Model name? EDIP_LAMMPS_Marks_2000_C__MO_374144505645_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_oC16_65_pq" }, "stoichiometric-species": { "source-value": [ "C" ] }, "a": { "source-value": 4.2547, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 2.0610619, 0.59089948, 0.18519352, 0.16660457, 0.18446938, 0.41082374 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_107978512998_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 3.146109070682458 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 16:16:28 -56.384970 4.412588 LBFGSLineSearch: 1 16:16:29 -56.499793 0.914823 LBFGSLineSearch: 2 16:16:30 -56.535387 0.742840 LBFGSLineSearch: 3 16:16:31 -56.574082 0.935797 LBFGSLineSearch: 4 16:16:32 -56.619606 0.457470 LBFGSLineSearch: 5 16:16:32 -56.628081 0.239534 LBFGSLineSearch: 6 16:16:33 -56.631336 0.174007 LBFGSLineSearch: 7 16:16:33 -56.634071 0.126989 LBFGSLineSearch: 8 16:16:34 -56.635890 0.136606 LBFGSLineSearch: 9 16:16:34 -56.636333 0.063567 LBFGSLineSearch: 10 16:16:34 -56.636482 0.024489 LBFGSLineSearch: 11 16:16:35 -56.636520 0.023821 LBFGSLineSearch: 12 16:16:35 -56.636607 0.004411 LBFGSLineSearch: 13 16:16:36 -56.636608 0.000513 LBFGSLineSearch: 14 16:16:36 -56.636608 0.000001