INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.1614,2.3850257,0.93992864,0.19609985,0.87847441,0.10226691,0.13030281,0.77487209,0.98453855,0.85341975,0.13332475,0.92680675,0.43292986,0.065760748,0.72131569,0.45643579,0.87171028,0.86152967,0.57092716,0.9958931,0.93303081,0.43052092,0.13256247,0.98508065 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.6220480440911214 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=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.1614,2.3850257,0.93992864,0.19609985,0.87847441,0.10226691,0.13030281,0.77487209,0.98453855,0.85341975,0.13332475,0.92680675,0.43292986,0.065760748,0.72131569,0.45643579,0.87171028,0.86152967,0.57092716,0.9958931,0.93303081,0.43052092,0.13256247,0.98508065 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 49 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:Attempting to find NN distance by searching within covalent radii times 2 INFO:kim_tools.aflow_util.core:Automatically set max fractional residual for solving position equations to 0.0017149231753745262 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpvuni9feu | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.0381,2.4395154,0.13061861,0.7736633,0.62339456,0.10276544,0.56039335,0.19601376,0.50718442,0.85321211,0.36938589,0.92925412,0.50896126,0.56860972,0.42952276,0.87046383,0.45271886,0.35946384,0.064850531,0.43360916,0.2211989,0.063383973,0.13133364,0.9866933 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [ -5.01903 -5.01903 -12.244 ] (Cartesian), [-0.49999572 -0.49999572 -0.49999735] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --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=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --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 A_tP106_137_a5g4h that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --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=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpwojf80ns --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=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpywggyo6n --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=A_tP106_137_a5g4h --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tP106_137_a5g4h --params=10.038145868440767,2.4395072736733905,0.36938566230885383,0.7263393554845983,0.876609720990817,0.3972372135325739,0.9396109224903277,0.3039888942658733,0.9928198602744533,0.6467905438713355,0.1306183847618403,0.5707485297568335,0.4313945525765117,0.4910430191901063,0.4295254144209868,0.5472854219472469,0.12954044329134673,0.3594664907071503,0.5663951186330669,0.9351537461621064,0.2212015494389663,0.868670641138857,0.9366203040889411,0.986695950700528 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpodoefgdw --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.