Model name?
MEAM_LAMMPS_AgrawalMirzaeifar_2021_CuC__MO_028979335952_002
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_hP16_194_e3f"
    },
    "stoichiometric-species": {
      "source-value": [
        "C"
      ]
    },
    "a": {
      "source-value": 2.5225,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        6.564004,
        0.046707512,
        0.57788125,
        0.67123739,
        0.29740429
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_680212468769_000"
        ]
      ]
    },
    "duplicate_reference_data": []
  }
]

NOTE: The configuration you provided has a maximum force component 12.573028306177507 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration.


NOTE: The configuration you provided has a maximum stress component 0.1448568390719999 eV/angstrom^3 even though the nominal state of the system is unstressed. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration.

                 Step     Time          Energy          fmax
LBFGSLineSearch:    0 16:16:51     -113.348558       12.573028
LBFGSLineSearch:    1 16:16:53     -115.914720        1.083747
LBFGSLineSearch:    2 16:16:55     -116.069453        0.880777
LBFGSLineSearch:    3 16:16:57     -116.096988        0.667112
LBFGSLineSearch:    4 16:16:59     -116.158731        0.682763
LBFGSLineSearch:    5 16:17:00     -116.187467        0.308588
LBFGSLineSearch:    6 16:17:02     -116.196577        0.051932
LBFGSLineSearch:    7 16:17:03     -116.196688        0.006569
LBFGSLineSearch:    8 16:17:04     -116.196689        0.001933
LBFGSLineSearch:    9 16:17:05     -116.196690        0.002372
LBFGSLineSearch:   10 16:17:06     -116.196691        0.000354
LBFGSLineSearch:   11 16:17:06     -116.196691        0.000046
LBFGSLineSearch:   12 16:17:07     -116.196691        0.000001