Model name?
MEAM_LAMMPS_KimLee_2008_TiC__MO_134206624109_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_oC16_65_mn"
    },
    "stoichiometric-species": {
      "source-value": [
        "C"
      ]
    },
    "a": {
      "source-value": 4.883,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        1.1391972,
        0.87542494,
        0.15709997,
        0.85013575,
        0.6807677
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_344206135651_000"
        ]
      ]
    },
    "duplicate_reference_data": [
      "RD_432402070923_000"
    ]
  },
  {
    "prototype-label": {
      "source-value": "A_oC16_65_mn"
    },
    "stoichiometric-species": {
      "source-value": [
        "C"
      ]
    },
    "a": {
      "source-value": 4.9133,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        1.1162152,
        1.3733336,
        0.10134088,
        0.12560938,
        0.81864012
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_367949787318_000"
        ]
      ]
    },
    "duplicate_reference_data": []
  }
]

NOTE: The configuration you provided has a maximum force component 4.047677636831773 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 0.22791321908607134 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 16:16:42      -56.111848        4.778254
LBFGSLineSearch:    1 16:16:42      -56.698176        2.854355
LBFGSLineSearch:    2 16:16:43      -57.159854        1.392187
LBFGSLineSearch:    3 16:16:44      -57.441060        0.881094
LBFGSLineSearch:    4 16:16:44      -57.518719        1.072365
LBFGSLineSearch:    5 16:16:47      -57.676333        1.225154
LBFGSLineSearch:    6 16:16:48      -57.874525        2.480785
LBFGSLineSearch:    7 16:16:50      -58.135784        3.100059
LBFGSLineSearch:    8 16:16:52      -58.325602        2.441853
LBFGSLineSearch:    9 16:16:52      -58.537356        1.715301
LBFGSLineSearch:   10 16:16:53      -58.822442        1.159087
LBFGSLineSearch:   11 16:16:54      -58.879727        0.907927
LBFGSLineSearch:   12 16:16:55      -58.907583        0.465585
LBFGSLineSearch:   13 16:16:55      -58.937367        1.110486
LBFGSLineSearch:   14 16:16:57      -59.043315        0.498085
LBFGSLineSearch:   15 16:16:57      -59.079215        0.613130
LBFGSLineSearch:   16 16:16:59      -59.105050        0.732694
LBFGSLineSearch:   17 16:17:01      -59.165406        0.105006
LBFGSLineSearch:   18 16:17:01      -59.166857        0.027347
LBFGSLineSearch:   19 16:17:01      -59.166938        0.005455
LBFGSLineSearch:   20 16:17:02      -59.166953        0.000176
LBFGSLineSearch:   21 16:17:02      -59.166953        0.000021
LBFGSLineSearch:   22 16:17:03      -59.166953        0.000002