Model name? Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_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": "A2B_cF408_227_efgh_aeg" }, "stoichiometric-species": { "source-value": [ "O", "Si" ] }, "a": { "source-value": 20.0107, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 0.82889069, 0.78273951, 0.87602924, 0.45066568, 0.7056959, 0.81751496, 0.62920578, 0.84263958 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_171228956220_000" ] ] }, "duplicate_reference_data": [ "RD_956146303223_000" ] } ] NOTE: The configuration you provided has a maximum force component 0.2223265519885535 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 01:02:06 -775.730226 0.314417 LBFGSLineSearch: 1 01:02:07 -775.770371 0.290251 LBFGSLineSearch: 2 01:02:07 -775.807328 0.272364 LBFGSLineSearch: 3 01:02:07 -775.835971 0.241217 LBFGSLineSearch: 4 01:02:07 -775.852066 0.234054 LBFGSLineSearch: 5 01:02:08 -775.870588 0.312051 LBFGSLineSearch: 6 01:02:08 -775.890529 0.181832 LBFGSLineSearch: 7 01:02:09 -775.907558 0.184980 LBFGSLineSearch: 8 01:02:09 -775.967421 0.293689 LBFGSLineSearch: 9 01:02:09 -775.987244 0.062219 LBFGSLineSearch: 10 01:02:10 -775.990638 0.034673 LBFGSLineSearch: 11 01:02:10 -775.991621 0.038255 LBFGSLineSearch: 12 01:02:10 -775.993516 0.027685 LBFGSLineSearch: 13 01:02:10 -775.993820 0.010064 LBFGSLineSearch: 14 01:02:10 -775.993837 0.002599 LBFGSLineSearch: 15 01:02:10 -775.993839 0.000062 LBFGSLineSearch: 16 01:02:11 -775.993839 0.000006