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_cI82_217_acgh" }, "stoichiometric-species": { "source-value": [ "Si" ] }, "a": { "source-value": 12.484, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 0.60872638, 0.067937819, 0.29127613, 0.022996208, 0.36892608, 0.23626523 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_920273982077_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 1.3672680796442187 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 17:03:55 -68.761828 14.376017 LBFGSLineSearch: 1 17:04:00 -93.023248 8.413386 LBFGSLineSearch: 2 17:04:03 -105.366471 5.563533 LBFGSLineSearch: 3 17:04:08 -112.282364 3.044815 LBFGSLineSearch: 4 17:04:12 -112.786201 0.713761 LBFGSLineSearch: 5 17:04:14 -112.888778 0.527971 LBFGSLineSearch: 6 17:04:19 -113.039854 0.717325 LBFGSLineSearch: 7 17:04:24 -113.655529 0.707250 LBFGSLineSearch: 8 17:04:28 -113.804952 0.417950 LBFGSLineSearch: 9 17:04:32 -113.856934 0.196823 LBFGSLineSearch: 10 17:04:36 -113.875516 0.173027 LBFGSLineSearch: 11 17:04:42 -113.902852 0.260822 LBFGSLineSearch: 12 17:04:48 -114.120457 0.904546 LBFGSLineSearch: 13 17:04:53 -114.305011 1.075166 LBFGSLineSearch: 14 17:04:56 -114.369198 0.198635 LBFGSLineSearch: 15 17:04:59 -114.376073 0.044172 LBFGSLineSearch: 16 17:05:02 -114.377009 0.007505 LBFGSLineSearch: 17 17:05:05 -114.377026 0.008805 LBFGSLineSearch: 18 17:05:07 -114.377031 0.004274 LBFGSLineSearch: 19 17:05:09 -114.377031 0.000448 LBFGSLineSearch: 20 17:05:11 -114.377031 0.000024 LBFGSLineSearch: 21 17:05:14 -114.377031 0.000000