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 25.20405342106254 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 0.28404482449764207 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 29 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 0.004199708295433627 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpk_45ngpo | 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=9.8327,0.28224191,0.45280543,84.261,0.055984963,0.12751475,0.55691504,0.34860126,0.21356835,0.94832045,0.7263159,0.4159887 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-1.03265e+01 5.57202e-15 -4.31538e+00] (Cartesian), [-0.9999905 -0.9999905 -0.9999844] (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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 5.45276570e-07 1.00000002e+00 2.57207922e-08] [ 9.99999093e-01 -5.45276570e-07 -6.57518763e-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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpuajbs1ek --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp1zrztwyf --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=9.832746153636508,0.28224185577070304,0.45280788801961386,84.260992132178,0.9440245354589041,0.8725008495843021,0.44309445794907054,0.6514143406198187,0.7864411459449419,0.05169514703347988,0.2736935953217645,0.5840269018703275 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpzafxd_mt --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.