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": "AB_hP8_186_ab_ab"
    },
    "stoichiometric-species": {
      "source-value": [
        "C",
        "Si"
      ]
    },
    "a": {
      "source-value": 3.0934,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        3.2733562,
        0.00019436728,
        0.18764075,
        0.74957521,
        0.93758968
      ]
    },
    "library-prototype-label": {
      "source-value": "AB_hP8_186_ab_ab-001"
    },
    "short-name": {
      "source-value": "Moissanite-4H SiC"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_086978719260_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_257961450295_000"
    ]
  }
]

NOTE: The configuration you provided has a maximum force component 0.19789736793900836 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration.


NOTE: The configuration you provided has a maximum stress component 0.025388055259585537 eV/angstrom^3 even though the nominal state of the system is unstressed. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration.

                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 13:55:52      -51.284808        0.266300
LBFGSLineSearch:    1 13:55:53      -51.289058        0.165424
LBFGSLineSearch:    2 13:55:55      -51.294564        0.086359
LBFGSLineSearch:    3 13:55:55      -51.295349        0.074013
LBFGSLineSearch:    4 13:55:56      -51.295650        0.028344
LBFGSLineSearch:    5 13:55:57      -51.295719        0.017970
LBFGSLineSearch:    6 13:55:58      -51.295744        0.011567
LBFGSLineSearch:    7 13:56:00      -51.295753        0.008602
LBFGSLineSearch:    8 13:56:03      -51.295759        0.008565
LBFGSLineSearch:    9 13:56:05      -51.295788        0.011053
LBFGSLineSearch:   10 13:56:06      -51.295801        0.000161
LBFGSLineSearch:   11 13:56:08      -51.295801        0.000017
LBFGSLineSearch:   12 13:56:09      -51.295801        0.000000