Model name?
Sim_LAMMPS_BOP_ZhouWardFoster_2015_CCu__SM_784926969362_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_cP1_221_a"
    },
    "stoichiometric-species": {
      "source-value": [
        "C"
      ]
    },
    "a": {
      "source-value": 1.774,
      "source-unit": "angstrom"
    },
    "library-prototype-label": {
      "source-value": "A_cP1_221_a"
    },
    "short-name": {
      "source-value": "alpha-Po"
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_264533273680_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_895883518403_000",
      "RD_640053269289_000"
    ]
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 10:29:55       -2.168273        1.338040
LBFGSLineSearch:    1 10:30:02       -2.215932        0.340455
LBFGSLineSearch:    2 10:30:08       -2.219464        0.022390
LBFGSLineSearch:    3 10:30:15       -2.219480        0.000429
LBFGSLineSearch:    4 10:30:19       -2.219480        0.000122
LBFGSLineSearch:    5 10:30:21       -2.219480        0.000000