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_hP68_194_ef2h2kl" }, "stoichiometric-species": { "source-value": [ "Si" ] }, "a": { "source-value": 10.4152, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 1.6357247, 0.31830311, 0.81966704, 0.46519346, 0.20236843, 0.54218647, 0.36473096, 0.87644393, 0.86132444, 0.33059886, 0.28059813, 0.064561489 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_213498259012_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 1.6947343758699527 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. Step Time Energy fmax LBFGSLineSearch: 0 18:04:35 -114.124193 14.593368 LBFGSLineSearch: 1 18:04:39 -157.006219 8.161675 LBFGSLineSearch: 2 18:04:43 -181.761527 8.537705 LBFGSLineSearch: 3 18:04:45 -194.606445 4.296374 LBFGSLineSearch: 4 18:04:46 -196.264510 2.151471 LBFGSLineSearch: 5 18:04:49 -197.076796 1.403455 LBFGSLineSearch: 6 18:04:50 -197.406539 1.067754 LBFGSLineSearch: 7 18:04:51 -197.744841 1.023021 LBFGSLineSearch: 8 18:04:54 -198.342036 1.158006 LBFGSLineSearch: 9 18:04:57 -199.759862 2.149654 LBFGSLineSearch: 10 18:04:58 -200.084658 1.997193 LBFGSLineSearch: 11 18:05:00 -200.169723 0.395189 LBFGSLineSearch: 12 18:05:02 -200.257365 0.800133 LBFGSLineSearch: 13 18:05:04 -200.400571 1.402242 LBFGSLineSearch: 14 18:05:06 -200.745116 0.872652 LBFGSLineSearch: 15 18:05:08 -200.961225 0.301768 LBFGSLineSearch: 16 18:05:10 -200.981161 0.208713 LBFGSLineSearch: 17 18:05:14 -200.995560 0.186941 LBFGSLineSearch: 18 18:05:19 -201.015063 0.190118 LBFGSLineSearch: 19 18:05:21 -201.033802 0.214985 LBFGSLineSearch: 20 18:05:22 -201.052974 0.157220 LBFGSLineSearch: 21 18:05:24 -201.066202 0.152968 LBFGSLineSearch: 22 18:05:27 -201.070762 0.142547 LBFGSLineSearch: 23 18:05:27 -201.072144 0.134820 LBFGSLineSearch: 24 18:05:30 -201.073731 0.105190 LBFGSLineSearch: 25 18:05:36 -201.088521 0.159210 LBFGSLineSearch: 26 18:05:43 -201.110162 0.192153 LBFGSLineSearch: 27 18:05:48 -201.119742 0.095440 LBFGSLineSearch: 28 18:05:56 -201.123832 0.121757 LBFGSLineSearch: 29 18:06:02 -201.131874 0.188218 LBFGSLineSearch: 30 18:06:09 -201.242702 0.272482 LBFGSLineSearch: 31 18:06:13 -201.281977 0.097155 LBFGSLineSearch: 32 18:06:15 -201.287252 0.035230 LBFGSLineSearch: 33 18:06:17 -201.288077 0.013167 LBFGSLineSearch: 34 18:06:19 -201.288121 0.003737 LBFGSLineSearch: 35 18:06:21 -201.288126 0.002341 LBFGSLineSearch: 36 18:06:23 -201.288126 0.000411 LBFGSLineSearch: 37 18:06:25 -201.288126 0.000144 LBFGSLineSearch: 38 18:06:27 -201.288126 0.000020 LBFGSLineSearch: 39 18:06:33 -201.288126 0.000004