Model name?
Tersoff_LAMMPS_PlummerTucker_2019_TiAlC__MO_736419017411_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_hP3_191_ad"
    },
    "stoichiometric-species": {
      "source-value": [
        "Ti"
      ]
    },
    "a": {
      "source-value": 4.7179,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        0.60942368
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_455934130096_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_519509765092_000"
    ]
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 16:03:27      -14.241869        0.771432
LBFGSLineSearch:    1 16:03:27      -14.303119        0.213141
LBFGSLineSearch:    2 16:03:27      -14.306888        0.128461
LBFGSLineSearch:    3 16:03:27      -14.307770        0.056715
LBFGSLineSearch:    4 16:03:27      -14.308436        0.024861
LBFGSLineSearch:    5 16:03:27      -14.308519        0.002647
LBFGSLineSearch:    6 16:03:27      -14.308520        0.000299
LBFGSLineSearch:    7 16:03:28      -14.308520        0.000008