INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7854,2.9018453,1.1948374,0.13408348 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 5.033217990114265 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_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7854,2.9018453,1.1948374,0.13408348 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 14 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 0.008326688668927017 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpkx8apd53 | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry None: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7242,2.7609573,1.2498715,0.14107705 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-1.98428e-06 -1.73247e-06 -3.40489e+00] (Cartesian), [-4.98052860e-07 -9.58731357e-07 -9.99982407e-01] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --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_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-9.10632015e-07 -9.99999246e-01 0.00000000e+00] [-1.00000064e+00 9.10632015e-07 0.00000000e+00] [ 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_oC4_63_c that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --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_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpg18p2ptm --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_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpxeg4t42g --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_oC4_63_c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_oC4_63_c --params=2.7241920628735063,2.7609596123738243,1.2498934817065919,0.1410768217662849 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp0rtzrnpx --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.