Model name?
Sim_LAMMPS_MEAM_ZhangTrinkle_2016_TiO__SM_513612626462_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_cI2_229_a"
    },
    "stoichiometric-species": {
      "source-value": [
        "Ti"
      ]
    },
    "a": {
      "source-value": 3.397,
      "source-unit": "angstrom"
    },
    "library-prototype-label": {
      "source-value": "A_cI2_229_a"
    },
    "short-name": {
      "source-value": "Body-Centered Cubic"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_719348212458_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_802546231287_000",
      "RD_580065734361_000",
      "RD_385637919514_000",
      "RD_174669587901_000"
    ]
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 21:10:54        2.400295        2.085346
LBFGSLineSearch:    1 21:10:54        0.269102        0.666923
LBFGSLineSearch:    2 21:10:54        0.032440        0.145518
LBFGSLineSearch:    3 21:10:54        0.000000        0.000000