INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=10.2415,0.37696626,2.274491,113.7336,0.075664135,0.96858081,0.34532764,0.12387618,0.50480131,0.29806326,0.49177878,0.44522583,0.80298895,0.48216759,0.77351832,0.61699666,0.07417085,0.65196614,0.78639859,0.72631965,0.88954321,0.85570463,0.10254777,0.78603577,0.32384031,0.93421848,0.10194622,0.88606025,0.94467547,0.70163366,0.6164131,0.64612053,0.6652839,0.52451857,0.30457756,0.20494614,0.13131574,0.059847637 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 12.492240471185731 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=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=10.2415,0.37696626,2.274491,113.7336,0.075664135,0.96858081,0.34532764,0.12387618,0.50480131,0.29806326,0.49177878,0.44522583,0.80298895,0.48216759,0.77351832,0.61699666,0.07417085,0.65196614,0.78639859,0.72631965,0.88954321,0.85570463,0.10254777,0.78603577,0.32384031,0.93421848,0.10194622,0.88606025,0.94467547,0.70163366,0.6164131,0.64612053,0.6652839,0.52451857,0.30457756,0.20494614,0.13131574,0.059847637 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 72 steps. 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 0.0025917282048180685 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp5ye3rpe0 | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.0149,0.43861829,2.3308855,110.2132,0.61181795,0.065585603,0.65157661,0.8807481,0.5139486,0.71020155,0.51394359,0.5679224,0.17726362,0.5212914,0.15867025,0.37993753,0.83549518,0.34416336,0.14600269,0.2588426,0.059221955,0.15039844,0.79699401,0.20404418,0.12894532,0.97396292,0.7176703,0.79579123,0.3307106,0.47621185,0.33008971,0.34847142,0.16215443,0.88366282,0.98112351,0.2907033,0.098886576,0.058559192 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-9.01193e+00 -2.44249e-15 -2.31094e-01] (Cartesian), [-9.99994473e-01 -9.99994473e-01 -5.54256516e-07] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --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=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-2.89001117e-08 -1.00000015e+00 1.46364033e-07] [-1.00000011e+00 2.89001115e-08 6.82861171e-08] [ 1.11022312e-16 -1.11022323e-16 -1.00000000e+00]] INFO:kim_tools.symmetry_util.core:Found matching rotation with point group op: [[0.0, -1.0, 0.0], [-1.0, 0.0, 0.0], [0.0, 0.0, -1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A11B6_mC68_12_11i_6i that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmplgfkzxqp --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpllwmau1y --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A11B6_mC68_12_11i_6i --params=9.014946346780198,0.4386169069477545,2.330869420722552,110.21324984473529,0.3881875773827066,0.9344138422822927,0.3484289136289036,0.11925134565641038,0.48605692637664144,0.2897978935422394,0.4860619369530903,0.4320770473347051,0.8227419040876915,0.4787080484288935,0.8413352730812411,0.6200619152812128,0.16451034653787766,0.6558360905563279,0.8540028342279495,0.7411568431676017,0.940783571916169,0.849601002069654,0.20301151798208417,0.7959552687396632,0.8710602076331229,0.02603652091257236,0.2823352309842948,0.20420821997751148,0.6692949219237605,0.5237875973870816,0.6699158206420046,0.6515280290354148,0.8378510989663601,0.11633662402915834,0.018882012689963368,0.7092961504731481,0.9011189507262944,0.9414402535388966 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmptcr5df3e --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.