INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.5124,1.6642254,0.062750617 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.022794014426733122 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 0.15234029176990574 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_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.5124,1.6642254,0.062750617 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 7 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 0.005455615274460764 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpi9ywiv5j | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_hP4_194_f-001: Lonsdaleite (Hexagonal Diamond) Structure INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.5151,1.6330563,0.56250498 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-3.89603e-06 -2.24938e-06 -2.05365e+00] (Cartesian), [-1.03270882e-06 -2.06542179e-06 -5.00001341e-01] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --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_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-2.33125054e-07 9.99999767e-01 0.00000000e+00] [ 9.99999534e-01 2.33125054e-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_hP4_194_f that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --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_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp03m_8__8 --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_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp8nybxg9v --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_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=2.515084415867587,1.6330620792496853,0.562503634263364 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpgrvxbq2o --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.