Model name? Tersoff_LAMMPS_AlbeNordlundNord_2002_GaAs__MO_799020228312_004 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_mC4_15_e" }, "stoichiometric-species": { "source-value": [ "Ga" ] }, "a": { "source-value": 2.7913, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 2.9000466, 1.53656, 129.558, 0.88421875 ] }, "library-prototype-label": { "source-value": "A_mC4_15_e-001" }, "short-name": { "source-value": "beta-Ga (obsolete)" }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_525912051999_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 2.3901416436551806 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 17:13:54 -5.438720 2.520370 LBFGSLineSearch: 1 17:13:55 -5.570410 0.231696 LBFGSLineSearch: 2 17:13:55 -5.580508 0.194401 LBFGSLineSearch: 3 17:13:56 -5.586539 0.097228 LBFGSLineSearch: 4 17:13:56 -5.587285 0.076079 LBFGSLineSearch: 5 17:13:56 -5.587984 0.028384 LBFGSLineSearch: 6 17:13:56 -5.588034 0.013065 LBFGSLineSearch: 7 17:13:56 -5.588054 0.011986 LBFGSLineSearch: 8 17:13:56 -5.588103 0.006798 LBFGSLineSearch: 9 17:13:56 -5.588114 0.002933 LBFGSLineSearch: 10 17:13:56 -5.588116 0.000458 LBFGSLineSearch: 11 17:13:56 -5.588116 0.000000