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 3 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 0.005 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpl9smvbng | 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=4.6318 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-7.17822e-06 -7.17822e-06 -1.00495e-05] (Cartesian), [-1.54977667e-06 -1.54977667e-06 -2.16968562e-06] (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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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=4.631777029681293 --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 6 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 0.004999999999999998 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp9eih_guf | 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=4.6318 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-7.17834e-06 -7.17834e-06 -1.00497e-05] (Cartesian), [-1.54980258e-06 -1.54980258e-06 -2.16972880e-06] (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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029310475 --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=4.631777029681293 --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=4.631777029310475 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpsf748xih --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=4.631777029681293 --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=4.631777029310475 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpcelflpc2 --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=4.631777029681293 --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=4.631777029310475 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpd60bciud --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.