INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=2.8655 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=2.8655 --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: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 0.008660254037844387 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpp2pzpzgy | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry AB_cP2_221_a_b-001: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1708 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-2.7267e-06 -2.7267e-06 -2.7267e-06] (Cartesian), [-8.59943667e-07 -8.59943667e-07 -8.59943667e-07] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --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=AB_cP2_221_a_b --params=3.1707890931874543 --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 AB_cP2_221_a_b that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --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=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpogdchgo0 --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=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp8ky74g_e --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=AB_cP2_221_a_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_cP2_221_a_b --params=3.1707890931874543 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpnm9jci24 --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.