INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.9197,1.4818988 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.9197,1.4818988 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 10 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 0.01100616990371261 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp7e1u6f2b | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_tI2_139_a-001: In ($A6$) Structure INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.7489,1.5000909 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [0 0 0] (Cartesian), [0. 0. 0.] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --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_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 9.99999588e-01 -4.91705300e-07 3.50383972e-07] [ 9.99999713e-01 -8.18663652e-09 -1.00000012e+00] [ 9.99999751e-01 -1.00000059e+00 4.19729968e-07]] INFO:kim_tools.symmetry_util.core:Found matching rotation with point group op: [[1.0, 0.0, 0.0], [1.0, 0.0, -1.0], [1.0, -1.0, 0.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A_tI2_139_a that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --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_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpr2flldzh --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_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpirhj53i0 --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_tI2_139_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI2_139_a --params=2.748871589390364,1.5001039592478467 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpurmf0_zq --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.