Model name? Sim_LAMMPS_GW_GaoWeber_2002_SiC__SM_606253546840_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_cF8_227_a" }, "stoichiometric-species": { "source-value": [ "C" ] }, "a": { "source-value": 3.5727, "source-unit": "angstrom" }, "library-prototype-label": { "source-value": "A_cF8_227_a" }, "short-name": { "source-value": "Diamond" }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_932972351634_000" ] ] }, "duplicate_reference_data": [ "RD_369268253838_000", "RD_934390611803_000", "RD_235635192471_000", "RD_380047531965_000", "RD_314903559187_000", "RD_627189256053_000", "RD_287852491168_000", "RD_712701276634_000", "RD_452539028206_000", "RD_175322864559_000", "RD_615207242390_000", "RD_746644174750_000", "RD_800869917864_000", "RD_555511497587_000", "RD_174415898673_000", "RD_810961167381_000", "RD_644739981451_000", "RD_199187661542_000", "RD_598556040956_000", "RD_449600608221_000" ] } ] Step Time Energy fmax LBFGSLineSearch: 0 16:16:16 -10.954906 2.173932 LBFGSLineSearch: 1 16:16:16 -11.437603 0.002097 LBFGSLineSearch: 2 16:16:16 -11.437604 0.000299 LBFGSLineSearch: 3 16:16:16 -11.437604 0.000000