Model name?
EDIP_LAMMPS_LucasBertolusPizzagalli_2009_SiC__MO_634310164305_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_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 0.5213349455181605 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 0.04909841545094385 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 16:16:26     -117.959149        0.521335
LBFGSLineSearch:    1 16:16:27     -117.968489        0.329842
LBFGSLineSearch:    2 16:16:28     -117.973674        0.248293
LBFGSLineSearch:    3 16:16:29     -117.977694        0.201274
LBFGSLineSearch:    4 16:16:29     -117.979739        0.193149
LBFGSLineSearch:    5 16:16:31     -117.983974        0.207769
LBFGSLineSearch:    6 16:16:33     -117.988875        0.016905
LBFGSLineSearch:    7 16:16:34     -117.988964        0.029709
LBFGSLineSearch:    8 16:16:34     -117.989014        0.012382
LBFGSLineSearch:    9 16:16:35     -117.989025        0.000012
LBFGSLineSearch:   10 16:16:36     -117.989025        0.000000