INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.5225,6.564004,0.046707512,0.57788125,0.67123739,0.29740429 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.44375188974383306 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_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.5225,6.564004,0.046707512,0.57788125,0.67123739,0.29740429 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 18 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 0.0034368240869521605 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpn8o95aob | 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_hP16_194_e3f --params=2.7305,6.5319172,0.046875,0.578125,0.671875,0.296875 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-7.58138e-06 8.75423e-07 -3.20797e-06] (Cartesian), [-2.96168378e-06 -2.59147305e-06 -1.79865396e-07] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --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_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[-1.00000000e+00 -1.13063628e-16 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_hP16_194_e3f that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --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_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp1291lzdn --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_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpi4tc0wt9 --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_hP16_194_e3f --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_hP16_194_e3f --params=2.7304757395732517,6.5319726468749355,0.953124820140062,0.9218748202187053,0.8281248203647094,0.20312482002151078 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp02c_by_a --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.