INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --params=3.0942,22.083123,0.027737996,0.10185281,0.25006394,0.95367302,0.36117442,0.80561884,0.4722888,0.69450991,0.58340023,0.22221393,0.33332381,0.07407983,0.44443225,0.99998277,0.55554715,0.66665413,0.77776987,0.92589232,0.65737804,0.5092664,0.73148577,0.43515581,0.8796954,0.13885487,0.99080585,0.28704109,0.21292166,0.96295221,0.70370561,0.2592665,0.40737461,0.85184069,0.48148442,0.62959668,0.11108069,0.18517325,0.76848619,0.064877279,0.17598852,0.32404073,0.39815432,0.54626724,0.62037798,0.84255183,0.91667359,0.5925992,0.51848559,0.74070728,0.037026739,0.81479934,0.370376,0.88889355,0.1481435,0.29626557 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 0.5610027662870329 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.test_driver.core:The configuration you provided has a maximum stress component 0.029639271606832194 eV/angstrom^3 even though the nominal state of the system is unstressed. 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=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --params=3.0942,22.083123,0.027737996,0.10185281,0.25006394,0.95367302,0.36117442,0.80561884,0.4722888,0.69450991,0.58340023,0.22221393,0.33332381,0.07407983,0.44443225,0.99998277,0.55554715,0.66665413,0.77776987,0.92589232,0.65737804,0.5092664,0.73148577,0.43515581,0.8796954,0.13885487,0.99080585,0.28704109,0.21292166,0.96295221,0.70370561,0.2592665,0.40737461,0.85184069,0.48148442,0.62959668,0.11108069,0.18517325,0.76848619,0.064877279,0.17598852,0.32404073,0.39815432,0.54626724,0.62037798,0.84255183,0.91667359,0.5925992,0.51848559,0.74070728,0.037026739,0.81479934,0.370376,0.88889355,0.1481435,0.29626557 --webpage INFO:kim_tools.test_driver.core:Minimization converged after 54 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 0.002284062787276606 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpo4e0nhp0 | 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=AB_hP54_156_9a9b9c_9a9b9c --params=3.0661,22.39516,0.9533773,0.25011937,0.47219093,0.10190518,0.80529817,0.58322598,0.69426103,0.027629836,0.36115588,0.44457324,0.074356203,0.33353818,0.22250163,0.00010410016,0.55560829,0.7776797,0.92590612,0.66664333,0.84234324,0.91661857,0.7680907,0.064832758,0.17587138,0.3239506,0.39822681,0.54602071,0.62029691,0.14825291,0.29647933,0.51854943,0.37067805,0.8148175,0.03721502,0.8890696,0.59274816,0.74061951,0.21291645,0.28719177,0.99058476,0.13866391,0.43498565,0.87954616,0.65705576,0.50926186,0.73133195,0.62958448,0.96296629,0.7037832,0.2596428,0.11119272,0.85192842,0.18539071,0.40751437,0.48171311 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-1.45142e-05 -2.29944e-14 -6.86658e+01] (Cartesian), [-4.73383324e-06 -4.73383325e-06 -9.99999929e-01] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --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=AB_hP54_156_9a9b9c_9a9b9c --params=3.0660564573182487,22.395479612518947,0.9533773689843046,0.25011943767352474,0.4721910031040517,0.10190524970470438,0.8052982392099093,0.5832260539457348,0.6942610964556293,0.027629906940183524,0.36115594691207953,0.44457330687412355,0.07435627390109989,0.3335382499591253,0.22250170301110828,0.00010417124247252829,0.5556083578216895,0.7776797668149968,0.9259061874983052,0.6666434031588437,0.21291651819050283,0.2871918449491959,0.990584835027879,0.13866397993346236,0.434985723022713,0.8795462324670231,0.6570558269926607,0.509261930900335,0.7313320238908618,0.629584550269608,0.9629663657072705,0.703783271662858,0.25964287592334,0.11119279439794916,0.8519284960409585,0.18539078509086826,0.40751444591721286,0.4817131792341982,0.8423433102455111,0.916618645295074,0.7680907675314543,0.06483282864467865,0.17587145265586024,0.3239506692942429,0.39822687637290843,0.546020778891013,0.6202969794476256,0.1482529809424351,0.296479397295756,0.5185495006216874,0.3706781258606442,0.814817574241804,0.037215091484827933,0.8890696721974805,0.5927482265788995,0.7406195818383914 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 9.99999767e-01 -2.33125054e-07 0.00000000e+00] [ 9.99999534e-01 -9.99999767e-01 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], [1.0, -1.0, 0.0], [0.0, 0.0, 1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype AB_hP54_156_9a9b9c_9a9b9c that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--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=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpmhxvjrof --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=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpvsbu0q_0 --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=AB_hP54_156_9a9b9c_9a9b9c --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=AB_hP54_156_9a9b9c_9a9b9c 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--webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp7xevfeq5 --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.