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_hP58_164_2d3i3j" }, "stoichiometric-species": { "source-value": [ "Si" ] }, "a": { "source-value": 10.017, "source-unit": "angstrom" }, "parameter-values": { "source-value": [ 1.6093441, 0.42717347, 0.57149774, 0.13353688, 0.49951896, 0.20865981, 0.62176631, 0.20852652, 0.37695719, 0.38057577, 0.3795477, 0.29513767, 0.00061200299, 0.24460663, 0.17356382, 0.33353138, 0.4211924, 0.058121322 ] }, "crystal-genome-source-structure-id": { "source-value": [ [ "RD_757650228553_000" ] ] }, "duplicate_reference_data": [] } ] NOTE: The configuration you provided has a maximum force component 7.198877521631559 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 -89.512669 13.487427 LBFGSLineSearch: 1 18:04:37 -148.923803 3.732903 LBFGSLineSearch: 2 18:04:40 -155.149306 3.074786 LBFGSLineSearch: 3 18:04:43 -157.464387 2.644768 LBFGSLineSearch: 4 18:04:47 -158.542689 1.689163 LBFGSLineSearch: 5 18:04:50 -158.911775 1.952664 LBFGSLineSearch: 6 18:04:52 -159.324645 1.373830 LBFGSLineSearch: 7 18:04:54 -159.661501 1.587646 LBFGSLineSearch: 8 18:04:58 -160.044929 2.724446 LBFGSLineSearch: 9 18:05:05 -163.617383 1.769098 LBFGSLineSearch: 10 18:05:06 -164.319786 2.417381 LBFGSLineSearch: 11 18:05:10 -164.906554 1.667422 LBFGSLineSearch: 12 18:05:14 -165.531297 2.364191 LBFGSLineSearch: 13 18:05:17 -166.490095 1.880956 LBFGSLineSearch: 14 18:05:22 -167.266119 2.287144 LBFGSLineSearch: 15 18:05:25 -167.983778 1.758798 LBFGSLineSearch: 16 18:05:28 -168.422984 2.435565 LBFGSLineSearch: 17 18:05:29 -168.558939 0.568404 LBFGSLineSearch: 18 18:05:33 -168.622707 0.759949 LBFGSLineSearch: 19 18:05:37 -168.735563 0.779611 LBFGSLineSearch: 20 18:05:41 -168.862994 0.965690 LBFGSLineSearch: 21 18:05:45 -169.194785 1.647015 LBFGSLineSearch: 22 18:05:48 -169.389423 0.740838 LBFGSLineSearch: 23 18:05:51 -169.461644 0.411653 LBFGSLineSearch: 24 18:05:55 -169.505224 0.652314 LBFGSLineSearch: 25 18:05:58 -169.566118 0.282291 LBFGSLineSearch: 26 18:06:00 -169.611667 0.182246 LBFGSLineSearch: 27 18:06:03 -169.627755 0.218873 LBFGSLineSearch: 28 18:06:06 -169.632447 0.174216 LBFGSLineSearch: 29 18:06:08 -169.639584 0.183273 LBFGSLineSearch: 30 18:06:13 -169.662488 0.839885 LBFGSLineSearch: 31 18:06:17 -169.766060 0.522120 LBFGSLineSearch: 32 18:06:21 -169.806203 0.401047 LBFGSLineSearch: 33 18:06:23 -169.835092 0.235458 LBFGSLineSearch: 34 18:06:26 -169.846097 0.228029 LBFGSLineSearch: 35 18:06:31 -169.870490 0.583626 LBFGSLineSearch: 36 18:06:33 -169.949105 0.386185 LBFGSLineSearch: 37 18:06:37 -169.985735 0.241290 LBFGSLineSearch: 38 18:06:40 -169.993867 0.306279 LBFGSLineSearch: 39 18:06:44 -170.031291 0.428274 LBFGSLineSearch: 40 18:06:48 -170.153969 