436 -0.02412 0.28684 -0. 0. 0. ] [-0.02412 0.97407 0.30524 -0. 0. 0. ] [ 0.28684 0.30524 2.2524 0. 0. 0. ] [-0. -0. 0. 0.43245 0. -0. ] [ 0. 0. 0. 0. 0.43245 0. ] [ 0. 0. 0. -0. 0. 0.48096]] 95%% Error estimate [ASE units]: [[ 0.06617 0.07376 0.02741 0.00004 0.00008 0. ] [ 0.07376 0.06939 0.04087 0.00003 0.0001 0. ] [ 0.02741 0.04087 0.01607 0.00003 0.0003 0. ] [ 0.00004 0.00003 0.00003 32.94839 0. 0. ] [ 0.00008 0.0001 0.0003 0. 51.15187 0. ] [ 0. 0. 0. 0. 0. 0.02717]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 25.575937 is too big compared to maximum elastic constant component 2.252397 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.018399 Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 23 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-6.80412393e-10 6.84728790e-02 -1.91776899e-08] [ 8.25615718e-10 -6.84728808e-02 -3.22192985e-09] [-3.98982856e-02 8.02115596e-09 -3.15317422e-09] [-4.26574734e-02 7.58221794e-02 -4.91493946e-02] [-4.26574956e-02 -7.58221667e-02 4.91494042e-02] [ 3.98982859e-02 3.71162948e-08 1.44030996e-08] [ 4.26574689e-02 -7.58221827e-02 -4.91493919e-02] [ 4.26574733e-02 7.58221795e-02 4.91493947e-02] [ 4.05183908e-03 -7.53434823e-02 -1.42160875e-03] [-4.05183249e-03 7.53434526e-02 -1.42161018e-03] [ 4.05184718e-03 7.53434493e-02 1.42160255e-03] [-4.05182753e-03 -7.53434724e-02 1.42161518e-03]] Final stress: [ 2.79450184e-03 3.50893440e-03 5.52771544e-03 -1.44984809e-11 -5.04929701e-11 -2.85788202e-11] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-7.05316472e-10 7.63052095e-02 -8.06822431e-09] [-2.24490899e-09 -7.63052097e-02 2.76566599e-08] [ 1.04316771e-02 -1.32006897e-08 5.20327248e-09] [-9.11714919e-02 2.13510705e-01 -1.11566121e-01] [-9.11715106e-02 -2.13510694e-01 1.11566130e-01] [-1.04316767e-02 -1.26379200e-08 -5.53356320e-09] [ 9.11715163e-02 -2.13510691e-01 -1.11566132e-01] [ 9.11714951e-02 2.13510703e-01 1.11566121e-01] [ 8.22156285e-03 -9.67129717e-02 -1.37993339e-01] [-8.22156507e-03 9.67129741e-02 -1.37993372e-01] [ 8.22156255e-03 9.67129722e-02 1.37993347e-01] [-8.22156652e-03 -9.67129717e-02 1.37993348e-01]] Final stress: [ 1.13024006e-02 1.10719923e-02 1.78307327e-02 1.06709763e-11 -2.04940291e-11 -6.06931337e-12] Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-1.78639992e-10 -3.69352645e-02 5.68357961e-09] [ 8.70703287e-10 3.69352642e-02 4.70896770e-08] [ 1.45843374e-02 9.75597536e-09 -4.23491001e-09] [ 2.66416563e-03 -4.08048545e-03 2.28659075e-02] [ 2.66417693e-03 4.08047892e-03 -2.28659135e-02] [-1.45843374e-02 -6.95294444e-09 -3.29045830e-09] [-2.66416056e-03 4.08048846e-03 2.28659051e-02] [-2.66418227e-03 -4.08047615e-03 -2.28659159e-02] [-5.12507378e-03 1.65307380e-02 7.29601549e-03] [ 5.12507247e-03 -1.65307421e-02 7.29599398e-03] [-5.12507259e-03 -1.65307434e-02 -7.29602772e-03] [ 5.12507341e-03 1.65307391e-02 -7.29601025e-03]] Final stress: [ 9.19755888e-04 -7.94678341e-04 3.09604464e-04 -1.46732981e-12 -5.86259571e-12 -3.91424051e-12] Minimization converged after 29 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-5.69691183e-10 3.21113450e-02 -2.57210606e-08] [ 1.89779345e-10 -3.21113452e-02 -1.03134622e-08] [-1.89620715e-02 -2.04278847e-08 8.27064456e-09] [-4.47313873e-03 1.04159310e-02 -2.10958794e-02] [-4.47317368e-03 -1.04159107e-02 2.10958958e-02] [ 1.89620715e-02 7.45911602e-09 2.81384390e-09] [ 4.47315397e-03 -1.04159221e-02 -2.10958866e-02] [ 4.47316185e-03 1.04159174e-02 2.10958901e-02] [-3.03230142e-04 -2.48141495e-02 7.09411390e-03] [ 3.03228368e-04 2.48141487e-02 7.09409698e-03] [-3.03229567e-04 2.48141468e-02 -7.09410171e-03] [ 3.03228280e-04 -2.48141484e-02 -7.09410407e-03]] Final stress: [-4.99500143e-04 5.75793047e-04 2.75744473e-04 3.10403066e-12 -5.17043085e-12 -6.10544884e-12] Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.00254441e-05 -1.72818757e-05 9.45423075e-05] [-5.00254443e-05 1.72818763e-05 9.45425254e-05] [ 1.92880162e-04 2.48821267e-04 6.36476304e-04] [ 1.47271139e-04 5.56467433e-04 -2.11381599e-04] [ 2.27991078e-04 -4.43000758e-04 -5.26849521e-04] [-1.92880161e-04 -2.48821171e-04 6.36476344e-04] [-1.47271219e-04 -5.56467479e-04 -2.11381559e-04] [-2.27990979e-04 4.43000701e-04 -5.26849473e-04] [ 2.93965386e-04 -9.29554982e-05 6.89923185e-04] [-2.93965395e-04 9.29555050e-05 6.89923148e-04] [ 2.36889354e-04 2.45730147e-04 -6.82710915e-04] [-2.36889365e-04 -2.45730146e-04 -6.82710745e-04]] Final stress: [2.39590589e-05 2.75914239e-05 8.94072544e-06 1.58858561e-14 7.12551820e-15 2.11875967e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-4.99609098e-05 -1.72808239e-05 -9.45416711e-05] [ 4.99609090e-05 1.72808244e-05 -9.45417734e-05] [ 1.92885089e-04 -2.48858257e-04 -6.36484571e-04] [ 2.27936548e-04 4.42981311e-04 5.26839031e-04] [ 1.47256445e-04 -5.56454283e-04 2.11400051e-04] [-1.92885089e-04 2.48858284e-04 -6.36484558e-04] [-2.27936554e-04 -4.42981309e-04 5.26839034e-04] [-1.47256416e-04 5.56454271e-04 2.11400065e-04] [ 2.36800400e-04 -2.45748480e-04 6.82706241e-04] [-2.36800404e-04 2.45748474e-04 6.82706308e-04] [ 2.93991865e-04 9.29208625e-05 -6.89919062e-04] [-2.93991885e-04 -9.29208740e-05 -6.89919094e-04]] Final stress: [ 2.39595267e-05 2.75913749e-05 8.94090128e-06 1.76920425e-14 3.03152767e-14 -2.11876184e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 2.22364349e-11 1.96427929e-02 1.09014275e-08] [-5.79991902e-10 -1.96427929e-02 4.80819545e-08] [-6.69002705e-03 1.09678011e-08 -4.46018672e-09] [-4.72150911e-03 1.14996138e-02 -1.26719832e-02] [-4.72148457e-03 -1.14996280e-02 1.26719719e-02] [ 6.69002718e-03 -1.98899248e-08 -8.21787111e-09] [ 4.72152068e-03 -1.14996070e-02 -1.26719886e-02] [ 4.72147794e-03 1.14996317e-02 1.26719686e-02] [-5.06490839e-05 -1.10766363e-02 -1.02395137e-02] [ 5.06466960e-05 1.10766361e-02 -1.02395377e-02] [-5.06479912e-05 1.10766317e-02 1.02395128e-02] [ 5.06458607e-05 -1.10766330e-02 1.02395238e-02]] Final stress: [-8.92909280e-06 8.42238735e-04 5.66858061e-04 4.57929200e-12 -2.47766943e-12 -1.64745526e-11] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 1.20220417e-10 -2.20954397e-02 -1.10528470e-08] [ 6.94382218e-10 2.20954397e-02 5.01935270e-08] [ 1.58801699e-02 9.36135702e-09 -4.10925385e-09] [-1.48794473e-03 6.40924458e-04 1.37309448e-02] [-1.48792387e-03 -6.40936397e-04 -1.37309550e-02] [-1.58801697e-02 -2.28098118e-09 -1.15646994e-09] [ 1.48793635e-03 -6.40929046e-04 1.37309486e-02] [ 1.48792779e-03 6.40933862e-04 -1.37309529e-02] [-2.35068622e-03 7.68448544e-03 -1.04831397e-02] [ 2.35068796e-03 -7.68448587e-03 -1.04831639e-02] [-2.35068566e-03 -7.68448797e-03 1.04831254e-02] [ 2.35068739e-03 7.68448845e-03 1.04831589e-02]] Final stress: [ 9.94471732e-04 -1.42189555e-04 5.86794293e-04 -5.07491969e-12 -9.65793823e-13 -1.00512360e-11] Minimization converged after 28 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.13116943e-04 -4.96171777e-06 2.37385817e-04] [-5.13116936e-04 4.96171903e-06 2.37385644e-04] [ 2.25534921e-03 3.77981935e-04 3.71834582e-04] [-1.50408203e-03 2.53095579e-03 -2.68227569e-04] [-1.05946984e-03 -2.28425217e-03 -3.51910292e-04] [-2.25534920e-03 -3.77981103e-04 3.71834915e-04] [ 1.50408131e-03 -2.53095620e-03 -2.68227233e-04] [ 1.05947059e-03 2.28425174e-03 -3.51909948e-04] [ 2.73005379e-05 -3.39434450e-04 5.61876577e-03] [-2.73005369e-05 3.39434469e-04 5.61876638e-03] [-4.09201496e-04 2.68969789e-04 -5.60784924e-03] [ 4.09201448e-04 -2.68969803e-04 -5.60784882e-03]] Final stress: [ 1.79692174e-04 1.76997897e-04 -1.66860504e-06 3.98612835e-14 1.01482826e-13 4.58317130e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-5.14141643e-04 -4.80695550e-06 -2.37804988e-04] [ 5.14141641e-04 4.80694623e-06 -2.37802368e-04] [ 2.25887076e-03 -3.78685438e-04 -3.70495784e-04] [-1.06525766e-03 2.28500673e-03 3.49631983e-04] [-1.51054343e-03 -2.53205999e-03 2.69598147e-04] [-2.25887075e-03 3.78685791e-04 -3.70495623e-04] [ 1.06525739e-03 -2.28500692e-03 3.49632135e-04] [ 1.51054369e-03 2.53205981e-03 2.69598299e-04] [-4.13885355e-04 -2.67473281e-04 5.61509712e-03] [ 4.13885296e-04 2.67473269e-04 5.61509613e-03] [ 2.33912760e-05 3.39419771e-04 -5.62602828e-03] [-2.33912119e-05 -3.39419742e-04 -5.62602676e-03]] Final stress: [ 1.79973678e-04 1.77215248e-04 -1.66350450e-06 -6.81189257e-14 -2.80026258e-13 -4.56871546e-05] Minimization converged after 25 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.91152380e-11 -3.27779488e-02 8.23405788e-09] [ 5.73064263e-10 3.27779487e-02 2.70993967e-08] [ 1.12533350e-02 9.17586573e-09 -3.86143534e-09] [ 1.40923341e-03 -9.50320951e-03 1.62613001e-02] [ 1.40925010e-03 9.50319994e-03 -1.62613081e-02] [-1.12533348e-02 -6.12320417e-09 -2.63108121e-09] [-1.40923806e-03 9.50320689e-03 1.62613022e-02] [-1.40925503e-03 -9.50319713e-03 -1.62613102e-02] [-2.17044252e-03 2.67489233e-03 4.71634186e-03] [ 2.17044663e-03 -2.67489499e-03 4.71633351e-03] [-2.17044187e-03 -2.67489593e-03 -4.71634884e-03] [ 2.17044662e-03 2.67489547e-03 -4.71633934e-03]] Final stress: [ 7.51374327e-04 -1.00448788e-03 1.06179682e-04 -8.57875191e-12 -2.27315376e-12 -8.31231952e-12] Minimization converged after 28 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 8.05089329e-12 2.92716840e-02 -4.22015956e-09] [ 3.31723381e-10 -2.92716840e-02 -2.15416631e-08] [-2.00916341e-02 9.88230608e-10 -4.17539947e-10] [ 3.47587391e-04 7.92065891e-03 -1.50487238e-02] [ 3.47587774e-04 -7.92065916e-03 1.50487236e-02] [ 2.00916341e-02 1.20660681e-08 5.08328607e-09] [-3.47601737e-04 -7.92066729e-03 -1.50487170e-02] [-3.47576614e-04 7.92065278e-03 1.50487290e-02] [-1.28069767e-03 -8.17573918e-03 4.87823370e-03] [ 1.28069914e-03 8.17573956e-03 4.87825120e-03] [-1.28069815e-03 8.17574150e-03 -4.87823835e-03] [ 1.28069953e-03 -8.17574023e-03 -4.87823726e-03]] Final stress: [-7.94884134e-04 5.40495222e-04 8.84746902e-05 -3.23499015e-12 3.03533756e-12 6.53287901e-12] Minimization converged after 6 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.43302940e-02 -4.18254879e-03 -1.75466206e-04] [ 2.43302940e-02 4.18254879e-03 1.75466263e-04] [-5.38490270e-02 -2.88971301e-11 1.18871499e-11] [-6.30667755e-03 -3.19225604e-02 4.30011605e-03] [-6.30667766e-03 3.19225605e-02 -4.30011600e-03] [ 2.52851904e-02 -1.12948212e-12 -5.27488141e-12] [-3.67000359e-02 2.31024550e-02 -9.34362462e-04] [-3.67000360e-02 -2.31024549e-02 9.34362428e-04] [ 1.23610675e-02 1.08965490e-01 4.34258880e-03] [ 2.05972703e-02 1.26140649e-01 4.28742906e-03] [ 1.23610675e-02 -1.08965491e-01 -4.34258878e-03] [ 2.05972703e-02 -1.26140649e-01 -4.28742915e-03]] Final stress: [-1.74051760e-03 -2.27288509e-03 -2.47042223e-04 -2.53501284e-03 -1.00553744e-13 1.15042927e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.43285475e-02 -4.18238521e-03 1.75455573e-04] [-2.43285475e-02 4.18238520e-03 -1.75455974e-04] [-2.52866683e-02 6.33914382e-12 1.08227924e-12] [ 3.66995281e-02 -2.30995847e-02 -9.35471880e-04] [ 