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_cP1_221_a" }, "stoichiometric-species": { "source-value": [ "C" ] }, "a": { "source-value": 1.774, "source-unit": "angstrom" }, "library-prototype-label": { "source-value": "A_cP1_221_a" }, "short-name": { "source-value": "alpha-Po" }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_264533273680_000" ] ] }, "duplicate_reference_data": [ "RD_895883518403_000", "RD_640053269289_000" ] } ] Step Time Energy fmax LBFGSLineSearch: 0 16:16:15 -4.975121 1.717054 LBFGSLineSearch: 1 16:16:16 -5.112154 0.002309 LBFGSLineSearch: 2 16:16:17 -5.112154 0.000293 LBFGSLineSearch: 3 16:16:17 -5.112154 0.000018 LBFGSLineSearch: 4 16:16:18 -5.112154 0.000000