INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.9056,0.27794558,1.0489443,154.3362,0.18156111,0.12588526,0.90562063,0.34640648,0.15579867,0.9429254,0.14139464,0.41433526 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.5370733953780394 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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.9056,0.27794558,1.0489443,154.3362,0.18156111,0.12588526,0.90562063,0.34640648,0.15579867,0.9429254,0.14139464,0.41433526 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 28 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 0.004222720172788208 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmp988vhb4b | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry A_mC16_12_4i-001: M-carbon Structure INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.9069,0.28119854,0.44452035,85.354,0.94342505,0.86925399,0.44257983,0.65467405,0.7894858,0.047857215,0.27423478,0.58704219 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-6.26678e-01 7.99258e-15 -6.15004e+00] (Cartesian), [-0.99999396 -0.99999396 -0.99999394] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --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_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 1.00000000e+00 1.51727741e-16 -1.73975536e-16] [ 0.00000000e+00 1.00000000e+00 2.52171275e-16] [ 5.55111512e-17 -5.55111512e-17 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_mC16_12_4i that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpbwrrvbvq --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpb8vthegc --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_mC16_12_4i --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A_mC16_12_4i --params=13.906932654197512,0.28119455072192046,1.0609368435336062,155.31606067653962,0.18732699022317356,0.13075206888496593,0.9027521513457573,0.34533200792613794,0.16266302451019432,0.9521488474639836,0.13872906935059248,0.41296387490150566 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpz5h7fknm --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.