INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=10.0092,0.99696279,0.58779922,0.68691123,0.43746514,0.51896554,0.71395007,0.56366939,0.87826171,0.73877602,0.40895898,0.36257694,0.59725778,0.49539958,0.47831656,0.66121931,0.3474838,0.61611508,0.80687377,0.60623289,0.57206579,0.86499379,0.46766254,0.69825546,0.78750107,0.61879088,0.9793786,0.68248778,0.47340845,0.96970412,0.62769556,0.62737604,0.83961232,0.52998349,0.79500019,0.42786654,0.77682682,0.52145274,0.66056026,0.48901769,0.89370861,0.30602198,0.45102464,0.74310966,0.57130468,0.64759124,0.75195863,0.40299444 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 10.446179710431199 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=10.0092,0.99696279,0.58779922,0.68691123,0.43746514,0.51896554,0.71395007,0.56366939,0.87826171,0.73877602,0.40895898,0.36257694,0.59725778,0.49539958,0.47831656,0.66121931,0.3474838,0.61611508,0.80687377,0.60623289,0.57206579,0.86499379,0.46766254,0.69825546,0.78750107,0.61879088,0.9793786,0.68248778,0.47340845,0.96970412,0.62769556,0.62737604,0.83961232,0.52998349,0.79500019,0.42786654,0.77682682,0.52145274,0.66056026,0.48901769,0.89370861,0.30602198,0.45102464,0.74310966,0.57130468,0.64759124,0.75195863,0.40299444 --webpage INFO:kim_tools.test_driver.core:The following exception was caught during minimization: INFO:kim_tools.test_driver.core:RuntimeError('LineSearch failed!') INFO:kim_tools.test_driver.core:Minimization stalled after 186 steps. INFO:kim_tools.test_driver.core:Final forces: INFO:kim_tools.test_driver.core:[[-8.25449135e-03 -1.06309621e-01 -3.09735725e-02] [ 8.25401702e-03 1.06310749e-01 -3.09734399e-02] [-8.25390446e-03 1.06309003e-01 -3.09733034e-02] [ 8.25436788e-03 -1.06310353e-01 -3.09734076e-02] [ 2.28912824e-01 -5.04772350e-02 -2.13840609e-01] [-2.28912929e-01 5.04783992e-02 -2.13840629e-01] [ 2.28912974e-01 5.04779246e-02 -2.13841040e-01] [-2.28912803e-01 -5.04789385e-02 -2.13840672e-01] [ 9.72919198e-03 5.15093836e-02 1.57358012e-02] [-9.72921290e-03 -5.15103703e-02 1.57357219e-02] [ 9.72927235e-03 -5.15087437e-02 1.57356288e-02] [-9.72939517e-03 5.15097925e-02 1.57356893e-02] [-4.65406056e-02 1.31953624e-02 -1.60606935e-02] [ 4.65413022e-02 -1.31965966e-02 -1.60607053e-02] [-4.65413842e-02 -1.31954867e-02 -1.60607361e-02] [ 4.65406495e-02 1.31966449e-02 -1.60606776e-02] [ 6.11712076e-02 1.05052704e-01 1.01185947e-01] [-6.11707526e-02 -1.05053442e-01 1.01186146e-01] [ 6.11707328e-02 -1.05051602e-01 1.01186163e-01] [-6.11712968e-02 1.05052517e-01 1.01186167e-01] [-5.25767787e-02 -7.06485622e-02 7.19543982e-03] [ 5.25766625e-02 7.06470913e-02 7.19534917e-03] [-5.25764873e-02 7.06464637e-02 7.19509735e-03] [ 5.25767826e-02 -7.06453569e-02 7.19526674e-03] [-2.20790347e-01 4.74670345e-02 -8.61037736e-02] [ 2.20789088e-01 -4.74696091e-02 -8.61040106e-02] [-2.20788556e-01 -4.74665991e-02 -8.61037831e-02] [ 2.20790248e-01 4.74693280e-02 -8.61039895e-02] [ 2.62949188e-02 -2.68483974e-02 -2.05972743e-05] [-2.62952226e-02 2.68475777e-02 -2.05517745e-05] [ 2.62955686e-02 2.68474788e-02 -2.04501651e-05] [-2.62949404e-02 -2.68467116e-02 -2.05331145e-05] [-8.27513506e-02 -1.68236868e-02 7.09430244e-02] [ 8.27515425e-02 1.68224142e-02 7.09429795e-02] [-8.27514959e-02 1.68240025e-02 7.09430692e-02] [ 8.27512932e-02 -1.68224935e-02 7.09429748e-02] [-1.24218114e-01 5.96906617e-03 2.74534423e-02] [ 1.24218609e-01 -5.96973792e-03 2.74534694e-02] [-1.24218790e-01 -5.97005407e-03 2.74534163e-02] [ 1.24218083e-01 5.97056285e-03 2.74534748e-02] [ 4.34646599e-01 -1.18826180e-01 -3.64646644e-02] [-4.34643390e-01 1.18827853e-01 -3.64644577e-02] [ 4.34643161e-01 1.18821711e-01 -3.64648461e-02] [-4.34646634e-01 -1.18823555e-01 -3.64648623e-02] [-4.21199021e-02 2.18018321e-01 7.58273626e-02] [ 4.21202157e-02 -2.18016069e-01 7.58273749e-02] [-4.21204915e-02 -2.18017773e-01 7.58275283e-02] [ 4.21200648e-02 2.18015607e-01 7.58273816e-02] [-2.88593429e-01 -4.04616763e-02 -6.59581768e-03] [ 2.88590623e-01 4.04578963e-02 -6.59620688e-03] [-2.88590618e-01 4.04636368e-02 -6.59585559e-03] [ 2.88593356e-01 -4.04597853e-02 -6.59610829e-03] [-1.36045073e-01 1.15191066e-01 5.93954211e-03] [ 1.36042409e-01 -1.15190104e-01 5.93966293e-03] [-1.36042085e-01 -1.15187417e-01 5.93964294e-03] [ 1.36045090e-01 1.15186547e-01 5.93999160e-03] [-4.12049091e-02 -1.40371424e-01 8.57793197e-02] [ 4.12037236e-02 1.40370571e-01 8.57791038e-02] [-4.12039371e-02 1.40375225e-01 8.57795023e-02] [ 4.12047470e-02 -1.40374353e-01 8.57793138e-02]] INFO:kim_tools.test_driver.core:Final stress: INFO:kim_tools.test_driver.core:[-7.91785296e-04 9.71933599e-04 1.79234859e-03 7.99340638e-11 -1.13887229e-09 3.03548854e-10] INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:Attempting to find NN distance by searching within covalent radii times 1 INFO:kim_tools.aflow_util.core:Automatically set max fractional residual for solving position equations to 0.0015292385699599475 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp7h8am_be | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.1024,1.0414616,0.60689488,0.67582458,0.44498813,0.50516293,0.73408725,0.5861904,0.892878,0.40807842,0.022296765,0.685967,0.82283144,0.64367731,0.9855171,0.71000652,0.49409006,0.0064144775,0.63746455,0.65536771,0.89786786,0.26111334,0.83823664,0.51302876,0.72478438,0.40529723,0.33604593,0.57196659,0.49628787,0.45496102,0.64516331,0.35010927,0.60869542,0.22137877,0.45770452,0.14000804,0.44519176,0.20226036,0.94632972,0.19433141,0.72486061,0.37609864,0.48792527,0.90806594,0.33919917,0.49590059,0.72498521,0.59381948 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-4.55121e+00 -4.73989e+00 -1.73160e-05] (Cartesian), [-5.00002714e-01 -4.99997937e-01 -3.13459313e-06] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --equations_only INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.0] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1. 0. 0.] [0. 1. 0.] [0. 0. 1.]] INFO:kim_tools.symmetry_util.core:Found matching rotation with point group op: [[1.0, 0.0, 0.0], [0.0, 1.0, 0.0], [0.0, 0.0, 1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A2B8C2D3_oP60_33_2a_8a_2a_3a that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --params=9.102370590103153,1.041467057391416,0.606892661621256,0.6758218629899373,0.5550139363226956,0.5051597969131436,0.7340845385800179,0.41381165812061305,0.8928748620155111,0.4080757054271964,0.9777052984808903,0.6859638639492762,0.8228287308460209,0.3563247541699117,0.985513967074013,0.7100038041064858,0.5059120033897622,0.006411342950708665,0.6374618371618519,0.3446343501189888,0.8978647294473925,0.26111062565829535,0.16176542705716912,0.5130256210648385,0.7247816656424972,0.594704831182232,0.3360428002372038,0.5719638732699197,0.5037141966417054,0.4549578842241313,0.6451605980549031,0.649892788919328,0.608692283101945,0.22137605303779084,0.542297543174731,0.1400049046097105,0.4451890478044951,0.7977417023199556,0.9463265829962189,0.1943286981375787,0.2751414555537004,0.37609550333906094,0.4879225568108483,0.09193611982066541,0.3391960365205946,0.495897879324003,0.2750168510269053,0.5938163411843138 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a 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INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B8C2D3_oP60_33_2a_8a_2a_3a 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