INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.3595,0.95899178,0.31606908,0.61199005,0.23298748 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.488534799449858 eV/angstrom. 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=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.3595,0.95899178,0.31606908,0.61199005,0.23298748 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 10 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 0.0023327088180090656 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpb2yk9qvt | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.3202,0.96415398,0.31963388,0.61294949,0.23342414 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-1.46649e-05 3.87019e-06 -1.17630e+00] (Cartesian), [-2.30860242e-06 -1.69810945e-06 -1.66666703e-01] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_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:Failed to solve equations for prototype A2B_hP18_179_ab_b on this shift attempt INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.5] INFO:kim_tools.aflow_util.core:Failed to solve equations for prototype A2B_hP18_179_ab_b on this shift attempt INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.6666666666666666] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1.00000000e+00 5.13542928e-17 0.00000000e+00] [0.00000000e+00 1.00000000e+00 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: [[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 A2B_hP18_179_ab_b that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --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=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp9672c7dd --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=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmphljd_qhh --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=A2B_hP18_179_ab_b --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_hP18_179_ab_b --params=7.320167003996849,0.9641581229588642,0.6803638145441715,0.3870493659648429,0.7665747212029065 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpusgeqmef --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.