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 2.2852055904513136 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_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 17 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 0.004170678801666138 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp5699wiga | 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=9.1938,0.27835063,0.45358829,82.0863,0.055860667,0.11992647,0.55735632,0.34512226,0.21543502,0.94392052,0.72848164,0.4196212 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-9.73439e+00 -1.77636e-15 -4.20897e+00] (Cartesian), [-0.99999943 -0.99999943 -0.99998524] (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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-3.47610710e-07 -9.99999911e-01 -1.61257019e-08] [-9.99999315e-01 3.47610710e-07 6.44649736e-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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpvdcsk52l --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpg_wtrpvj --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=9.193810960809486,0.278345732747076,0.4535920963839377,82.0863237721532,0.944139899562437,0.8800882927159661,0.44264424561369964,0.6548925053382837,0.7845655479045714,0.056094243487206485,0.2715189256451851,0.5803935640501328 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmps67r7hwx --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.