Model name?
Morse_Shifted_GirifalcoWeizer_1959MedCutoff_Mo__MO_534363225491_004
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_hP4_194_ac"
    },
    "stoichiometric-species": {
      "source-value": [
        "Mo"
      ]
    },
    "a": {
      "source-value": 2.7695,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        3.5762773
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_530606616034_000"
        ]
      ]
    },
    "duplicate_reference_data": []
  }
]
                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 17:05:49      -26.446716        4.017613
LBFGSLineSearch:    1 17:05:49      -27.096921        0.821959
LBFGSLineSearch:    2 17:05:49      -27.126245        0.409114
LBFGSLineSearch:    3 17:05:49      -27.134010        0.142252
LBFGSLineSearch:    4 17:05:49      -27.135152        0.027314
LBFGSLineSearch:    5 17:05:49      -27.135198        0.000227
LBFGSLineSearch:    6 17:05:49      -27.135198        0.000081
LBFGSLineSearch:    7 17:05:49      -27.135198        0.000000