3.66995280e-02 2.30995848e-02 9.35471951e-04] [ 5.38443795e-02 1.56266717e-10 6.36830680e-11] [ 6.30736622e-03 3.19233101e-02 4.30118829e-03] [ 6.30736653e-03 -3.19233103e-02 -4.30118814e-03] [-2.05965447e-02 -1.26140564e-01 4.28746750e-03] [-1.23606579e-02 -1.08966046e-01 4.34262615e-03] [-2.05965447e-02 1.26140564e-01 -4.28746751e-03] [-1.23606579e-02 1.08966046e-01 -4.34262602e-03]] Final stress: [-1.74044637e-03 -2.27279475e-03 -2.47029247e-04 2.53495879e-03 -9.63669389e-14 2.06286722e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.89436877e-13 -2.01516276e-02 -9.98896299e-12] [ 7.44822514e-12 -2.85126119e-02 5.11964526e-11] [-2.87194783e-02 2.39199523e-02 2.71919930e-03] [ 2.33398022e-02 -1.49304582e-02 -3.49480060e-03] [ 1.45408914e-02 4.83021334e-02 -1.30492715e-04] [ 2.87194783e-02 2.39199524e-02 -2.71919929e-03] [-1.45408915e-02 4.83021334e-02 1.30492726e-04] [-2.33398023e-02 -1.49304581e-02 3.49480056e-03] [ 1.21663154e-01 -7.91311064e-03 3.94542954e-03] [ 1.13442277e-01 -2.50463973e-02 4.68453135e-03] [-1.13442277e-01 -2.50463973e-02 -4.68453139e-03] [-1.21663154e-01 -7.91311057e-03 -3.94542952e-03]] Final stress: [-2.27285591e-03 -1.74070774e-03 -2.47055340e-04 -1.16818059e-13 -2.53506487e-03 -2.26192003e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-4.40055888e-12 2.85126120e-02 1.36542975e-10] [-4.98482783e-12 2.01516277e-02 -1.41255171e-10] [-2.87194783e-02 -2.39199524e-02 -2.71919922e-03] [ 1.45408916e-02 -4.83021335e-02 1.30492731e-04] [ 2.33398022e-02 1.49304582e-02 3.49480059e-03] [ 2.87194783e-02 -2.39199524e-02 2.71919918e-03] [-2.33398021e-02 1.49304582e-02 -3.49480064e-03] [-1.45408916e-02 -4.83021336e-02 -1.30492710e-04] [-1.13442277e-01 2.50463974e-02 4.68453139e-03] [-1.21663154e-01 7.91311059e-03 3.94542953e-03] [ 1.21663154e-01 7.91311060e-03 -3.94542936e-03] [ 1.13442277e-01 2.50463973e-02 -4.68453148e-03]] Final stress: [-2.27285592e-03 -1.74070774e-03 -2.47055340e-04 1.78015679e-13 2.53506487e-03 2.15123845e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-7.90728594e-10 3.98838888e-03 -2.34155066e-08] [-1.01103752e-09 -3.98838931e-03 -2.47193397e-07] [-1.14409131e-03 -6.50326357e-08 2.81541399e-08] [-5.53853174e-04 1.37788733e-03 -2.57467432e-03] [-5.54027312e-04 -1.37778752e-03 2.57475742e-03] [ 1.14408974e-03 2.73598038e-08 1.21338582e-08] [ 5.53931357e-04 -1.37784270e-03 -2.57471035e-03] [ 5.54019286e-04 1.37779239e-03 2.57475225e-03] [ 7.08107257e-04 -3.74600303e-04 -6.77644745e-04] [-7.08142029e-04 3.74602911e-04 -6.77569492e-04] [ 7.08101781e-04 3.74622623e-04 6.77727373e-04] [-7.08133793e-04 -3.74636628e-04 6.77592189e-04]] Final stress: [-4.40997398e-05 1.79571630e-04 6.67114191e-05 5.39064893e-11 -1.10714237e-11 1.17675720e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-4.90857216e-10 -4.45235526e-03 3.40192372e-08] [-1.17322818e-10 4.45235213e-03 -2.94756943e-07] [ 1.04919132e-03 -9.91607192e-08 4.29444819e-08] [ 5.66188619e-04 -1.45848617e-03 2.80663332e-03] [ 5.65994144e-04 1.45859812e-03 -2.80653738e-03] [-1.04919224e-03 3.43507940e-08 1.35707714e-08] [-5.66053854e-04 1.45856160e-03 2.80656992e-03] [-5.66135850e-04 -1.45851596e-03 -2.80660458e-03] [-9.36644197e-04 2.48799619e-04 7.30970009e-04] [ 9.36637161e-04 -2.48845478e-04 7.31040892e-04] [-9.36624900e-04 -2.48877078e-04 -7.30814734e-04] [ 9.36640401e-04 2.48833290e-04 -7.31053238e-04]] Final stress: [ 7.42552200e-05 -1.89576280e-04 -2.56834003e-05 -4.59855046e-12 -7.04209043e-11 -1.35893375e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 6.28678318e-10 -4.12949075e-03 -4.39192116e-09] [-6.46465104e-10 4.12948736e-03 -1.74030044e-07] [ 2.25326113e-03 -6.10777148e-08 2.80471474e-08] [-7.46177888e-05 -2.56893195e-04 2.60762083e-03] [-7.48527128e-05 2.57027192e-04 -2.60750835e-03] [-2.25326152e-03 -2.57967265e-08 -1.07414910e-08] [ 7.47764600e-05 2.56982954e-04 2.60754575e-03] [ 7.46829107e-05 -2.56929488e-04 -2.60758873e-03] [-8.11393682e-04 3.26600174e-04 -7.14901373e-04] [ 8.11387219e-04 -3.26650199e-04 -7.14923309e-04] [-8.11386722e-04 -3.26626655e-04 7.15048920e-04] [ 8.11404723e-04 3.26579481e-04 7.14867382e-04]] Final stress: [ 1.87734703e-04 -4.90821568e-05 6.82776529e-05 -8.61716346e-12 -7.63364349e-11 9.12599884e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-3.96600086e-10 4.29869937e-03 6.09535888e-09] [-6.00478854e-10 -4.29869943e-03 -2.81498492e-07] [-2.52900779e-03 6.03696360e-09 -1.22283486e-09] [ 1.15172731e-04 3.53855697e-04 -2.74121183e-03] [ 1.15126472e-04 -3.53829627e-04 2.74123408e-03] [ 2.52900619e-03 8.63201859e-08 3.72886010e-08] [-1.15223882e-04 -3.53885984e-04 -2.74118595e-03] [-1.15022001e-04 3.53770007e-04 2.74128332e-03] [ 8.32537097e-04 -3.75358545e-04 6.70622348e-04] [-8.32562822e-04 3.75363670e-04 6.70817134e-04] [ 8.32530114e-04 3.75387335e-04 -6.70622016e-04] [-8.32555118e-04 -3.75394844e-04 -6.70697758e-04]] Final stress: [-1.81328765e-04 6.60556093e-05 -2.48126378e-05 3.98875597e-11 7.93382515e-13 1.25999099e-10] Minimization converged after 5 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.88636445e-03 -8.19143665e-03 -5.13143794e-04] [ 2.88636444e-03 8.19143660e-03 5.13144485e-04] [ 3.65395850e-02 -1.13789940e-09 4.85375029e-10] [ 2.02857059e-02 -7.22602790e-02 5.09183286e-02] [ 2.02857005e-02 7.22602820e-02 -5.09183261e-02] [ 1.26754931e-01 -2.27307750e-09 -9.87345940e-10] [-2.68257261e-03 -1.27684778e-02 -3.84474741e-02] [-2.68257663e-03 1.27684801e-02 3.84474721e-02] [-6.16791392e-02 2.12894208e-02 -1.27780460e-02] [-4.04576118e-02 5.45274692e-02 -1.21727593e-02] [-6.16791392e-02 -2.12894209e-02 1.27780488e-02] [-4.04576114e-02 -5.45274711e-02 1.21727558e-02]] Final stress: [-1.59471931e-03 -2.83226091e-03 7.66035083e-04 -4.78221163e-03 -2.11443717e-12 3.77868815e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.86052506e-03 -8.19009593e-03 5.13001073e-04] [-2.86052506e-03 8.19009593e-03 -5.13003235e-04] [-1.26750684e-01 -1.88921472e-10 1.11131429e-10] [ 2.67086100e-03 1.28026488e-02 -3.84661784e-02] [ 2.67086069e-03 -1.28026486e-02 3.84661786e-02] [-3.65907084e-02 -9.33814801e-11 -2.15980280e-11] [-2.02745503e-02 7.22529034e-02 5.09363087e-02] [-2.02745510e-02 -7.22529030e-02 -5.09363090e-02] [ 4.04585813e-02 -5.45859998e-02 -1.21709206e-02] [ 6.16763298e-02 -2.13551659e-02 -1.27759162e-02] [ 4.04585813e-02 5.45859994e-02 1.21709220e-02] [ 6.16763298e-02 2.13551660e-02 1.27759169e-02]] Final stress: [-1.59325769e-03 -2.83063389e-03 7.66586322e-04 4.78154857e-03 -1.10651602e-12 -6.30366256e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.32640768e-12 5.30234064e-03 -1.47025921e-09] [-1.03132355e-11 -1.10644081e-02 -3.22960860e-09] [-2.69828305e-02 1.53126319e-02 5.07145186e-02] [ 6.72179456e-02 -8.99265861e-02 -3.29411153e-02] [-1.80825499e-02 -2.46216362e-02 -2.04360600e-02] [ 2.69828305e-02 1.53126328e-02 -5.07145182e-02] [ 1.80825479e-02 -2.46216373e-02 2.04360610e-02] [-6.72179443e-02 -8.99265868e-02 3.29411160e-02] [ 4.85653575e-02 6.75851706e-02 -1.35609399e-02] [ 2.73428745e-02 3.45314540e-02 -1.13843870e-02] [-2.73428743e-02 3.45314545e-02 1.13843892e-02] [-4.85653571e-02 6.75851701e-02 1.35609404e-02]] Final stress: [-2.83180280e-03 -1.59483385e-03 7.66063983e-04 -1.68342435e-12 -4.78180423e-03 2.02284193e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-6.42606230e-12 1.10808315e-02 3.94443867e-11] [ 2.80332791e-11 -5.28616763e-03 -2.13490804e-09] [-2.69907131e-02 -1.53209302e-02 -5.07013871e-02] [-1.80925213e-02 2.46317757e-02 2.04283481e-02] [ 6.72378286e-02 8.99508857e-02 3.29358188e-02] [ 2.69907131e-02 -1.53209279e-02 5.07013879e-02] [-6.72378294e-02 8.99508852e-02 -3.29358183e-02] [ 1.80925218e-02 2.46317754e-02 -2.04283479e-02] [-2.72355012e-02 -3.45514011e-02 -1.13903316e-02] [-4.84595620e-02 -6.76076628e-02 -1.35670059e-02] [ 4.84595624e-02 -6.76076635e-02 1.35670073e-02] [ 2.72355012e-02 -3.45514004e-02 1.13903309e-02]] Final stress: [-2.83241216e-03 -1.59537547e-03 7.65911532e-04 -2.94783643e-13 4.78268925e-03 -3.08332740e-12] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 8.67860228e-10 1.07454817e-03 -4.50848980e-09] [ 1.61205695e-10 -1.07454869e-03 2.03269027e-07] [-3.55500246e-04 3.30442074e-08 -1.40841028e-08] [ 3.26007655e-05 4.12330625e-04 -5.93773704e-04] [ 3.26158707e-05 -4.12339862e-04 5.93763892e-04] [ 3.55501356e-04 -5.80589622e-08 -2.48838622e-08] [-3.25832916e-05 -4.12320142e-04 -5.93782712e-04] [-3.26684570e-05 4.12369498e-04 5.93739607e-04] [ 3.46946181e-04 2.60946362e-05 -1.17021150e-04] [-3.46931520e-04 -2.61060366e-05 -1.17141968e-04] [ 3.46944207e-04 -2.60860636e-05 1.16990775e-04] [-3.46925894e-04 2.60828748e-05 1.17065467e-04]] Final stress: [ 3.27178852e-06 5.54531808e-05 2.85407645e-05 -2.73118357e-11 -1.26871932e-11 6.59088369e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 2.20863683e-09 -8.31625627e-03 -6.23218485e-08] [ 2.57849003e-09 8.31626042e-03 2.18591102e-08] [ 1.59134511e-03 9.58723201e-09 -2.69910094e-09] [-3.61804793e-03 -5.39183926e-03 3.83439238e-03] [-3.61789654e-03 5.39175453e-03 -3.83445647e-03] [-1.59134337e-03 -5.69089196e-08 -1.94139545e-08] [ 3.61791795e-03 5.39176580e-03 3.83445051e-03] [ 3.61789366e-03 -5.39175042e-03 -3.83445683e-03] [-6.52250437e-03 -8.14764205e-04 1.10574537e-03] [ 6.52258302e-03 8.14804579e-04 1.10572731e-03] [-6.52251500e-03 8.14804117e-04 -1.10570056e-03] [ 6.52256269e-03 -8.14731963e-04 -1.10563915e-03]] Final stress: [ 2.16708850e-04 -3.88525413e-04 -3.04485513e-05 -1.10550868e-10 9.74419994e-11 -6.57462645e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 4.44579290e-10 -1.08739730e-03 3.06770608e-08] [-4.20077972e-10 1.08739469e-03 1.97716661e-07] [ 5.46891072e-04 6.59667310e-08 -2.66307155e-08] [-2.26042806e-05 -1.62161917e-04 6.53153846e-04] [-2.26128178e-05 1.62165285e-04 -6.53153531e-04] [-5.46890537e-04 -6.08575064e-08 -2.64178160e-08] [ 2.26690713e-05 1.62199155e-04 6.53123635e-04] [ 2.25505116e-05 -1.62130801e-04 -6.53182370e-04] [-2.52161430e-04 -7.39173353e-05 -1.15058993e-04] [ 2.52150668e-04 7.38805814e-05 -1.15168411e-04] [-2.52159583e-04 7.39103265e-05 1.15031359e-04] [ 2.52167301e-04 -7.39477937e-05 1.15079119e-04]] Final stress: [ 5.45342849e-05 2.72159914e-06 2.81694188e-05 2.10969235e-12 -6.18327613e-11 1.25084296e-10] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-2.02934469e-09 5.59398436e-03 -7.50543219e-08] [ 1.33859635e-09 -5.59398319e-03 -9.85738249e-07] [-3.41850889e-03 -1.32392106e-07 5.76777676e-08] [ 3.17708755e-04 3.54098891e-04 -3.65450456e-03] [ 3.17450630e-04 -3.53949985e-04 3.65463245e-03] [ 3.41850461e-03 2.81441754e-07 1.21023862e-07] [-3.17805156e-04 -3.54156805e-04 -3.65445553e-03] [-3.17233120e-04 3.53827528e-04 3.65473450e-03] [ 1.17902749e-03 4.69630787e-04 1.86699357e-04] [-1.17908198e-03 -4.69601694e-04 1.87240553e-04] [ 1.17901484e-03 -4.69584937e-04 -1.86574518e-04] [-1.17907649e-03 4.69585995e-04 -1.86890167e-04]] Final stress: [-2.60931636e-04 1.21431916e-04 -1.24589048e-05 8.43698369e-11 3.31420139e-11 1.28225401e-10] Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-1.43055567e-09 2.91974831e-03 1.12886298e-08] [-1.39282423e-09 -2.91974777e-03 -1.23109281e-07] [-8.54777972e-04 -4.72594008e-09 1.86592988e-09] [-2.98961334e-04 8.98810744e-04 -1.93667693e-03] [-2.98965704e-04 -8.98808146e-04 1.93667897e-03] [ 8.54776488e-04 4.58927016e-08 1.94254872e-08] [ 2.98957415e-04 -8.98812751e-04 -1.93667340e-03] [ 2.99060028e-04 8.98753777e-04 1.93672236e-03] [ 6.15310647e-04 -9.94414862e-05 -3.66011127e-04] [-6.15351917e-04 9.94596030e-05 -3.65914202e-04] [ 6.15307546e-04 9.94541345e-05 3.65997140e-04] [-6.15352374e-04 -9.94575754e-05 3.65967725e-04]] Final stress: [-5.14172860e-05 1.23150104e-04 3.82087320e-05 7.14748317e-11 1.34007874e-11 2.22286098e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 7.75768061e-10 -7.90455186e-04 -1.90560961e-08] [ 6.66497246e-10 7.90454666e-04 -1.67522435e-07] [-2.35850956e-04 -3.25308261e-08 1.34020887e-08] [ 4.85361885e-04 -4.19637194e-04 5.46525944e-04] [ 4.85291163e-04 4.19677898e-04 -5.46492869e-04] [ 2.35851094e-04 7.50239177e-08 3.06425520e-08] [-4.85405487e-04 4.19610988e-04 5.46546425e-04] [-4.85290879e-04 -4.19677202e-04 -5.46491854e-04] [-6.81126000e-05 2.35106436e-04 -1.69427454e-04] [ 6.81314475e-05 -2.35119982e-04 -1.69337430e-04] [-6.81106576e-05 -2.35114956e-04 1.69434691e-04] [ 6.81335484e-05 2.35112038e-04 1.69385080e-04]] Final stress: [-1.04850977e-05 -5.65909349e-05 -5.23508070e-06 -3.57571817e-11 -1.37467636e-11 -1.91276940e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.05599911e-09 -2.95538914e-03 7.67529262e-10] [ 4.14328405e-10 2.95538682e-03 -1.52414581e-07] [ 1.44559881e-03 -4.04072982e-08 1.85905223e-08] [-3.79684603e-05 -2.77731176e-04 1.94966241e-03] [-3.81180808e-05 2.77816522e-04 -1.94959046e-03] [-1.44559874e-03 1.90525817e-09 7.88775489e-10] [ 3.80371964e-05 2.77769171e-04 1.94962939e-03] [ 3.79987959e-05 -2.77747494e-04 -1.94964612e-03] [-6.66304317e-04 1.74074153e-05 -3.64970871e-04] [ 6.66320499e-04 -1.74465930e-05 -3.64954625e-04] [-6.66298498e-04 -1.74300660e-05 3.65065185e-04] [ 6.66331320e-04 1.74030513e-05 3.64937352e-04]] Final stress: [ 1.25902873e-04 -5.41150784e-05 3.81925647e-05 -4.08634954e-11 -5.38321481e-11 4.30921576e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-7.81715359e-10 7.79140509e-04 4.59603582e-08] [-5.37469853e-10 -7.79138463e-04 -1.08225627e-07] [-7.39009237e-04 -4.68020620e-08 1.93332030e-08] [-7.26875386e-06 -4.12406211e-04 -5.42796722e-04] [-7.28730276e-06 4.12417760e-04 5.42808066e-04] [ 7.39008142e-04 -3.05945788e-08 -1.15172850e-08] [ 7.30429907e-06 4.12427196e-04 -5.42813816e-04] [ 7.29380916e-06 -4.12420547e-04 5.42809393e-04] [ 5.45063451e-05 -2.46840058e-04 -1.70127023e-04] [-5.45189838e-05 2.46873770e-04 -1.70078912e-04] [ 5.45004524e-05 2.46863118e-04 1.70175205e-04] [-5.45274517e-05 -2.46839678e-04 1.70078258e-04]] Final stress: [-5.59071790e-05 -1.10951746e-05 -5.20928650e-06 3.39119731e-11 4.83965699e-11 -2.30807919e-11] Minimization converged after 6 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.74843335e-02 -5.46740246e-03 -2.18418236e-04] [-2.74843335e-02 5.46740243e-03 2.18417567e-04] [ 1.02169634e-01 -2.47113186e-10 9.38947727e-11] [-3.66700049e-02 -9.77184278e-02 4.88021410e-02] [-3.66700055e-02 9.77184282e-02 -4.88021407e-02] [ 1.32973898e-01 2.37434637e-10 9.96796097e-11] [-4.08396009e-02 -8.33006322e-02 -3.59832197e-02] [-4.08396006e-02 8.33006321e-02 3.59832198e-02] [-1.20659213e-02 1.59972191e-03 -1.69136907e-02] [-5.11905514e-04 2.51563821e-02 -1.65253145e-02] [-1.20659212e-02 -1.59972202e-03 1.69136909e-02] [-5.11905453e-04 -2.51563823e-02 1.65253144e-02]] Final stress: [-2.49022656e-04 -1.10120489e-03 1.22789561e-03 -4.39230445e-03 -1.87092619e-13 5.84822819e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 2.74843339e-02 -5.46740258e-03 2.18418064e-04] [ 2.74843339e-02 5.46740255e-03 -2.18418601e-04] [-1.32973900e-01 -1.72776216e-10 3.42369726e-11] [ 4.08396013e-02 8.33006334e-02 -3.59832199e-02] [ 4.08396010e-02 -8.33006332e-02 3.59832200e-02] [-1.02169635e-01 6.90672577e-12 1.19015480e-11] [ 3.66700055e-02 9.77184288e-02 4.88021414e-02] [ 3.66700057e-02 -9.77184289e-02 -4.88021413e-02] [ 5.11905513e-04 -2.51563824e-02 -1.65253150e-02] [ 1.20659213e-02 -1.59972178e-03 -1.69136908e-02] [ 5.11905440e-04 2.51563826e-02 1.65253152e-02] [ 1.20659213e-02 1.59972180e-03 1.69136909e-02]] Final stress: [-2.49022645e-04 -1.10120490e-03 1.22789565e-03 4.39230449e-03 1.85947393e-14 1.64560682e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.91450557e-11 3.28200108e-02 9.19997428e-11] [ 1.62121637e-12 2.19524783e-02 -3.68625648e-10] [-4.64470285e-03 9.02830079e-02 4.83783026e-02] [ 9.83779175e-02 -7.52296102e-02 -3.12647280e-02] [-8.25633672e-02 -5.50078875e-02 -1.84857667e-02] [ 4.64470280e-03 9.02830078e-02 -4.83783026e-02] [ 8.25633670e-02 -5.50078876e-02 1.84857668e-02] [-9.83779175e-02 -7.52296103e-02 3.12647280e-02] [ 1.91043581e-02 1.79624644e-02 -1.71430171e-02] [ 7.61883849e-03 -5.39421906e-03 -1.60939643e-02] [-7.61883846e-03 -5.39421890e-03 1.60939647e-02] [-1.91043580e-02 1.79624644e-02 1.71430169e-02]] Final stress: [-1.10009881e-03 -2.52688578e-04 1.21888750e-03 -3.15303284e-13 -4.38038904e-03 3.13262929e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.63678171e-12 -2.19822886e-02 4.20342215e-11] [-8.00938138e-12 -3.28737780e-02 1.14727316e-11] [-4.61986781e-03 -9.04078525e-02 -4.84262889e-02] [-8.26867311e-02 5.51016206e-02 1.84974135e-02] [ 9.85024991e-02 7.53063557e-02 3.13056675e-02] [ 4.61986792e-03 -9.04078526e-02 4.84262888e-02] [-9.85024990e-02 7.53063558e-02 -3.13056676e-02] [ 8.26867312e-02 5.51016206e-02 -1.84974135e-02] [-7.61256273e-03 5.41869285e-03 -1.61353197e-02] [-1.91250684e-02 -1.79907833e-02 -1.71878917e-02] [ 1.91250683e-02 -1.79907833e-02 1.71878919e-02] [ 7.61256256e-03 5.41869274e-03 1.61353196e-02]] Final stress: [-1.10052544e-03 -2.51171956e-04 1.22273346e-03 3.18801317e-13 4.38547690e-03 2.25001152e-13] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 5.64581715e-11 4.37613523e-04 1.05016567e-08] [ 7.42529094e-11 -4.37613137e-04 2.26457385e-07] [-1.65623374e-04 5.86988038e-08 -2.54181758e-08] [ 3.36175881e-04 3.33021038e-04 -1.13878346e-04] [ 3.36292007e-04 -3.33087868e-04 1.13821198e-04] [ 1.65624166e-04 -3.24374265e-08 -1.41944313e-08] [-3.36211474e-04 -3.33040657e-04 -1.13861633e-04] [-3.36262636e-04 3.33070250e-04 1.13835458e-04] [ 4.52417375e-04 -9.42004098e-05 -3.64023449e-05] [-4.52413421e-04 9.42050632e-05 -3.64818454e-05] [ 4.52416731e-04 9.42031423e-05 3.63232367e-05] [-4.52415387e-04 -9.41972051e-05 3.64469312e-05]] Final stress: [ 1.47312922e-06 2.69798858e-05 1.74445441e-05 -4.23751717e-12 9.04400896e-12 -1.06783184e-11] Minimization converged after 5 steps. Minimization converged after 8 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 44 steps. Minimization converged after 44 steps. Minimization converged after 38 steps. Minimization converged after 39 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.59005955e-03 1.92744060e-05 2.88674196e-06] [-1.59005952e-03 -1.92744386e-05 2.87615215e-06] [ 6.11319782e-04 1.68064619e-04 -1.21057117e-03] [-7.89660364e-04 8.66673266e-04 4.77779627e-04] [-3.62546397e-04 1.97548086e-04 7.30393887e-04] [-6.11319778e-04 -1.68068052e-04 -1.21057261e-03] [ 7.89663586e-04 -8.66671468e-04 4.77778084e-04] [ 3.62542842e-04 -1.97545983e-04 7.30392168e-04] [-4.64263904e-04 -4.22763066e-05 -3.50209267e-04] [ 4.64264009e-04 4.22760574e-05 -3.50206745e-04] [-5.75524809e-05 -1.89747624e-04 3.49730305e-04] [ 5.75526746e-05 1.89747438e-04 3.49722825e-04]] Final stress: [ 4.19172775e-05 3.83949230e-05 3.56322912e-05 -2.58692742e-13 -3.83372987e-13 -4.43238354e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.58914345e-03 1.92199091e-05 -2.86737197e-06] [ 1.58914350e-03 -1.92200260e-05 -2.85801451e-06] [ 6.10963291e-04 -1.68336330e-04 1.21003023e-03] [-3.61083180e-04 -1.96979715e-04 -7.29484871e-04] [-7.87840246e-04 -8.67323544e-04 -4.78180484e-04] [-6.10963216e-04 1.68378351e-04 1.21004771e-03] [ 3.61048594e-04 1.96959712e-04 -7.29468177e-04] [ 7.87873369e-04 8.67304329e-04 -4.78164422e-04] [-5.56368249e-05 1.88911787e-04 -3.49844044e-04] [ 5.56371198e-05 -1.88913334e-04 -3.49822121e-04] [-4.63328414e-04 4.21537494e-05 3.50290453e-04] [ 4.63329459e-04 -4.21548881e-05 3.50321122e-04]] Final stress: [ 4.18866322e-05 3.83874213e-05 3.56241919e-05 -7.43852427e-13 -2.50071855e-12 4.42953449e-05] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-1.05885010e-03 -2.81319447e-06 -7.70777097e-10] [-1.05885010e-03 2.81320286e-06 6.32857719e-10] [ 1.48222123e-03 -1.69091749e-10 6.19408578e-11] [-7.99096199e-05 -1.45811451e-03 1.57884539e-03] [-7.99095045e-05 1.45811445e-03 -1.57884544e-03] [ 2.13241187e-03 6.28607739e-11 3.03285289e-11] [-4.03958625e-04 -9.08163360e-04 -1.56974523e-03] [-4.03958437e-04 9.08163246e-04 1.56974533e-03] [-1.33150377e-04 1.12824716e-03 -1.54520657e-03] [-1.31447946e-04 1.14580001e-03 -1.54520475e-03] [-1.33150375e-04 -1.12824711e-03 1.54520650e-03] [-1.31448008e-04 -1.14579979e-03 1.54520482e-03]] Final stress: [-1.78373359e-05 -1.82888579e-05 2.84516011e-05 -8.58381442e-05 2.11136918e-13 -3.20769254e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 1.05874225e-03 -2.81255475e-06 1.09865278e-09] [ 1.05874226e-03 2.81255568e-06 -1.20562153e-09] [-2.13174338e-03 2.28047698e-11 -1.09060670e-11] [ 4.03893669e-04 9.07629447e-04 -1.56950875e-03] [ 4.03893885e-04 -9.07629571e-04 1.56950865e-03] [-1.48142582e-03 1.34465881e-10 5.77400263e-11] [ 7.97804480e-05 1.45769115e-03 1.57860713e-03] [ 7.97805418e-05 -1.45769121e-03 -1.57860708e-03] [ 1.31233355e-04 -1.14514472e-03 -1.54594805e-03] [ 1.32934717e-04 -1.12759356e-03 -1.54594926e-03] [ 1.31233382e-04 1.14514465e-03 1.54594799e-03] [ 1.32934690e-04 1.12759366e-03 1.54594942e-03]] Final stress: [-1.78436849e-05 -1.82951085e-05 2.84617076e-05 8.58293604e-05 5.00472624e-15 -3.33548278e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.80114276e-12 1.06161618e-03 -1.30627039e-10] [-3.94670409e-13 1.05598977e-03 -6.72149444e-10] [-3.17253665e-04 9.25018373e-04 1.81783467e-03] [ 1.34239112e-03 -1.40570503e-03 -9.13475331e-04] [-1.02409075e-03 -8.43075438e-04 -9.04375001e-04] [ 3.17253664e-04 9.25018514e-04 -1.81783460e-03] [ 1.02409031e-03 -8.43075689e-04 9.04375212e-04] [-1.34239077e-03 -1.40570522e-03 9.13475502e-04] [ 1.13750791e-03 1.41256070e-04 -1.54528208e-03] [ 1.13580506e-03 1.23703187e-04 -1.54527418e-03] [-1.13580506e-03 1.23703344e-04 1.54527461e-03] [-1.13750781e-03 1.41255935e-04 1.54528200e-03]] Final stress: [-1.82943303e-05 -1.78427981e-05 2.84503212e-05 -8.11254397e-14 -8.58418172e-05 5.73202749e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.34403161e-12 -1.05472814e-03 1.75281315e-10] [ 1.14736864e-12 -1.06033034e-03 -1.51635936e-10] [-3.17527118e-04 -9.14928274e-04 -1.81378737e-03] [-1.01234786e-03 8.32806403e-04 9.02367601e-04] [ 1.33089695e-03 1.39590570e-03 9.11435134e-04] [ 3.17527120e-04 -9.14928588e-04 1.81378726e-03] [-1.33089685e-03 1.39590576e-03 -9.11435176e-04] [ 1.01234763e-03 8.32806535e-04 -9.02367696e-04] [-1.12899668e-03 -1.19365761e-04 -1.55816821e-03] [-1.13067123e-03 -1.36888780e-04 -1.55817532e-03] [ 1.13067127e-03 -1.36888706e-04 1.55817559e-03] [ 1.12899675e-03 -1.19365808e-04 1.55816817e-03]] Final stress: [-1.83528677e-05 -1.79032997e-05 2.86488131e-05 -9.06376736e-14 8.56205850e-05 2.72762394e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.05677470e-03 -7.52549383e-06 7.81882438e-07] [-1.05677461e-03 7.52551432e-06 7.78614793e-07] [ 2.32732428e-04 -9.54478054e-05 -7.63127764e-04] [ 1.15839415e-05 6.63894705e-04 5.28749123e-04] [ 4.32012017e-04 -1.30905372e-04 2.33472810e-04] [-2.32732376e-04 9.54595413e-05 -7.63122833e-04] [-1.15957009e-05 -6.63901492e-04 5.28754748e-04] [-4.32002777e-04 1.30900145e-04 2.33477318e-04] [ 4.49986612e-04 -3.43288424e-04 -1.16506258e-04] [-4.49985319e-04 3.43288169e-04 -1.16496822e-04] [ 2.11377575e-04 -1.94472865e-04 1.16616406e-04] [-2.11376484e-04 1.94473378e-04 1.16622774e-04]] Final stress: [ 1.67872465e-05 2.26460420e-05 2.08297992e-05 -2.48035396e-12 5.30057300e-13 -3.31209443e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.05846948e-03 -7.54000903e-06 -7.47189395e-07] [ 1.05846980e-03 7.54027468e-06 -7.22549097e-07] [ 2.26917655e-04 8.85879588e-05 7.66428083e-04] [ 4.32751550e-04 1.23491734e-04 -2.34988740e-04] [ 1.73932760e-05 -6.61708475e-04 -5.30592879e-04] [-2.26917392e-04 -8.85640114e-05 7.66438168e-04] [-4.32783229e-04 -1.23509905e-04 -2.34973840e-04] [-1.73701160e-05 6.61695251e-04 -5.30581745e-04] [ 2.05697002e-04 1.87961296e-04 -1.16715719e-04] [-2.05692073e-04 -1.87958785e-04 -1.16708461e-04] [ 4.56386081e-04 3.36959630e-04 1.16567200e-04] [-4.56383076e-04 -3.36954959e-04 1.16597672e-04]] Final stress: [ 1.64399198e-05 2.23043728e-05 2.06686459e-05 -6.99112940e-12 6.38219797e-12 3.31348655e-05] Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 2 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-5.34240194e-03 -1.43782072e-04 -8.74647703e-07] [-5.34240192e-03 1.43782075e-04 8.74402381e-07] [ 1.34283876e-02 5.09911967e-11 -3.65319318e-11] [-5.66455803e-04 -1.22304644e-02 9.40300826e-03] [-5.66455641e-04 1.22304644e-02 -9.40300839e-03] [ 1.84951761e-02 1.59700371e-10 9.63459023e-11] [-2.83256381e-03 -8.16510439e-03 -9.07907557e-03] [-2.83256342e-03 8.16510419e-03 9.07907576e-03] [-3.74931390e-03 3.99920185e-03 -1.08643189e-03] [-3.47104670e-03 4.58786933e-03 -1.08509248e-03] [-3.74931388e-03 -3.99920179e-03 1.08643179e-03] [-3.47104668e-03 -4.58786934e-03 1.08509270e-03]] Final stress: [-1.29000473e-04 -1.50549232e-04 -7.63315759e-06 -6.68019934e-04 -2.46590518e-14 1.10431032e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 5.34122808e-03 -1.43721681e-04 8.74023159e-07] [ 5.34122807e-03 1.43721669e-04 -8.74031090e-07] [-1.84874694e-02 -8.10869886e-11 2.60678869e-11] [ 2.83144150e-03 8.16176218e-03 -9.07676023e-03] [ 2.83144136e-03 -8.16176212e-03 9.07676027e-03] [-1.34228218e-02 -7.85233114e-11 2.66789595e-12] [ 5.66290728e-04 1.22253992e-02 9.40052776e-03] [ 5.66290593e-04 -1.22253991e-02 -9.40052781e-03] [ 3.46902093e-03 -4.58691245e-03 -1.08631840e-03] [ 3.74716450e-03 -3.99851568e-03 -1.08765653e-03] [ 3.46902095e-03 4.58691242e-03 1.08631851e-03] [ 3.74716448e-03 3.99851570e-03 1.08765640e-03]] Final stress: [-1.28949106e-04 -1.50487899e-04 -7.59867785e-06 6.67857552e-04 6.57456661e-15 3.47239157e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-8.53743300e-12 5.48514406e-03 -6.13248826e-11] [ 9.83238577e-13 5.19769062e-03 -3.12651377e-11] [-2.25744754e-03 7.58409926e-03 1.06660402e-02] [ 1.14573667e-02 -1.21866297e-02 -5.49786967e-03] [-8.93273214e-03 -7.95413318e-03 -5.17406372e-03] [ 2.25744756e-03 7.58409931e-03 -1.06660402e-02] [ 8.93273209e-03 -7.95413318e-03 5.17406372e-03] [-1.14573666e-02 -1.21866297e-02 5.49786970e-03] [ 4.43245919e-03 3.90181638e-03 -1.08860852e-03] [ 4.15430260e-03 3.31342991e-03 -1.08410406e-03] [-4.15430262e-03 3.31342992e-03 1.08410411e-03] [-4.43245922e-03 3.90181637e-03 1.08860848e-03]] Final stress: [-1.50508229e-04 -1.28968201e-04 -7.61696991e-06 3.84189827e-14 -6.67878325e-04 8.38734199e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.04907661e-11 -5.19801628e-03 -6.99025878e-11] [ 3.83211960e-12 -5.48550876e-03 2.37593728e-10] [-2.25738675e-03 -7.58384630e-03 -1.06673594e-02] [-8.93374540e-03 7.95615078e-03 5.17469438e-03] [ 1.14583545e-02 1.21885837e-02 5.49855974e-03] [ 2.25738680e-03 -7.58384638e-03 1.06673594e-02] [-1.14583545e-02 1.21885837e-02 -5.49855974e-03] [ 8.93374523e-03 7.95615085e-03 -5.17469445e-03] [-4.15356093e-03 -3.31532476e-03 -1.08449495e-03] [-4.43175659e-03 -3.90380088e-03 -1.08900079e-03] [ 4.43175662e-03 -3.90380088e-03 1.08900072e-03] [ 4.15356101e-03 -3.31532475e-03 1.08449500e-03]] Final stress: [-1.50508821e-04 -1.28965425e-04 -7.60526266e-06 -9.11733243e-14 6.67937191e-04 -1.41078832e-13] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 2 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-3.22367416e-03 -3.96441464e-05 -1.23345710e-07] [-3.22367416e-03 3.96441577e-05 1.23239758e-07] [ 1.52400974e-03 -1.89266944e-11 1.58786478e-11] [-4.15541623e-04 -3.29429374e-03 4.34063035e-03] [-4.15541574e-04 3.29429370e-03 -4.34063034e-03] [ 4.11481808e-03 -2.31116470e-11 -2.46994679e-11] [-1.64475438e-03 -1.15109056e-03 -4.27198614e-03] [-1.64475443e-03 1.15109053e-03 4.27198615e-03] [ 1.19898699e-03 4.18977938e-03 -6.59514522e-03] [ 1.26556924e-03 4.34160267e-03 -6.59505397e-03] [ 1.19898705e-03 -4.18977934e-03 6.59514529e-03] [ 1.26556922e-03 -4.34160260e-03 6.59505401e-03]] Final stress: [-8.78107372e-05 -9.30537386e-05 9.11105872e-05 -3.04421522e-04 -3.29430236e-14 7.95884724e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.22248798e-03 -3.96251687e-05 1.23238325e-07] [ 3.22248798e-03 3.96251766e-05 -1.23305976e-07] [-4.11531193e-03 -4.30895704e-11 2.04265359e-11] [ 1.64371945e-03 1.15311166e-03 -4.27107976e-03] [ 1.64371945e-03 -1.15311164e-03 4.27107978e-03] [-1.52723813e-03 2.08501465e-11 -2.37772770e-12] [ 4.15858093e-04 3.29400662e-03 4.33969468e-03] [ 4.15858071e-04 -3.29400661e-03 -4.33969469e-03] [-1.26367858e-03 -4.33944676e-03 -6.58783459e-03] [-1.19711188e-03 -4.18769472e-03 -6.58792580e-03] [-1.26367859e-03 4.33944672e-03 6.58783461e-03] [-1.19711191e-03 4.18769474e-03 6.58792581e-03]] Final stress: [-8.77075549e-05 -9.29484336e-05 9.10279257e-05 3.04370794e-04 9.04780416e-14 -1.00740522e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.45314871e-12 3.26224572e-03 -2.57814932e-11] [ 4.79446008e-12 3.18299519e-03 -9.47575042e-11] [-1.21497904e-03 2.31308629e-03 4.97110337e-03] [ 2.86359958e-03 -2.63932352e-03 -2.52023655e-03] [-1.58245351e-03 -4.34468917e-04 -2.45162003e-03] [ 1.21497901e-03 2.31308626e-03 -4.97110338e-03] [ 1.58245358e-03 -4.34468868e-04 2.45162003e-03] [-2.86359948e-03 -2.63932359e-03 2.52023661e-03] [ 4.29662883e-03 -1.15508182e-03 -6.59179436e-03] [ 4.23007117e-03 -1.30683241e-03 -6.59123756e-03] [-4.23007128e-03 -1.30683244e-03 6.59123762e-03] [-4.29662886e-03 -1.15508189e-03 6.59179439e-03]] Final stress: [-9.30195114e-05 -8.77787714e-05 9.10590351e-05 2.28006043e-13 -3.04367363e-04 -4.61754529e-14] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 3.90569120e-12 -3.18351254e-03 -2.06590439e-11] [ 4.79071341e-12 -3.26278322e-03 -1.27805505e-10] [-1.21474524e-03 -2.31333000e-03 -4.97176704e-03] [-1.58263888e-03 4.34546991e-04 2.45194429e-03] [ 2.86356721e-03 2.63902252e-03 2.52057625e-03] [ 1.21474523e-03 -2.31333004e-03 4.97176704e-03] [-2.86356726e-03 2.63902247e-03 -2.52057621e-03] [ 1.58263877e-03 4.34547070e-04 -2.45194434e-03] [-4.23145782e-03 1.30734830e-03 -6.59169479e-03] [-4.29803182e-03 1.15556005e-03 -6.59225172e-03] [ 4.29803190e-03 1.15556008e-03 6.59225183e-03] [ 4.23145791e-03 1.30734831e-03 6.59169484e-03]] Final stress: [-9.30083605e-05 -8.77663315e-05 9.10746182e-05 -1.29520786e-13 3.04398518e-04 2.58257882e-14] Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. Minimization converged after 4 steps. Minimization converged after 3 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-1.33028684e-03 -3.53982473e-06 -1.99465050e-09] [-1.33028683e-03 3.53983608e-06 2.54006665e-09] [ 2.24083827e-03 4.01627542e-10 -1.64859456e-10] [-2.91014707e-04 -1.14647716e-03 1.88990990e-03] [-2.91013655e-04 1.14647655e-03 -1.88991038e-03] [ 1.88418366e-03 -3.08002707e-10 -1.12481272e-10] [-1.06497359e-04 -1.46462165e-03 -1.88214623e-03] [-1.06497633e-04 1.46462181e-03 1.88214613e-03] [-1.70830908e-04 2.93061822e-03 -6.56732909e-04] [-1.63881492e-04 2.94650355e-03 -6.56730865e-04] [-1.70830954e-04 -2.93061808e-03 6.56732834e-04] [-1.63881550e-04 -2.94650334e-03 6.56731257e-04]] Final stress: [ 1.50708082e-05 1.45244141e-05 2.82226836e-05 -8.75390159e-05 3.19483002e-13 -1.09631687e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 1.33032890e-03 -3.53966661e-06 3.16676267e-09] [ 1.33032891e-03 3.53968275e-06 -2.90308306e-09] [-1.88361332e-03 -1.82416446e-11 -6.37028043e-12] [ 1.06290503e-04 1.46413205e-03 -1.88217507e-03] [ 1.06291156e-04 -1.46413242e-03 1.88217476e-03] [-2.24022080e-03 1.39803999e-10 4.87486944e-11] [ 2.90783391e-04 1.14602800e-03 1.88993797e-03] [ 2.90783434e-04 -1.14602803e-03 -1.88993795e-03] [ 1.63782546e-04 -2.94685786e-03 -6.57289852e-04] [ 1.70731392e-04 -2.93097290e-03 -6.57290692e-04] [ 1.63782583e-04 2.94685774e-03 6.57289631e-04] [ 1.70731311e-04 2.93097328e-03 6.57290904e-04]] Final stress: [ 1.50675057e-05 1.45211501e-05 2.82310178e-05 8.75307959e-05 1.76970924e-13 -1.00881691e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[-2.14087946e-12 1.33376925e-03 1.53892672e-10] [-9.49518354e-12 1.32668897e-03 -6.93243831e-10] [ 1.85540971e-04 9.53514718e-04 2.17768343e-03] [ 1.21674389e-03 -1.15320797e-03 -1.09273662e-03] [-1.39609424e-03 -1.46530143e-03 -1.08497103e-03] [-1.85540969e-04 9.53514879e-04 -2.17768336e-03] [ 1.39609408e-03 -1.46530153e-03 1.08497111e-03] [-1.21674317e-03 -1.15320837e-03 1.09273695e-03] [ 2.94130677e-03 1.75326428e-04 -6.57181253e-04] [ 2.93435623e-03 1.59439387e-04 -6.57162790e-04] [-2.93435655e-03 1.59439479e-04 6.57163209e-04] [-2.94130700e-03 1.75326190e-04 6.57180894e-04]] Final stress: [ 1.45108084e-05 1.50572773e-05 2.82242582e-05 4.48452199e-13 -8.75550186e-05 6.46809353e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 7 steps. Final forces: [[ 6.00928051e-12 -1.32680569e-03 -2.60651514e-10] [ 8.18119800e-12 -1.33388459e-03 -1.59728523e-11] [ 1.85978546e-04 -9.51701409e-04 -2.17777065e-03] [-1.39456934e-03 1.46447239e-03 1.08501669e-03] [ 1.21477905e-03 1.15162090e-03 1.09277849e-03] [-1.85978529e-04 -9.51700726e-04 2.17777091e-03] [-1.21477952e-03 1.15162062e-03 -1.09277827e-03] [ 1.39456940e-03 1.46447235e-03 -1.08501665e-03] [-2.93591379e-03 -1.59081904e-04 -6.56380833e-04] [-2.94286205e-03 -1.74965083e-04 -6.56398846e-04] [ 2.94286228e-03 -1.74965203e-04 6.56398618e-04] [ 2.93591395e-03 -1.59081663e-04 6.56380820e-04]] Final stress: [ 1.45395495e-05 1.50858519e-05 2.82235582e-05 -3.83264653e-13 8.75207639e-05 -7.89876135e-13] Minimization converged after 4 steps. Minimization converged after 4 steps. Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.001,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.96051 -0.00602 0.30231 -0. 0. -0. ] [ -0.00602 0.94107 0.30413 -0. -0. -0. ] [ 0.30231 0.30413 2.25774 -0. -0. 0. ] [ -0. -0. -0. -15.77007 -0. -0. ] [ 0. -0. -0. -0. 0.28583 -0. ] [ -0. -0. 0. -0. -0. 0.43348]] 95%% Error estimate [ASE units]: [[ 0.10541 0.27779 0.02413 0.0002 0.00009 0.00038] [ 0.27779 0.07346 0.05187 0.00063 0. 0.00028] [ 0.02413 0.05187 0.00004 0.00001 0. 0.00002] [ 0.0002 0.00063 0.00001 20.75522 0. 0. ] [ 0.00009 0. 0. 0. 92.43154 0. ] [ 0.00038 0.00028 0.00002 0. 0. 2.72389]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 46.215770 is too big compared to maximum elastic constant component 15.770068 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 16.055902 WARNING: Maximum deviation from material symmetry according to space group 182 is too big compared to maximum elastic constant component 15.770068 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. Minimization converged after 19 steps. Minimization converged after 23 steps. Minimization converged after 21 steps. Minimization converged after 21 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 25 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 22 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 22 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-0.00310667 0.0313772 -0.2090343 ] [ 0.00310667 -0.0313772 -0.2090343 ] [ 0.16040027 -0.1496641 -0.07047701] [ 0.21735078 0.36852237 0.18460888] [ 0.03461087 -0.12598725 0.03107024] [-0.16040027 0.1496641 -0.07047701] [-0.21735078 -0.36852237 0.18460888] [-0.03461087 0.12598725 0.03107024] [ 0.15475574 -0.0698404 0.13315816] [-0.15475574 0.0698404 0.13315816] [ 0.18781163 -0.04662525 -0.06932598] [-0.18781163 0.04662525 -0.06932598]] Final stress: [ 7.04888983e-03 1.50445714e-02 1.16409871e-02 -6.13414908e-13 -9.80697525e-13 -8.78217953e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 0.00310635 0.03137715 0.20903497] [-0.00310635 -0.03137715 0.20903497] [ 0.16039981 0.14966535 0.07047592] [ 0.03461207 0.12598717 -0.03106957] [ 0.21735159 -0.36852307 -0.18460907] [-0.16039981 -0.14966534 0.07047592] [-0.03461207 -0.12598717 -0.03106957] [-0.21735159 0.36852306 -0.18460907] [ 0.1878132 0.04662464 0.06932603] [-0.1878132 -0.04662464 0.06932603] [ 0.15475572 0.0698405 -0.13315828] [-0.15475572 -0.0698405 -0.13315828]] Final stress: [7.04886692e-03 1.50445518e-02 1.16409558e-02 1.10591527e-12 8.54117727e-13 8.78218780e-04] Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 29 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 23 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 23 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 26 steps. Minimization converged after 28 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-4.82389684e-11 4.60814819e-02 -9.89346161e-10] [ 3.03844533e-10 -4.60814821e-02 -1.04514211e-08] [-2.13673773e-02 -4.94029484e-09 2.09917747e-09] [-1.83026170e-02 4.13031600e-02 -4.43310017e-02] [-1.83026298e-02 -4.13031526e-02 4.43310078e-02] [ 2.13673772e-02 -4.87638208e-10 -2.06724762e-10] [ 1.83026239e-02 -4.13031560e-02 -4.43310050e-02] [ 1.83026237e-02 4.13031561e-02 4.43310049e-02] [ 6.88660269e-03 -3.92081540e-04 1.61654952e-02] [-6.88660338e-03 3.92080679e-04 1.61654952e-02] [ 6.88660248e-03 3.92081893e-04 -1.61654889e-02] [-6.88660282e-03 -3.92082994e-04 -1.61654978e-02]] Final stress: [ 3.55523789e-04 2.56718129e-03 1.75542340e-03 -6.93656838e-14 -4.55198019e-12 5.98954516e-12] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 42 steps. Minimization converged after 41 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 9.93398031e-10 9.12054794e-02 1.64743783e-08] [ 1.98268493e-09 -9.12054791e-02 -2.85062968e-08] [ 2.73906279e-03 9.81100667e-09 -4.05699141e-09] [-8.86361328e-02 1.84780591e-01 -1.00026887e-01] [-8.86361091e-02 -1.84780604e-01 1.00026876e-01] [-2.73906333e-03 1.50900515e-08 6.40246611e-09] [ 8.86361124e-02 -1.84780603e-01 -1.00026877e-01] [ 8.86361359e-02 1.84780589e-01 1.00026889e-01] [ 8.47266640e-03 -1.00119089e-01 -1.28911422e-01] [-8.47267118e-03 1.00119091e-01 -1.28911383e-01] [ 8.47266708e-03 1.00119088e-01 1.28911409e-01] [-8.47267119e-03 -1.00119088e-01 1.28911405e-01]] Final stress: [ 9.42250420e-03 9.74434329e-03 1.58653882e-02 -4.38376885e-12 2.73848291e-11 -1.15528862e-11] Minimization converged after 28 steps. Minimization converged after 26 steps. Minimization converged after 27 steps. Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.23403506e-05 -1.74253544e-05 8.89636626e-05] [-5.23403509e-05 1.74253551e-05 8.89633346e-05] [ 2.14163340e-04 2.36579040e-04 6.14585071e-04] [ 1.48153140e-04 5.78968866e-04 -1.93473772e-04] [ 2.25146681e-04 -4.66181140e-04 -5.16969468e-04] [-2.14163343e-04 -2.36579094e-04 6.14585048e-04] [-1.48153095e-04 -5.78968840e-04 -1.93473793e-04] [-2.25146706e-04 4.66181155e-04 -5.16969482e-04] [ 3.04549955e-04 -9.58681773e-05 7.29418515e-04] [-3.04549963e-04 9.58681909e-05 7.29418638e-04] [ 2.45304877e-04 2.45356689e-04 -7.22523785e-04] [-2.45304886e-04 -2.45356691e-04 -7.22523971e-04]] Final stress: [2.52237903e-05 2.90397538e-05 8.87376954e-06 3.59072473e-14 3.70236608e-15 2.00835195e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-5.25351261e-05 -1.73923867e-05 -8.89634684e-05] [ 5.25351274e-05 1.73923876e-05 -8.89633500e-05] [ 2.14130491e-04 -2.36702126e-04 -6.14039380e-04] [ 2.24070612e-04 4.65526278e-04 5.16243841e-04] [ 1.47255258e-04 -5.78293019e-04 1.93646753e-04] [-2.14130488e-04 2.36702079e-04 -6.14039404e-04] [-2.24070575e-04 -4.65526254e-04 5.16243819e-04] [-1.47255289e-04 5.78293043e-04 1.93646732e-04] [ 2.44291241e-04 -2.44819966e-04 7.22434175e-04] [-2.44291237e-04 2.44819962e-04 7.22434079e-04] [ 3.03608981e-04 9.58895338e-05 -7.29321907e-04] [-3.03608996e-04 -9.58895309e-05 -7.29321889e-04]] Final stress: [ 2.52275579e-05 2.90274932e-05 8.87340987e-06 -1.65894208e-14 4.15262155e-14 -2.00836652e-04] Minimization converged after 24 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 8.84157747e-10 -3.62133003e-02 -2.45038270e-08] [-4.81361562e-10 3.62132999e-02 -3.55052283e-08] [ 1.50513428e-02 -1.25971966e-08 5.22990753e-09] [ 2.23178483e-03 -6.75462942e-03 2.30562829e-02] [ 2.23174868e-03 6.75465000e-03 -2.30562663e-02] [-1.50513426e-02 2.21650422e-08 8.93679553e-09] [-2.23179211e-03 6.75462494e-03 2.30562863e-02] [-2.23175950e-03 -6.75464374e-03 -2.30562710e-02] [-5.55157922e-03 1.12235316e-02 1.21927775e-02] [ 5.55158661e-03 -1.12235392e-02 1.21927838e-02] [-5.55157838e-03 -1.12235346e-02 -1.21927718e-02] [ 5.55158849e-03 1.12235313e-02 -1.21927756e-02]] Final stress: [ 1.10292416e-03 -9.83981877e-04 2.95616883e-04 -1.56003378e-11 -8.75114482e-12 8.80873011e-12] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-4.10335321e-10 3.02593830e-02 -1.54069086e-08] [-8.56781809e-10 -3.02593833e-02 2.65530651e-08] [-2.33073133e-02 1.03941149e-08 -4.40583722e-09] [-2.87604919e-03 1.16205907e-02 -2.07497254e-02] [-2.87605577e-03 -1.16205872e-02 2.07497272e-02] [ 2.33073134e-02 6.92248478e-09 2.57735020e-09] [ 2.87605106e-03 -1.16205895e-02 -2.07497257e-02] [ 2.87607000e-03 1.16205787e-02 2.07497339e-02] [-9.83137209e-04 -2.09865785e-02 1.21624689e-02] [ 9.83128530e-04 2.09865756e-02 1.21624560e-02] [-9.83138011e-04 2.09865824e-02 -1.21624855e-02] [ 9.83131836e-04 -2.09865891e-02 -1.21624587e-02]] Final stress: [-6.33142144e-04 7.00329050e-04 2.49642812e-04 1.34756366e-11 -6.73172010e-12 3.64340439e-11] Minimization converged after 4 steps. Minimization converged after 6 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 8.94764651e-02 -3.10409046e-02 -3.61390695e-03] [ 8.94764651e-02 3.10409046e-02 3.61390633e-03] [-1.67505736e-01 1.79275303e-10 -6.43310434e-11] [-3.16214927e-02 5.63855632e-02 -4.26041651e-02] [-3.16214927e-02 -5.63855632e-02 4.26041652e-02] [-5.84643299e-02 1.48849591e-11 1.54286735e-11] [-1.32090079e-02 4.15649077e-02 6.30081649e-02] [-1.32090076e-02 -4.15649079e-02 -6.30081647e-02] [ 2.98228040e-03 8.84749838e-02 -3.97462842e-02] [ 6.53567878e-02 2.14445865e-01 -3.87926557e-02] [ 2.98228035e-03 -8.84749837e-02 3.97462844e-02] [ 6.53567879e-02 -2.14445866e-01 3.87926561e-02]] Final stress: [ 1.27272358e-03 -2.69299097e-03 5.62802597e-03 -7.80560070e-03 2.25360276e-13 6.62682437e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-8.94764725e-02 -3.10409267e-02 3.61391046e-03] [-8.94764725e-02 3.10409267e-02 -3.61391068e-03] [ 5.84644452e-02 2.50919783e-10 -1.03396613e-10] [ 1.32090061e-02 -4.15649337e-02 6.30082083e-02] [ 1.32090064e-02 4.15649336e-02 -6.30082084e-02] [ 1.67505876e-01 1.93571046e-10 7.64872932e-11] [ 3.16215288e-02 -5.63856606e-02 -4.26041973e-02] [ 3.16215295e-02 5.63856601e-02 4.26041977e-02] [-6.53568810e-02 -2.14446121e-01 -3.87926861e-02] [-2.98234243e-03 -8.84751422e-02 -3.97463174e-02] [-6.53568811e-02 2.14446121e-01 3.87926858e-02] [-2.98234244e-03 8.84751421e-02 3.97463178e-02]] Final stress: [ 1.27272653e-03 -2.69299097e-03 5.62803097e-03 7.80560204e-03 2.58260790e-13 7.26243418e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.60961205e-12 -5.85299205e-02 4.71722023e-11] [-1.00722928e-11 -1.20445350e-01 -1.14725326e-09] [ 3.34856280e-02 -6.68266471e-03 -6.55670887e-02] [-2.90784465e-02 5.67451880e-02 1.43316653e-02] [ 6.88742610e-02 1.08757716e-01 3.47370353e-02] [-3.34856280e-02 -6.68266432e-03 6.55670889e-02] [-6.88742613e-02 1.08757716e-01 -3.47370352e-02] [ 2.90784467e-02 5.67451879e-02 -1.43316652e-02] [ 1.81220559e-01 2.65026796e-02 -4.81218261e-02] [ 1.20622805e-01 -9.58352843e-02 -3.16710145e-02] [-1.20622805e-01 -9.58352844e-02 3.16710154e-02] [-1.81220559e-01 2.65026797e-02 4.81218259e-02]] Final stress: [-2.65142560e-03 1.29325709e-03 5.67627503e-03 -5.03730714e-13 -7.76378649e-03 -2.39000850e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 6.37641445e-12 1.20445200e-01 -3.05454371e-10] [ 7.36809022e-12 5.85297626e-02 -8.76345800e-10] [ 3.34856700e-02 6.68254125e-03 6.55669614e-02] [ 6.88740752e-02 -1.08757514e-01 -3.47369806e-02] [-2.90783382e-02 -5.67451264e-02 -1.43315926e-02] [-3.34856700e-02 6.68254181e-03 -6.55669611e-02] [ 2.90783378e-02 -5.67451266e-02 1.43315928e-02] [-6.88740748e-02 -1.08757514e-01 3.47369808e-02] [-1.20623187e-01 9.58352691e-02 -3.16710344e-02] [-1.81220908e-01 -2.65026510e-02 -4.81218459e-02] [ 1.81220908e-01 -2.65026510e-02 4.81218465e-02] [ 1.20623187e-01 9.58352691e-02 3.16710344e-02]] Final stress: [-2.65142135e-03 1.29326124e-03 5.67627881e-03 4.44210866e-13 7.76378515e-03 -7.11366724e-14] Minimization converged after 36 steps. Minimization converged after 37 steps. Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 18 steps. Final forces: [[ 1.92206920e-08 -1.50732211e-02 -1.66003441e-07] [ 3.34620651e-07 1.50732345e-02 3.95569358e-06] [ 7.70157485e-02 3.59322933e-06 -1.45312910e-06] [-7.24339742e-02 1.45705079e-01 4.41015697e-02] [-7.24291979e-02 -1.45707860e-01 -4.41039286e-02] [-7.70157717e-02 -4.70960666e-07 -1.23232127e-07] [ 7.24300767e-02 -1.45707293e-01 4.41034090e-02] [ 7.24327998e-02 1.45705719e-01 -4.41020799e-02] [-5.79375111e-02 -9.57127033e-02 -1.12984115e-01] [ 5.79377568e-02 9.57133294e-02 -1.12983500e-01] [-5.79381475e-02 9.57146487e-02 1.12980955e-01] [ 5.79378667e-02 -9.57140543e-02 1.12985476e-01]] Final stress: [ 1.65219782e-02 2.44441037e-03 1.85871328e-02 -1.25889876e-09 -3.45027309e-09 4.84644831e-09] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-7.99757260e-09 7.54850130e-02 -1.91366945e-09] [ 3.38934578e-08 -7.54850172e-02 -4.04597462e-07] [-5.71988042e-02 -2.79255933e-07 1.08249911e-07] [-9.62264012e-02 1.86982896e-01 -8.52031193e-02] [-9.62265306e-02 -1.86982814e-01 8.52031832e-02] [ 5.71987991e-02 4.06093799e-07 1.57647009e-07] [ 9.62264579e-02 -1.86982863e-01 -8.52031466e-02] [ 9.62265558e-02 1.86982798e-01 8.52031993e-02] [-3.09364273e-02 -2.34112716e-01 2.01977716e-02] [ 3.09363585e-02 2.34112657e-01 2.01979794e-02] [-3.09363476e-02 2.34112379e-01 -2.01977792e-02] [ 3.09363137e-02 -2.34112459e-01 -2.01979478e-02]] Final stress: [ 1.05700180e-02 7.88289315e-03 1.33000777e-02 -2.70341611e-11 -1.32691097e-10 -1.19623726e-09] Minimization converged after 5 steps. Minimization converged after 5 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.09535063e-02 -4.40521807e-03 -1.86688050e-04] [ 2.09535063e-02 4.40521807e-03 1.86687842e-04] [-4.24955658e-02 -4.82534049e-11 2.93261773e-11] [-1.04733945e-02 -4.00123324e-02 7.93741271e-03] [-1.04733945e-02 4.00123324e-02 -7.93741269e-03] [ 3.59550553e-02 5.59823796e-11 2.38766284e-11] [-4.04300559e-02 1.38592328e-02 -3.84990098e-03] [-4.04300557e-02 -1.38592329e-02 3.84990103e-03] [ 1.24068693e-02 1.16920381e-01 4.59117366e-03] [ 2.08133300e-02 1.35281023e-01 4.52783431e-03] [ 1.24068693e-02 -1.16920381e-01 -4.59117363e-03] [ 2.08133300e-02 -1.35281023e-01 -4.52783426e-03]] Final stress: [-1.69200884e-03 -2.25773716e-03 -1.73873563e-04 -2.62192053e-03 6.93762210e-14 -1.78125770e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-2.09535058e-02 -4.40521802e-03 1.86688039e-04] [-2.09535058e-02 4.40521801e-03 -1.86688067e-04] [-3.59550557e-02 4.90091431e-11 -2.18251138e-11] [ 4.04300556e-02 -1.38592320e-02 -3.84990131e-03] [ 4.04300556e-02 1.38592320e-02 3.84990130e-03] [ 4.24955645e-02 3.36997148e-11 1.13381616e-11] [ 1.04733947e-02 4.00123326e-02 7.93741297e-03] [ 1.04733947e-02 -4.00123326e-02 -7.93741299e-03] [-2.08133298e-02 -1.35281023e-01 4.52783425e-03] [-1.24068691e-02 -1.16920381e-01 4.59117377e-03] [-2.08133297e-02 1.35281023e-01 -4.52783424e-03] [-1.24068691e-02 1.16920381e-01 -4.59117372e-03]] Final stress: [-1.69200882e-03 -2.25773713e-03 -1.73873560e-04 2.62192051e-03 -1.39552766e-13 2.95989024e-15] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.21727653e-12 -1.65551056e-02 -1.39788385e-11] [-8.26960737e-13 -2.53614090e-02 8.16804278e-11] [-2.80247286e-02 3.28395335e-02 6.47502946e-03] [ 3.17136450e-02 -2.06237496e-02 -5.77204112e-03] [ 5.56576620e-03 4.19667620e-02 -1.68527070e-03] [ 2.80247286e-02 3.28395334e-02 -6.47502947e-03] [-5.56576617e-03 4.19667620e-02 1.68527068e-03] [-3.17136451e-02 -2.06237495e-02 5.77204109e-03] [ 1.30296118e-01 -7.45434211e-03 4.16096019e-03] [ 1.21906782e-01 -2.57699465e-02 4.95794581e-03] [-1.21906782e-01 -2.57699465e-02 -4.95794584e-03] [-1.30296118e-01 -7.45434208e-03 -4.16096016e-03]] Final stress: [-2.25786704e-03 -1.69234481e-03 -1.73913446e-04 -6.44687589e-14 -2.62205223e-03 -1.02421161e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 4.67317340e-12 2.53621443e-02 -7.29933703e-11] [ 1.83721767e-12 1.65557077e-02 6.12616343e-11] [-2.80251855e-02 -3.28390510e-02 -6.47453933e-03] [ 5.56684820e-03 -4.19681503e-02 1.68503059e-03] [ 3.17131785e-02 2.06234075e-02 5.77181212e-03] [ 2.80251855e-02 -3.28390511e-02 6.47453932e-03] [-3.17131785e-02 2.06234075e-02 -5.77181210e-03] [-5.56684824e-03 -4.19681503e-02 -1.68503060e-03] [-1.21906841e-01 2.57703687e-02 4.95794577e-03] [-1.30296306e-01 7.45449924e-03 4.16094239e-03] [ 1.30296306e-01 7.45449923e-03 -4.16094242e-03] [ 1.21906841e-01 2.57703687e-02 -4.95794571e-03]] Final stress: [-2.25790440e-03 -1.69237444e-03 -1.73919172e-04 1.14819077e-14 2.62207142e-03 -2.06671146e-17] Minimization converged after 40 steps. Minimization converged after 40 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 1.52046131e-09 3.81066585e-03 -1.45178884e-08] [ 1.38663965e-09 -3.81066575e-03 -2.44704336e-07] [-1.08045429e-03 -7.12180757e-08 3.05357054e-08] [-5.40783067e-04 1.30100413e-03 -2.43390058e-03] [-5.40946138e-04 -1.30091046e-03 2.43397893e-03] [ 1.08045423e-03 1.82626990e-08 8.51524022e-09] [ 5.40790890e-04 -1.30100089e-03 -2.43390570e-03] [ 5.40868755e-04 1.30095647e-03 2.43394286e-03] [ 6.51942359e-04 -4.40397206e-04 -7.00642450e-04] [-6.51908520e-04 4.40390672e-04 -7.00567188e-04] [ 6.51936098e-04 4.40422591e-04 7.00727889e-04] [-6.51903221e-04 -4.40412458e-04 7.00586405e-04]] Final stress: [-4.09238132e-05 1.70247693e-04 6.45912355e-05 -5.71448917e-11 1.63717208e-12 9.91492267e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.36097253e-12 -4.25265529e-03 5.03884577e-08] [ 4.47488213e-10 4.25265456e-03 -1.01222727e-07] [ 9.66724907e-04 -9.12883735e-09 3.26224586e-09] [ 5.51193015e-04 -1.38616852e-03 2.68103939e-03] [ 5.51189698e-04 1.38617059e-03 -2.68103826e-03] [-9.66725101e-04 5.16761798e-08 2.05049674e-08] [-5.51223318e-04 1.38615002e-03 2.68105400e-03] [-5.51183554e-04 -1.38617363e-03 -2.68103466e-03] [-9.04155618e-04 2.45093670e-04 7.11770360e-04] [ 9.04165051e-04 -2.45106786e-04 7.11860257e-04] [-9.04148963e-04 -2.45120905e-04 -7.11785638e-04] [ 9.04163437e-04 2.45113731e-04 -7.11838379e-04]] Final stress: [ 7.03663872e-05 -1.81232444e-04 -2.49935683e-05 -1.92823500e-11 -1.77944244e-11 -7.10962210e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.21232754e-11 -3.91943871e-03 -8.37142911e-09] [ 2.58491673e-10 3.91943854e-03 -1.86471829e-07] [ 2.15402190e-03 -1.66838014e-07 6.92876999e-08] [-7.43656872e-05 -2.59727328e-04 2.48663339e-03] [-7.46182691e-05 2.59873576e-04 -2.48651064e-03] [-2.15402224e-03 -4.32206180e-08 -1.85787779e-08] [ 7.45434924e-05 2.59829096e-04 2.48654755e-03] [ 7.44214272e-05 -2.59759171e-04 -2.48660528e-03] [-7.77583473e-04 2.98346227e-04 -7.00191367e-04] [ 7.77592151e-04 -2.98351577e-04 -7.00248120e-04] [-7.77576948e-04 -2.98372174e-04 7.00371461e-04] [ 7.77587412e-04 2.98371578e-04 7.00147145e-04]] Final stress: [ 1.78780245e-04 -4.68757069e-05 6.53613252e-05 -1.50835990e-11 9.59657998e-13 -9.56010120e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[ 2.25718289e-09 4.10312287e-03 8.90943557e-08] [ 1.45522551e-09 -4.10312434e-03 -1.82466873e-07] [-2.43659823e-03 1.21720737e-07 -4.77733874e-08] [ 1.06676062e-04 3.29677633e-04 -2.59767468e-03] [ 1.06793393e-04 -3.29746518e-04 2.59761991e-03] [ 2.43659822e-03 6.96099062e-08 3.10371140e-08] [-1.06847296e-04 -3.29778554e-04 -2.59759313e-03] [-1.06711011e-04 3.29700070e-04 2.59766194e-03] [ 7.70153744e-04 -4.86894347e-04 7.14316306e-04] [-7.70116576e-04 4.86862471e-04 7.14550192e-04] [ 7.70151811e-04 4.86903139e-04 -7.14374287e-04] [-7.70103834e-04 -4.86913761e-04 -7.14396136e-04]] Final stress: [-1.71880168e-04 6.15382144e-05 -2.51478109e-05 -7.28526145e-11 -3.14780083e-11 1.25759136e-10] Minimization converged after 5 steps. Minimization converged after 4 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 3.03922724e-04 -5.08078501e-03 -2.61965756e-04] [ 3.03922761e-04 5.08078507e-03 2.61963783e-04] [ 2.87934052e-02 -7.21180698e-10 2.97331827e-10] [ 2.34352741e-02 -5.91979266e-02 4.34154982e-02] [ 2.34352763e-02 5.91979253e-02 -4.34154991e-02] [ 1.04421039e-01 1.65816312e-10 1.00443344e-10] [ 5.98846061e-04 -4.27337605e-03 -3.59707257e-02] [ 5.98845540e-04 4.27337634e-03 3.59707256e-02] [-5.26909113e-02 1.54391517e-02 -7.86238466e-03] [-3.82543546e-02 3.56394946e-02 -7.53619334e-03] [-5.26909112e-02 -1.54391522e-02 7.86238568e-03] [-3.82543551e-02 -3.56394927e-02 7.53619495e-03]] Final stress: [-1.56794818e-03 -2.35000332e-03 1.98155316e-04 -3.79934089e-03 2.24475640e-12 -4.96127900e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-3.26280627e-04 -5.08125226e-03 2.62012928e-04] [-3.26280617e-04 5.08125225e-03 -2.62013594e-04] [-1.04455850e-01 3.90505112e-11 -4.44302860e-12] [-5.79170685e-04 4.27735992e-03 -3.59489617e-02] [-5.79170835e-04 -4.27735981e-03 3.59489618e-02] [-2.87944798e-02 1.95687590e-10 7.78543753e-11] [-2.34299040e-02 5.92289272e-02 4.33957902e-02] [-2.34299040e-02 -5.92289272e-02 -4.33957902e-02] [ 3.82610041e-02 -3.55247671e-02 -7.54296643e-03] [ 5.26995163e-02 -1.53204751e-02 -7.86945456e-03] [ 3.82610042e-02 3.55247669e-02 7.54296669e-03] [ 5.26995163e-02 1.53204750e-02 7.86945481e-03]] Final stress: [-1.56892290e-03 -2.35106787e-03 1.97873076e-04 3.80040905e-03 -4.63722805e-13 -2.51171275e-13] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[ 2.84423979e-11 4.75134396e-03 3.31357782e-10] [ 5.82760300e-11 -5.40544000e-03 1.35168417e-09] [-2.67402666e-02 6.12074622e-03 4.53761688e-02] [ 5.26860442e-02 -7.68064373e-02 -2.70684507e-02] [-1.09540501e-02 -1.99446085e-02 -1.96096150e-02] [ 2.67402666e-02 6.12074583e-03 -4.53761690e-02] [ 1.09540502e-02 -1.99446085e-02 1.96096150e-02] [-5.26860462e-02 -7.68064361e-02 2.70684498e-02] [ 3.26510478e-02 5.55454583e-02 -8.23892889e-03] [ 1.82059085e-02 3.54118887e-02 -7.17253105e-03] [-1.82059075e-02 3.54118885e-02 7.17253030e-03] [-3.26510470e-02 5.55454588e-02 8.23892914e-03]] Final stress: [-2.35107810e-03 -1.56908690e-03 1.97837448e-04 -1.22426399e-12 -3.80037652e-03 -1.41692281e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 6 steps. Final forces: [[-7.33958453e-12 5.38041941e-03 -8.26367669e-10] [ 4.65950105e-13 -4.77461554e-03 7.05381700e-10] [-2.67206753e-02 -6.10678130e-03 -4.54004255e-02] [-1.09591645e-02 1.99667661e-02 1.96224207e-02] [ 5.26681787e-02 7.67908110e-02 2.70795946e-02] [ 2.67206753e-02 -6.10678134e-03 4.54004255e-02] [-5.26681780e-02 7.67908114e-02 -2.70795949e-02] [ 1.09591643e-02 1.99667662e-02 -1.96224208e-02] [-1.82998559e-02 -3.54127008e-02 -7.16769514e-03] [-3.27423443e-02 -5.55409971e-02 -8.23383305e-03] [ 3.27423441e-02 -5.55409974e-02 8.23383257e-03] [ 1.82998556e-02 -3.54127006e-02 7.16769611e-03]] Final stress: [-2.34968331e-03 -1.56781738e-03 1.98253957e-04 4.49814928e-13 3.79942289e-03 -9.64438885e-13] Minimization converged after 37 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.22698385e-09 9.82574197e-04 1.13473195e-08] [-1.91088441e-09 -9.82577187e-04 6.18236095e-08] [-3.14748086e-04 -3.33416532e-08 1.42296268e-08] [ 2.31263834e-05 4.54888676e-04 -5.78156710e-04] [ 2.29581851e-05 -4.54793003e-04 5.78233393e-04] [ 3.14747278e-04 -5.29619774e-08 -2.39601161e-08] [-2.29285595e-05 -4.54774667e-04 -5.78248998e-04] [-2.30640049e-05 4.54852363e-04 5.78181853e-04] [ 3.58071304e-04 -1.12428001e-05 -3.31693577e-05] [-3.58125755e-04 1.12117008e-05 -3.32884629e-05] [ 3.58077228e-04 1.12190872e-05 3.32281957e-05] [-3.58110835e-04 -1.12720630e-05 3.31566463e-05]] Final stress: [ 7.09077755e-06 5.55123034e-05 2.77487473e-05 7.38862107e-11 -7.22227093e-11 7.60299009e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.11205509e-09 -1.13325722e-03 2.93177385e-08] [ 1.28256461e-09 1.13325645e-03 1.14101465e-07] [ 1.81038301e-04 -6.03393380e-09 1.87153903e-09] [ 1.76781420e-04 -4.52176239e-04 6.95506460e-04] [ 1.76753942e-04 4.52191876e-04 -6.95495259e-04] [-1.81037272e-04 -4.56293106e-08 -2.02567430e-08] [-1.76751411e-04 4.52193199e-04 6.95490868e-04] [-1.76853424e-04 -4.52134609e-04 -6.95541427e-04] [-2.69169433e-04 -7.57381404e-05 1.18503692e-04] [ 2.69199722e-04 7.57189978e-05 1.18419845e-04] [-2.69166300e-04 7.57255933e-05 -1.18502589e-04] [ 2.69202060e-04 -7.57282379e-05 -1.18506623e-04]] Final stress: [ 4.04325490e-06 -5.38787820e-05 -7.18139780e-06 -5.61642226e-11 -1.77561094e-11 -6.66924508e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-3.81957607e-09 -1.02384526e-03 -1.14948067e-07] [-3.45376749e-09 1.02384860e-03 5.91252422e-08] [ 5.63334380e-04 -1.20249709e-07 4.75851166e-08] [-4.86625574e-05 -1.43062531e-04 6.24857820e-04] [-4.87624805e-05 1.43121591e-04 -6.24809995e-04] [-5.63336149e-04 -3.92376565e-08 -1.65833950e-08] [ 4.88234702e-05 1.43158521e-04 6.24783024e-04] [ 4.88203595e-05 -1.43155953e-04 -6.24787761e-04] [-2.57796327e-04 -1.55930991e-05 -3.06750413e-05] [ 2.57703200e-04 1.56663679e-05 -3.08180253e-05] [-2.57805140e-04 1.56284209e-05 3.07270562e-05] [ 2.57688517e-04 -1.56071709e-05 3.07477436e-05]] Final stress: [ 5.36920099e-05 5.53223572e-06 2.69170659e-05 1.76583393e-10 8.00556032e-11 -4.95176943e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.10703957e-09 1.11262720e-03 -1.45390098e-08] [ 1.18980122e-09 -1.11262663e-03 8.89562169e-08] [-7.04616594e-04 -6.44373155e-09 2.78098417e-09] [ 8.03377414e-05 3.76621371e-06 -6.75569412e-04] [ 8.03487407e-05 -3.77225350e-06 6.75565306e-04] [ 7.04617737e-04 -5.18195482e-08 -2.11207757e-08] [-8.03372078e-05 -3.76576756e-06 -6.75571371e-04] [-8.04195837e-05 3.81343175e-06 6.75532369e-04] [ 2.49752033e-04 5.00023044e-05 1.14519084e-04] [-2.49716512e-04 -5.00026272e-05 1.14439620e-04] [ 2.49750913e-04 -4.99983136e-05 -1.14494786e-04] [-2.49719563e-04 5.00147082e-05 -1.14476887e-04]] Final stress: [-5.27928415e-05 2.94800601e-06 -7.12685561e-06 -5.60849288e-11 1.35043118e-11 -1.70420155e-11] Minimization converged after 2 steps. Minimization converged after 3 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-5.52573542e-10 3.25381852e-03 2.65514792e-08] [-2.55295250e-10 -3.25381774e-03 -1.53517321e-07] [-9.63404511e-04 -4.08148479e-08 1.68893458e-08] [-3.09234304e-04 1.03027254e-03 -2.15875310e-03] [-3.09281898e-04 -1.03024480e-03 2.15877680e-03] [ 9.63403515e-04 1.78855568e-08 7.92096864e-09] [ 3.09250290e-04 -1.03026357e-03 -2.15876037e-03] [ 3.09299932e-04 1.03023506e-03 2.15878440e-03] [ 7.03987908e-04 -1.40521561e-04 -4.09648576e-04] [-7.04001163e-04 1.40536992e-04 -4.09568417e-04] [ 7.03985316e-04 1.40531791e-04 4.09680319e-04] [-7.04004277e-04 -1.40524290e-04 4.09591091e-04]] Final stress: [-6.02272425e-05 1.36001818e-04 4.07430029e-05 2.58238978e-11 1.92378712e-11 -4.99591373e-12] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-1.05063089e-09 -5.40718305e-04 -7.37883232e-09] [-5.26064803e-10 5.40719379e-04 -1.16099234e-07] [ 9.32391661e-05 -4.31415595e-08 1.71901366e-08] [ 9.79789604e-05 -2.91913078e-04 2.79031533e-04] [ 9.79620285e-05 2.91923517e-04 -2.79022378e-04] [-9.32400092e-05 4.19944273e-08 1.74429992e-08] [-9.79827760e-05 2.91911054e-04 2.79033875e-04] [-9.79121630e-05 -2.91951839e-04 -2.78999847e-04] [-8.37859822e-05 8.96248782e-05 -4.49665173e-05] [ 8.37678735e-05 -8.96042237e-05 -4.49022470e-05] [-8.37857192e-05 -8.96261904e-05 4.49762420e-05] [ 8.37601979e-05 8.96359558e-05 4.49381842e-05]] Final stress: [-3.11029564e-06 -2.51957501e-05 1.26319019e-06 3.69898973e-11 2.51621427e-11 -6.87722099e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 12 steps. Final forces: [[-2.86548618e-10 -3.28890012e-03 -7.80888587e-09] [-3.22948002e-10 3.28889829e-03 -7.97003377e-08] [ 1.62639955e-03 -1.31161227e-08 5.40420964e-09] [-6.74625024e-05 -3.28526958e-04 2.17175188e-03] [-6.75251589e-05 3.28562618e-04 -2.17172359e-03] [-1.62639995e-03 5.74983450e-08 2.26175125e-08] [ 6.74784874e-05 3.28535415e-04 2.17174531e-03] [ 6.75234545e-05 -3.28562008e-04 -2.17172398e-03] [-7.57188071e-04 3.84650921e-05 -4.11450100e-04] [ 7.57175065e-04 -3.84892601e-05 -4.11410905e-04] [-7.57180750e-04 -3.84949486e-05 4.11449684e-04] [ 7.57180482e-04 3.84674956e-05 4.11421195e-04]] Final stress: [ 1.38995065e-04 -6.34705055e-05 4.06845681e-05 1.16986026e-11 -4.29768203e-11 -1.69953702e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-4.26980895e-10 5.40961531e-04 -6.21188589e-09] [ 5.12374171e-10 -5.40961314e-04 -1.37980469e-07] [-4.35973797e-04 -3.55213157e-08 1.43925270e-08] [ 7.21544775e-05 -6.02402250e-06 -2.82844646e-04] [ 7.21452098e-05 6.03006991e-06 2.82850705e-04] [ 4.35973334e-04 6.06650678e-08 2.50897853e-08] [-7.21826398e-05 6.00730666e-06 -2.82831067e-04] [-7.21177558e-05 -6.04537538e-06 2.82863793e-04] [ 8.44535341e-05 -8.31238902e-05 -3.94673316e-05] [-8.44521863e-05 8.31271561e-05 -3.93857458e-05] [ 8.44589703e-05 8.31018468e-05 3.94806992e-05] [-8.44592320e-05 -8.30984522e-05 3.94383041e-05]] Final stress: [-2.53162851e-05 -3.27720163e-06 1.09793009e-06 -7.58390242e-13 5.61301120e-12 -1.05337487e-10] Minimization converged after 6 steps. Minimization converged after 3 steps. Minimization converged after 41 steps. Minimization converged after 41 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[ 1.42150213e-03 3.14870936e-05 1.48110853e-05] [-1.42150209e-03 -3.14870850e-05 1.48124839e-05] [ 1.22214301e-03 1.07361902e-03 -1.77332570e-03] [-4.53664299e-04 8.80832150e-04 6.97886776e-04] [-1.52500191e-03 -6.59579629e-04 1.06133954e-03] [-1.22214301e-03 -1.07363310e-03 -1.77333158e-03] [ 4.53675737e-04 -8.80825539e-04 6.97881237e-04] [ 1.52498908e-03 6.59587008e-04 1.06133339e-03] [ 1.97928889e-03 -3.04198369e-04 -1.34677692e-03] [-1.97928826e-03 3.04198305e-04 -1.34678675e-03] [-2.70592113e-03 -5.26247807e-04 1.34608249e-03] [ 2.70592184e-03 5.26247945e-04 1.34607393e-03]] Final stress: [ 7.43193011e-05 6.99190654e-05 7.01781968e-05 -5.93999377e-13 -1.22477559e-13 -7.56349653e-05] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 11 steps. Final forces: [[-1.41582570e-03 3.15160774e-05 -1.47928235e-05] [ 1.41582569e-03 -3.15160509e-05 -1.48117635e-05] [ 1.22819846e-03 -1.07340114e-03 1.77320484e-03] [-1.53267652e-03 6.70536086e-04 -1.06175709e-03] [-4.54232911e-04 -8.79029527e-04 -6.97345188e-04] [-1.22819855e-03 1.07339394e-03 1.77320185e-03] [ 1.53268233e-03 -6.70532831e-04 -1.06175988e-03] [ 4.54226877e-04 8.79033031e-04 -6.97348099e-04] [-2.69471488e-03 5.36819354e-04 -1.34323046e-03] [ 2.69471505e-03 -5.36819196e-04 -1.34322610e-03] [ 1.96594929e-03 3.14265946e-04 1.34393909e-03] [-1.96594913e-03 -3.14265682e-04 1.34392563e-03]] Final stress: [ 7.46961234e-05 7.02777633e-05 7.03004286e-05 -3.70488253e-13 2.17690371e-13 7.54413865e-05] Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.01,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.63114 -0.0161 -0.10666 0. 0. 0. ] [-0.0161 0.84826 0.28649 0. -0. 0. ] [-0.10666 0.28649 2.25774 0. -0. 0. ] [ 0. 0. 0. -0.50441 -0. 0. ] [ 0. -0. -0. -0. 0.30579 -0. ] [ 0. 0. 0. 0. -0. 0.62901]] 95%% Error estimate [ASE units]: [[1.25874 3.88219 1.23313 0. 0. 0.00001] [3.88219 5.9977 1.24848 0. 0. 0.00001] [1.23313 1.24848 0.00004 0. 0. 0.00001] [0. 0. 0. 2.55697 0. 0. ] [0. 0. 0. 0. 6.61308 0. ] [0.00001 0.00001 0.00001 0. 0. 4.4127 ]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 3.306538 is too big compared to maximum elastic constant component 2.257740 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.810199 WARNING: Maximum deviation from material symmetry according to space group 182 is too big compared to maximum elastic constant component 2.257740 [ASE units] and requested fractional tolerance 0.010000. Attempting to compute elastic constants with method stress-condensed and step generator MaxStepGenerator(_base_step=0.1,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Minimization converged after 3 steps. Minimization converged after 20 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 23 steps. Minimization converged after 6 steps. Minimization converged after 7 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 50 steps. Minimization converged after 50 steps. Minimization converged after 18 steps. Minimization converged after 23 steps. Minimization converged after 23 steps. Minimization converged after 21 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 40 steps. Minimization converged after 40 steps. Minimization converged after 19 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 6 steps. Minimization converged after 6 steps. Minimization converged after 28 steps. Minimization converged after 28 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 20 steps. Minimization converged after 23 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 5 steps. Minimization converged after 5 steps. Minimization converged after 29 steps. Minimization converged after 29 steps. Minimization converged after 30 steps. Minimization converged after 30 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 18 steps. Minimization converged after 24 steps. Minimization converged after 22 steps. Minimization converged after 21 steps. Minimization converged after 4 steps. Minimization converged after 6 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 18 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 22 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 32 steps. Minimization converged after 43 steps. Minimization converged after 43 steps. Minimization converged after 24 steps. Minimization