0.567953 LBFGSLineSearch: 41 18:06:52 -170.247360 0.475895 LBFGSLineSearch: 42 18:06:56 -170.300230 0.408600 LBFGSLineSearch: 43 18:06:59 -170.317546 0.248633 LBFGSLineSearch: 44 18:07:02 -170.331204 0.198203 LBFGSLineSearch: 45 18:07:06 -170.353760 0.611667 LBFGSLineSearch: 46 18:07:10 -170.386669 0.309870 LBFGSLineSearch: 47 18:07:13 -170.457411 0.327154 LBFGSLineSearch: 48 18:07:17 -170.481504 0.285908 LBFGSLineSearch: 49 18:07:20 -170.490965 0.208271 LBFGSLineSearch: 50 18:07:26 -170.499814 0.306804 LBFGSLineSearch: 51 18:07:29 -170.507685 0.142196 LBFGSLineSearch: 52 18:07:31 -170.514633 0.209795 LBFGSLineSearch: 53 18:07:37 -170.521983 0.346862 LBFGSLineSearch: 54 18:07:43 -170.525602 0.232200 LBFGSLineSearch: 55 18:07:46 -170.528361 0.147050 LBFGSLineSearch: 56 18:07:52 -170.535204 0.277751 LBFGSLineSearch: 57 18:08:06 -170.677820 2.289575 LBFGSLineSearch: 58 18:08:14 -170.680103 2.337027 LBFGSLineSearch: 59 18:08:21 -170.909674 1.649187 LBFGSLineSearch: 60 18:08:26 -171.031105 1.177736 LBFGSLineSearch: 61 18:08:29 -171.093515 0.499128 LBFGSLineSearch: 62 18:08:32 -171.124590 0.312137 LBFGSLineSearch: 63 18:08:35 -171.153015 0.549689 LBFGSLineSearch: 64 18:08:43 -171.572083 1.331424 LBFGSLineSearch: 65 18:08:49 -171.577697 1.375218 LBFGSLineSearch: 66 18:08:58 -171.919346 0.957722 LBFGSLineSearch: 67 18:09:06 -172.175629 0.780541 LBFGSLineSearch: 68 18:09:12 -172.300075 0.659277 LBFGSLineSearch: 69 18:09:21 -172.378266 0.564534 LBFGSLineSearch: 70 18:09:26 -172.418576 0.418597 LBFGSLineSearch: 71 18:09:30 -172.463544 0.352205 LBFGSLineSearch: 72 18:09:34 -172.494526 0.269698 LBFGSLineSearch: 73 18:09:37 -172.532355 0.386360 LBFGSLineSearch: 74 18:09:39 -172.559161 0.302286 LBFGSLineSearch: 75 18:09:43 -172.588129 0.396347 LBFGSLineSearch: 76 18:09:46 -172.617510 0.299374 LBFGSLineSearch: 77 18:09:49 -172.657807 0.437666 LBFGSLineSearch: 78 18:09:54 -172.688431 0.392800 LBFGSLineSearch: 79 18:10:00 -172.713575 0.541274 LBFGSLineSearch: 80 18:10:03 -172.726295 0.105994 LBFGSLineSearch: 81 18:10:05 -172.731908 0.112728 LBFGSLineSearch: 82 18:10:08 -172.733188 0.091305 LBFGSLineSearch: 83 18:10:10 -172.733809 0.069293 LBFGSLineSearch: 84 18:10:15 -172.734174 0.055160 LBFGSLineSearch: 85 18:10:18 -172.734485 0.023317 LBFGSLineSearch: 86 18:10:21 -172.734586 0.015786 LBFGSLineSearch: 87 18:10:27 -172.734697 0.013094 LBFGSLineSearch: 88 18:10:30 -172.734723 0.003723 LBFGSLineSearch: 89 18:10:32 -172.734727 0.001108 LBFGSLineSearch: 90 18:10:34 -172.734727 0.000417 LBFGSLineSearch: 91 18:10:35 -172.734727 0.000082 LBFGSLineSearch: 92 18:10:36 -172.734727 0.000075 LBFGSLineSearch: 93 18:10:41 -172.734727 0.000019 LBFGSLineSearch: 94 18:10:47 -172.734727 0.000003