INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.4678,13.950077,0.86916696,0.13083843 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.000634784505570475 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 0.014971879403476468 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_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.4678,13.950077,0.86916696,0.13083843 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 4 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 0.002513283145141723 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmptqc5s_u6 | 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_hP12_194_bc2f --params=2.4594,13.997723,0.86916427,0.13083574 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-9.63648e-06 -2.38441e-06 -1.72130e+01] (Cartesian), [-3.35852290e-06 -4.47803029e-06 -5.00000000e-01] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --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:Failed to solve equations for prototype A_hP12_194_bc2f on this shift attempt INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.5] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 1.00000000e+00 1.95571444e-17 0.00000000e+00] [ 0.00000000e+00 1.00000000e+00 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: [[1.0, 0.0, 0.0], [0.0, 1.0, 0.0], [0.0, 0.0, -1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A_hP12_194_bc2f that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --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_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpg_odz5ac --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_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpnl1t00mq --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_hP12_194_bc2f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP12_194_bc2f --params=2.459366960629481,13.997911068341379,0.6308357262847086,0.3691642562847086 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp_uomkehw --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.