converged after 24 steps. Minimization converged after 26 steps. Minimization converged after 22 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 24 steps. Minimization converged after 6 steps. Minimization converged after 5 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 31 steps. Minimization converged after 31 steps. Minimization converged after 24 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 22 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 39 steps. Minimization converged after 39 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. Minimization converged after 25 steps. Minimization converged after 25 steps. Minimization converged after 26 steps. Minimization converged after 23 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 34 steps. Minimization converged after 34 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[-0.00613108 0.02931538 -0.07579921] [ 0.00613108 -0.02931538 -0.07579921] [ 0.19908018 -0.04249722 -0.0998324 ] [ 0.0561671 0.28103157 0.09876387] [ 0.02310808 -0.16980953 0.01526647] [-0.19908018 0.04249722 -0.0998324 ] [-0.0561671 -0.28103157 0.09876387] [-0.02310808 0.16980953 0.01526647] [ 0.09282761 -0.04259004 0.10978111] [-0.09282761 0.04259004 0.10978111] [ 0.12019474 -0.06782358 -0.04817984] [-0.12019474 0.06782358 -0.04817984]] Final stress: [ 9.18591224e-03 1.71762191e-02 1.50154013e-02 2.41189669e-13 -1.24231785e-13 -1.10992843e-03] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 10 steps. Final forces: [[ 0.00613115 0.0293155 0.07579886] [-0.00613115 -0.0293155 0.07579886] [ 0.19908041 0.04249618 0.09983494] [ 0.02310366 0.16980708 -0.0152695 ] [ 0.05616311 -0.28102914 -0.09876322] [-0.19908041 -0.04249618 0.09983494] [-0.02310366 -0.16980708 -0.0152695 ] [-0.05616311 0.28102914 -0.09876322] [ 0.12018984 0.06782566 0.04818042] [-0.12018984 -0.06782566 0.04818042] [ 0.09282452 0.04258988 -0.1097815 ] [-0.09282452 -0.04258988 -0.1097815 ]] Final stress: [ 9.18594761e-03 1.71761846e-02 1.50153894e-02 7.64836863e-14 -2.78799288e-13 1.10992070e-03] Minimization converged after 25 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 5 steps. Minimization converged after 4 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. Minimization converged after 23 steps. Minimization converged after 27 steps. Minimization converged after 27 steps. Minimization converged after 24 steps. Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 38 steps. Minimization converged after 38 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 33 steps. Minimization converged after 33 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 7.32031769e-10 5.42998328e-02 1.09663287e-08] [ 5.39180145e-10 -5.42998326e-02 -7.63071910e-09] [-5.86464231e-02 9.14503295e-09 -3.76980380e-09] [-5.79926394e-02 1.32474235e-01 -7.51810735e-02] [-5.79926089e-02 -1.32474253e-01 7.51810595e-02] [ 5.86464230e-02 7.67339015e-09 3.34444943e-09] [ 5.79926181e-02 -1.32474247e-01 -7.51810634e-02] [ 5.79926239e-02 1.32474244e-01 7.51810670e-02] [-1.71162908e-03 -5.07358988e-02 -1.27461917e-01] [ 1.71163172e-03 5.07359000e-02 -1.27461896e-01] [-1.71162773e-03 5.07358946e-02 1.27461908e-01] [ 1.71163022e-03 -5.07358920e-02 1.27461912e-01]] Final stress: [ 4.80674622e-03 6.03419257e-03 1.08382992e-02 -6.43154475e-12 1.84149194e-11 -2.69104580e-11] Minimization converged after 27 steps. Minimization converged after 27 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[ 5.11825249e-10 6.92634648e-02 4.91645769e-09] [-2.54956334e-09 -6.92634648e-02 3.02169866e-08] [-2.07455370e-02 9.58690838e-09 -3.95540106e-09] [-1.01486565e-01 2.29880365e-01 -1.30463229e-01] [-1.01486548e-01 -2.29880375e-01 1.30463221e-01] [ 2.07455372e-02 -7.46423751e-09 -3.08617003e-09] [ 1.01486567e-01 -2.29880364e-01 -1.30463229e-01] [ 1.01486552e-01 2.29880373e-01 1.30463222e-01] [-2.94590662e-03 -7.82953776e-02 -2.41034673e-02] [ 2.94590461e-03 7.82953776e-02 -2.41034785e-02] [-2.94590597e-03 7.82953764e-02 2.41034601e-02] [ 2.94590415e-03 -7.82953776e-02 2.41034731e-02]] Final stress: [ 1.13861761e-02 1.13616974e-02 1.60657990e-02 7.23131625e-12 2.79648506e-13 -4.58290107e-12] Minimization converged after 4 steps. Minimization converged after 4 steps. Minimization converged after 40 steps. Minimization converged after 39 steps. Minimization converged after 36 steps. Minimization converged after 36 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 14 steps. Final forces: [[-8.38501713e-10 1.03769902e-01 -1.13631602e-08] [-1.65899670e-09 -1.03769902e-01 2.09188277e-08] [ 1.99059917e-02 1.62171485e-08 -6.78650042e-09] [-9.60916425e-02 2.02132489e-01 -1.12634723e-01] [-9.60916262e-02 -2.02132499e-01 1.12634714e-01] [-1.99059914e-02 1.45225485e-08 5.81690590e-09] [ 9.60916232e-02 -2.02132501e-01 -1.12634713e-01] [ 9.60916471e-02 2.02132487e-01 1.12634724e-01] [ 5.95492269e-03 -1.25600746e-01 -1.42419086e-01] [-5.95492400e-03 1.25600742e-01 -1.42419084e-01] [ 5.95492376e-03 1.25600745e-01 1.42419063e-01] [-5.95492188e-03 -1.25600749e-01 1.42419095e-01]] Final stress: [1.12431909e-02 1.07907990e-02 1.80110238e-02 6.44636383e-12 1.63505147e-11 1.17865893e-11] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[ 4.31714858e-10 -3.19090698e-02 -1.32836310e-08] [-7.51412710e-10 3.19090698e-02 -4.12258003e-08] [ 7.95714319e-03 -1.13405432e-08 4.83865603e-09] [ 2.55414082e-03 -3.66660349e-03 2.05692055e-02] [ 2.55411185e-03 3.66662000e-03 -2.05691918e-02] [-7.95714320e-03 9.21322507e-09 3.98504360e-09] [-2.55414115e-03 3.66660316e-03 2.05692057e-02] [-2.55411460e-03 -3.66661824e-03 -2.05691931e-02] [-7.74730532e-03 8.26592054e-03 1.51373143e-02] [ 7.74730711e-03 -8.26592067e-03 1.51373264e-02] [-7.74730665e-03 -8.26591469e-03 -1.51373035e-02] [ 7.74730827e-03 8.26591549e-03 -1.51373177e-02]] Final stress: [ 8.23077624e-04 -8.68092634e-04 7.23115744e-05 -2.06878581e-12 8.10021388e-13 2.16564723e-11] Minimization converged after 26 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 13 steps. Final forces: [[-2.60874211e-10 2.78623061e-02 -1.30246898e-08] [ 2.89649551e-10 -2.78623063e-02 -2.83481449e-08] [-1.49745356e-02 -1.90926899e-08 8.18897264e-09] [-2.46796079e-03 6.22667787e-03 -1.89497389e-02] [-2.46800750e-03 -6.22665102e-03 1.89497612e-02] [ 1.49745355e-02 -6.73681450e-09 -2.71021246e-09] [ 2.46799074e-03 -6.22666067e-03 -1.89497531e-02] [ 2.46798377e-03 6.22666464e-03 1.89497498e-02] [ 3.06975425e-03 -1.52679653e-02 1.49672487e-02] [-3.06975779e-03 1.52679637e-02 1.49672367e-02] [ 3.06975344e-03 1.52679680e-02 -1.49672210e-02] [-3.06975603e-03 -1.52679711e-02 -1.49672474e-02]] Final stress: [-6.08264808e-04 5.34527113e-04 4.70783410e-05 3.97306643e-12 -9.73429635e-12 2.19581654e-11] Minimization converged after 4 steps. Minimization converged after 5 steps. Minimization converged after 35 steps. Minimization converged after 35 steps. Minimization converged after 37 steps. Minimization converged after 37 steps. The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[ 5.59773040e-05 -1.75310309e-05 8.41614368e-05] [-5.59773047e-05 1.75310315e-05 8.41613732e-05] [ 2.38232683e-04 2.25719560e-04 5.92264783e-04] [ 1.44982014e-04 6.03288642e-04 -1.76602895e-04] [ 2.19051668e-04 -4.91111867e-04 -5.06422653e-04] [-2.38232685e-04 -2.25719672e-04 5.92264738e-04] [-1.44981929e-04 -6.03288592e-04 -1.76602935e-04] [-2.19051768e-04 4.91111923e-04 -5.06422698e-04] [ 3.13329989e-04 -9.93888911e-05 7.76582384e-04] [-3.13329981e-04 9.93888958e-05 7.76582347e-04] [ 2.51009002e-04 2.44246775e-04 -7.69982892e-04] [-2.51008993e-04 -2.44246773e-04 -7.69982989e-04]] Final stress: [ 2.67235243e-05 3.06825275e-05 8.77480152e-06 3.09260166e-15 -7.68326813e-16 1.90175693e-04] The following exception was caught during minimization: RuntimeError('LineSearch failed!') Minimization stalled after 9 steps. Final forces: [[-5.56262436e-05 -1.75742036e-05 -8.41607525e-05] [ 5.56262451e-05 1.75742023e-05 -8.41606871e-05] [ 2.38286151e-04 -2.25600450e-04 -5.92968631e-04] [ 2.20445193e-04 4.91961046e-04 5.07368756e-04] [ 1.46168808e-04 -6.04205794e-04 1.76369266e-04] [-2.38286147e-04 2.25600556e-04 -5.92968585e-04] [-2.20445290e-04 -4.91961104e-04 5.07368805e-04] [-1.46168706e-04 6.04205734e-04 1.76369315e-04] [ 2.52261125e-04 -2.44984127e-04 7.70113135e-04] [-2.52261125e-04 2.44984130e-04 7.70113182e-04] [ 3.14642981e-04 9.93296261e-05 -7.76721954e-04] [-3.14642991e-04 -9.93296153e-05 -7.76721849e-04]] Final stress: [ 2.67192735e-05 3.06993056e-05 8.77537824e-06 -1.70489758e-14 1.76870305e-14 -1.90174109e-04] Summary of completed elastic constants calculation: Method: stress-condensed Step generator: MaxStepGenerator(_base_step=0.1,_step_nom=None,_num_steps=14,_step_ratio=1.6,offset=0,num_extrap=0,check_num_steps=True,use_exact_steps=True,_scale=500,_state=State(x=array(1), method='forward', n=1, order=2)) Raw elastic constants [ASE units]: [[ 0.63422 -0.10965 -0.01855 0. -0. -0. ] [-0.10965 0.89608 0.22536 -0. -0. -0. ] [-0.01855 0.22536 2.25774 0. -0. -0. ] [ 0. -0. 0. 0.5527 0. 0. ] [-0. -0. -0. 0. 0.42102 -0. ] [-0. -0. -0. 0. -0. 0.66742]] 95%% Error estimate [ASE units]: [[0.14444 0.54308 0.0326 0. 0. 0. ] [0.54308 1.06784 0.03599 0. 0. 0. ] [0.0326 0.03599 0.00009 0. 0. 0. ] [0. 0. 0. 0.98289 0. 0. ] [0. 0. 0. 0. 0.8933 0. ] [0. 0. 0. 0. 0. 0.75082]] WARNING: Maximum standard error estimate (1/2 of the error given by numdifftools) 0.533919 is too big compared to maximum elastic constant component 2.257744 [ASE units] and requested fractional tolerance 0.010000. Maximum deviation from material symmetry [ASE units]: 0.295483 WARNING: Maximum deviation from material symmetry according to space group 182 is too big compared to maximum elastic constant component 2.257744 [ASE units] and requested fractional tolerance 0.010000. WARNING: None of the calculations successfully completed with errors within tolerance. The last run performed had the lowest errors. R E S U L T S Elastic constants [GPa]: [[101.61402 -17.56718 -2.97223 0. -0. -0. ] [-17.56718 143.56713 36.10643 -0. -0. -0. ] [ -2.97223 36.10643 361.73054 0. -0. -0. ] [ 0. -0. 0. 88.55293 0. 0. ] [ -0. -0. -0. 0. 67.45543 -0. ] [ -0. -0. -0. 0. -0. 106.93219]] 95 %% Error estimate [GPa]: [[ 23.14139 87.01072 5.22243 0. 0. 0. ] [ 87.01072 171.08658 5.76548 0. 0. 0. ] [ 5.22243 5.76548 0.01391 0. 0. 0. ] [ 0. 0. 0. 157.4763 0. 0. ] [ 0. 0. 0. 0. 143.12297 0. ] [ 0. 0. 0. 0. 0. 120.29467]] Maximum deviation from material symmetry [GPa] = 47.34159 Bulk modulus [GPa] = 47.28026 Unique elastic constants for space group 182 [GPa] ['c11', 'c12', 'c13', 'c33', 'c44'] [101.61402465797664, -17.567182422350744, -2.9722337462619253, 361.7305449249604, 88.55293243227894] Nearest matrix of isotropic elastic constants: Distance to isotropic state [-] = 1.03405 Isotropic bulk modulus [GPa] = 57.27691 Isotropic shear modulus [GPa] = 85.90960