INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0985,3.6231244 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0985,3.6231244 --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 0.008165529054362812 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpwwdbb_eo | 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_tI4_141_a --params=5.0316,3.6735035 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-2.51579e+00 2.22045e-16 -9.24180e+00] (Cartesian), [-0.50000013 -0.99999431 -0.49999418] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --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_tI4_141_a on this shift attempt INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.5, 0.5, 0.0] INFO:kim_tools.aflow_util.core:Failed to solve equations for prototype A_tI4_141_a on this shift attempt INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.5, 0.0, 0.5] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 1.00000000e+00 4.60068297e-17 4.66717799e-18] [ 0.00000000e+00 1.00000000e+00 -2.63028124e-17] [ 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_tI4_141_a that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --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_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpivmzsa50 --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_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmptazhy6fs --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_tI4_141_a --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_tI4_141_a --params=5.0316385633605,3.6734743382041506 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpnmag9atw --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.