Model name?
Sim_LAMMPS_ADP_StarikovSmirnovaPradhan_2021_Fe__SM_906654900816_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_hP2_194_c"
    },
    "stoichiometric-species": {
      "source-value": [
        "Fe"
      ]
    },
    "a": {
      "source-value": 2.4403,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        1.5759538
      ]
    },
    "library-prototype-label": {
      "source-value": "A_hP2_194_c-001"
    },
    "short-name": {
      "source-value": "Hexagonal Close Packed"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_727881181226_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_449759849635_000",
      "RD_991070543618_000"
    ]
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 12:16:59       -8.396507        1.244568
LBFGSLineSearch:    1 12:17:00       -8.468574        0.454248
LBFGSLineSearch:    2 12:17:00       -8.495419        0.212434
LBFGSLineSearch:    3 12:17:01       -8.498797        0.082200
LBFGSLineSearch:    4 12:17:01       -8.499006        0.054707
LBFGSLineSearch:    5 12:17:02       -8.499337        0.041908
LBFGSLineSearch:    6 12:17:03       -8.499555        0.018288
LBFGSLineSearch:    7 12:17:03       -8.499596        0.009321
LBFGSLineSearch:    8 12:17:03       -8.499603        0.004291
LBFGSLineSearch:    9 12:17:03       -8.499605        0.000199
LBFGSLineSearch:   10 12:17:04       -8.499605        0.000023
LBFGSLineSearch:   11 12:17:04       -8.499605        0.000000