Model name? Tersoff_LAMMPS_PlummerTucker_2019_TiSiC__MO_751442731010_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": "AB_hP12_186_a2b_a2b" }, "stoichiometric-species": { "source-value": [ "C", "Si" ] }, "a": { "source-value": 3.0946, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 4.9075486, 0.12540823, 6.1691626e-05, 0.79179857, 0.45829706, 0.66680468, 0.33328977 ] }, "library-prototype-label": { "source-value": "AB_hP12_186_a2b_a2b-001" }, "short-name": { "source-value": "Moissanite-6H SiC" }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_091901798837_000" ] ] }, "duplicate_reference_data": [ "RD_765022010619_000", "RD_088945562488_000", "RD_100474802784_000", "RD_375191677454_000", "RD_915104268055_000", "RD_567571246715_000" ] } ] NOTE: The configuration you provided has a maximum force component 1.6100597118004585 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 13:47:00 -27.767380 21.357690 LBFGSLineSearch: 1 13:47:02 -53.702298 14.096728 LBFGSLineSearch: 2 13:47:03 -67.303255 11.987371 LBFGSLineSearch: 3 13:47:03 -74.764857 10.592693 LBFGSLineSearch: 4 13:47:04 -75.789417 5.636540 LBFGSLineSearch: 5 13:47:05 -77.018263 6.699151 LBFGSLineSearch: 6 13:47:06 -77.803473 3.189317 LBFGSLineSearch: 7 13:47:07 -77.957284 1.284260 LBFGSLineSearch: 8 13:47:08 -78.012414 0.509183 LBFGSLineSearch: 9 13:47:10 -78.019077 0.189101 LBFGSLineSearch: 10 13:47:11 -78.020697 0.131128 LBFGSLineSearch: 11 13:47:12 -78.021080 0.036077 LBFGSLineSearch: 12 13:47:13 -78.021179 0.024433 LBFGSLineSearch: 13 13:47:14 -78.021214 0.006068 LBFGSLineSearch: 14 13:47:15 -78.021215 0.001195 LBFGSLineSearch: 15 13:47:15 -78.021215 0.000220 LBFGSLineSearch: 16 13:47:16 -78.021215 0.000030 LBFGSLineSearch: 17 13:47:17 -78.021215 0.000012 LBFGSLineSearch: 18 13:47:18 -78.021215 0.000000