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=3.8496,1.6527431,0.56294015 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.06106794302101064 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=A_hP4_194_f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP4_194_f --params=3.8496,1.6527431,0.56294015 --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 0.005455618179730796 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp7bj25zfj | 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=3.8421,1.6329872,0.5625 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-3.84210e+00 1.04213e-06 -6.27409e+00] (Cartesian), [-0.99999828 -0.99999796 -0.99999286] (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=3.8421072201162314,1.6329931620682105,0.562507143377333 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[1.00000000e+00 4.50197214e-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 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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp6lew2xjg --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp70sz0c1g --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=3.8421072201162314,1.6329931620682105,0.562507143377333 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpfo_4cuq8 --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.