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_tI4_141_a"
    },
    "stoichiometric-species": {
      "source-value": [
        "Si"
      ]
    },
    "a": {
      "source-value": 4.8146,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        0.54949529
      ]
    },
    "library-prototype-label": {
      "source-value": "A_tI4_141_a-001"
    },
    "short-name": {
      "source-value": "betaSn"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_836155795862_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_542335592260_000",
      "RD_881662876123_000"
    ]
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 18:50:22       -0.003366        1.119296
LBFGSLineSearch:    1 18:50:23       -5.074777        0.367588
LBFGSLineSearch:    2 18:50:23       -5.074894        0.339369
LBFGSLineSearch:    3 18:50:23       -5.235812        3.108710
LBFGSLineSearch:    4 18:50:23       -5.263482        4.634684
LBFGSLineSearch:    5 18:50:23       -5.551494        0.363035
LBFGSLineSearch:    6 18:50:23       -5.569844        1.350598
LBFGSLineSearch:    7 18:50:23       -5.606800        1.615184
LBFGSLineSearch:    8 18:50:23       -5.629537        0.330219
LBFGSLineSearch:    9 18:50:23       -5.635350        0.070792
LBFGSLineSearch:   10 18:50:23       -5.636322        0.140730
LBFGSLineSearch:   11 18:50:23       -5.636528        0.030631
LBFGSLineSearch:   12 18:50:23       -5.636544        0.000662
LBFGSLineSearch:   13 18:50:23       -5.636544        0.000058
LBFGSLineSearch:   14 18:50:23       -5.636544        0.000021
LBFGSLineSearch:   15 18:50:23       -5.636544        0.000000