INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.577 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.577 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 1 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 0.005000000000000001 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpqyrxm4y2 | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_cP8_223_ac-001: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.5858 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-4.58579 -4.58579 -4.58578] (Cartesian), [-0.99998914 -0.99998914 -0.99998696] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --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_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1. 0. 0.] [0. 1. 0.] [0. 0. 1.]] 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_cP8_223_ac that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=5.5603 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=5.5603 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 5 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 0.005000000000000002 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp1rz4v4gn | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_cP8_223_ac-001: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.5858 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-4.58579 -4.58579 -4.58578] (Cartesian), [-0.99998909 -0.99998909 -0.99998691] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --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_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[0. 1. 0.] [1. 0. 0.] [0. 0. 1.]] 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_cP8_223_ac that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --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_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp8oi3t_g3 --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1. 0. 0.] [0. 1. 0.] [0. 0. 1.]] 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: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_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpjyosmebv --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1. 0. 0.] [0. 1. 0.] [0. 0. 1.]] 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: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_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585839810236656 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_cP8_223_ac --params=4.585840041671858 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpoqer82rp --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1. 0. 0.] [0. 1. 0.] [0. 0. 1.]] 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.test_driver.core:Deduplicated 6 Property Instances down to 3.