Model name? Tersoff_LAMMPS_PlummerTucker_2019_TiAlC__MO_736419017411_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_tI8_139_h" }, "stoichiometric-species": { "source-value": [ "C" ] }, "a": { "source-value": 4.3798, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 0.57333668, 0.81976373 ] }, "library-prototype-label": { "source-value": "A_tI8_139_h-001" }, "short-name": { "source-value": "Hypothetical Tetrahedrally Bonded Carbon with 4-Member Rings" }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_649356775256_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 1.3733764481961783 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 14:29:40 -27.639137 1.942248 LBFGSLineSearch: 1 14:29:42 -27.694680 0.592913 LBFGSLineSearch: 2 14:29:43 -27.708678 0.091304 LBFGSLineSearch: 3 14:29:45 -27.708841 0.002356 LBFGSLineSearch: 4 14:29:46 -27.708841 0.000101 LBFGSLineSearch: 5 14:29:47 -27.708841 0.000048 LBFGSLineSearch: 6 14:29:47 -27.708841 0.000000