Model name?
Sim_LAMMPS_Polymorphic_ZhouJonesChu_2017_GaInN__SM_887684855692_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_cI12_220_a"
    },
    "stoichiometric-species": {
      "source-value": [
        "Ga"
      ]
    },
    "a": {
      "source-value": 6.0491,
      "source-unit": "angstrom"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_669798498862_000"
        ]
      ]
    },
    "duplicate_reference_data": []
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 13:04:34      -16.057224        0.981151
LBFGSLineSearch:    1 13:04:38      -16.377295        0.055037
LBFGSLineSearch:    2 13:04:39      -16.378215        0.003403
LBFGSLineSearch:    3 13:04:39      -16.378219        0.000007