Model name? Sim_LAMMPS_Polymorphic_NordAlbeErhart_2003_GaN__SM_333071728528_000 Temperature (K)? No temperature given Cauchy stress (literal list of floats, Voigt order xx,yy,zz,yz,xz,xy, eV/A^3)? No stress given Runtime arguments (literal dictonary)? No runtime arguments given Initial parameters from query or test_generator (literal list of dicts)? [ { "prototype-label": { "source-value": "A_oC40_63_2cf3g" }, "stoichiometric-species": { "source-value": [ "Ga" ] }, "a": { "source-value": 10.5959, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 1.285903, 0.49246407, 0.99994518, 0.21340616, 0.39342112, 0.99751753, 0.2773131, 0.94908387, 0.62563937, 0.29385601, 0.77128637, 0.13906362 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_474047521004_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 4.106300672741703 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 16:19:06 -40.064853 8.230060 LBFGSLineSearch: 1 16:19:08 -43.044042 7.408422 LBFGSLineSearch: 2 16:19:11 -49.470943 3.509598 LBFGSLineSearch: 3 16:19:15 -51.534137 1.535104 LBFGSLineSearch: 4 16:19:18 -52.585483 1.748999 LBFGSLineSearch: 5 16:19:21 -52.897353 1.172092 LBFGSLineSearch: 6 16:19:24 -53.433229 0.962496 LBFGSLineSearch: 7 16:19:25 -53.684000 0.597424 LBFGSLineSearch: 8 16:19:28 -53.812086 0.428334 LBFGSLineSearch: 9 16:19:29 -53.825973 0.384615 LBFGSLineSearch: 10 16:19:32 -53.863689 0.491909 LBFGSLineSearch: 11 16:19:34 -53.919069 0.419449 LBFGSLineSearch: 12 16:19:36 -53.958303 0.464247 LBFGSLineSearch: 13 16:19:39 -54.004445 0.373493 LBFGSLineSearch: 14 16:19:40 -54.054265 0.353625 LBFGSLineSearch: 15 16:19:41 -54.086713 0.415320 LBFGSLineSearch: 16 16:19:42 -54.138830 0.194370 LBFGSLineSearch: 17 16:19:42 -54.150771 0.198982 LBFGSLineSearch: 18 16:19:44 -54.155689 0.155869 LBFGSLineSearch: 19 16:19:45 -54.161384 0.257062 LBFGSLineSearch: 20 16:19:45 -54.168521 0.107651 LBFGSLineSearch: 21 16:19:46 -54.171621 0.061220 LBFGSLineSearch: 22 16:19:47 -54.172581 0.033185 LBFGSLineSearch: 23 16:19:48 -54.172940 0.027863 LBFGSLineSearch: 24 16:19:49 -54.173135 0.037021 LBFGSLineSearch: 25 16:19:50 -54.173423 0.032865 LBFGSLineSearch: 26 16:19:52 -54.173784 0.042726 LBFGSLineSearch: 27 16:19:53 -54.175107 0.051253 LBFGSLineSearch: 28 16:19:54 -54.175298 0.017904 LBFGSLineSearch: 29 16:19:54 -54.175447 0.021443 LBFGSLineSearch: 30 16:19:56 -54.176001 0.008511 LBFGSLineSearch: 31 16:19:56 -54.176052 0.008351 LBFGSLineSearch: 32 16:19:57 -54.176079 0.006268 LBFGSLineSearch: 33 16:19:58 -54.176118 0.004335 LBFGSLineSearch: 34 16:19:59 -54.176125 0.004102 LBFGSLineSearch: 35 16:20:00 -54.176129 0.003851 LBFGSLineSearch: 36 16:20:01 -54.176135 0.002278 LBFGSLineSearch: 37 16:20:02 -54.176139 0.000098 LBFGSLineSearch: 38 16:20:03 -54.176139 0.000002