INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=9.1921,0.27467064,0.45133321,82.971,0.94271241,0.87955035,0.44178398,0.65364615,0.78567809,0.059238811,0.27133365,0.58534651 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 2.6340767491275003 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.test_driver.core:The configuration you provided has a maximum stress component 0.2703898387168012 eV/angstrom^3 even though the nominal state of the system is unstressed. 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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=9.1921,0.27467064,0.45133321,82.971,0.94271241,0.87955035,0.44178398,0.65364615,0.78567809,0.059238811,0.27133365,0.58534651 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 19 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 0.004103242241073722 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpnuch9bth | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_mC16_12_4i-001: M-carbon Structure INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.9573,0.27305103,0.45402074,83.5626,0.053163329,0.12221893,0.55527468,0.35515759,0.21380771,0.94026592,0.72891179,0.41747357 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-8.95719e+00 -3.33067e-15 4.29174e-02] (Cartesian), [-9.99997458e-01 -9.99997458e-01 -2.81276317e-06] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --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_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-4.85365133e-07 -1.00000081e+00 -6.59933023e-08] [-9.99999975e-01 4.85365133e-07 2.59766078e-08] [ 0.00000000e+00 0.00000000e+00 -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 A_mC16_12_4i that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpsaxqvdcj --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpnoeb9cit --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=8.957314306067959,0.2730476625961221,0.4540186788674676,83.56262429953884,0.9468392133221475,0.8777782588854266,0.4447278656005913,0.6448396019381413,0.7861948367056775,0.05973126404123752,0.2710907562887601,0.5825236133759104 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpimz6wsdm --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.