Model name?
MEAM_LAMMPS_LiyanageKimHouze_2014_FeC__MO_075279800195_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_oP16_62_4c"
    },
    "stoichiometric-species": {
      "source-value": [
        "C"
      ]
    },
    "a": {
      "source-value": 9.0838,
      "source-unit": "angstrom"
    },
    "parameter-values": {
      "source-value": [
        0.27794535,
        0.45742971,
        0.80509054,
        0.074368855,
        0.18951676,
        0.70009446,
        0.5207376,
        0.90843723,
        0.46345886,
        0.56850299
      ]
    },
    "crystal-genome-source-structure-id": {
      "source-value": [
        [
          "RD_296635253471_000"
        ]
      ]
    },
    "duplicate_reference_data": []
  }
]

NOTE: The configuration you provided has a maximum force component 7.206656724922779 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 0.14169393746932835 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 14:51:34     -112.473480        7.721319
LBFGSLineSearch:    1 14:51:35     -113.530126        1.465350
LBFGSLineSearch:    2 14:51:35     -113.594236        1.249488
LBFGSLineSearch:    3 14:51:36     -113.659138        0.868002
LBFGSLineSearch:    4 14:51:36     -113.744831        0.774085
LBFGSLineSearch:    5 14:51:38     -113.835587        0.844227
LBFGSLineSearch:    6 14:51:39     -113.950559        1.214628
LBFGSLineSearch:    7 14:51:41     -114.050829        0.812519
LBFGSLineSearch:    8 14:51:43     -114.080613        0.464546
LBFGSLineSearch:    9 14:51:46     -114.120526        1.045560
LBFGSLineSearch:   10 14:51:48     -114.313987        1.900139
LBFGSLineSearch:   11 14:51:48     -114.510231        3.133508
LBFGSLineSearch:   12 14:51:49     -114.879635        3.228173
LBFGSLineSearch:   13 14:51:51     -115.207717        1.759694
LBFGSLineSearch:   14 14:51:52     -115.292585        1.190694
LBFGSLineSearch:   15 14:51:54     -115.375196        1.046144
LBFGSLineSearch:   16 14:51:59     -115.548759        0.960847
LBFGSLineSearch:   17 14:52:00     -115.606852        3.406462
LBFGSLineSearch:   18 14:52:01     -115.730305        1.239131
LBFGSLineSearch:   19 14:52:02     -115.883185        1.336846
LBFGSLineSearch:   20 14:52:02     -115.954211        1.148326
LBFGSLineSearch:   21 14:52:03     -116.015843        0.946210
LBFGSLineSearch:   22 14:52:03     -116.086998        0.529514
LBFGSLineSearch:   23 14:52:04     -116.114515        0.266160
LBFGSLineSearch:   24 14:52:04     -116.122730        0.320757
LBFGSLineSearch:   25 14:52:05     -116.128640        0.246152
LBFGSLineSearch:   26 14:52:05     -116.134015        0.231231
LBFGSLineSearch:   27 14:52:05     -116.139977        0.306372
LBFGSLineSearch:   28 14:52:06     -116.155145        0.350274
LBFGSLineSearch:   29 14:52:06     -116.165240        0.304040
LBFGSLineSearch:   30 14:52:07     -116.169434        0.187763
LBFGSLineSearch:   31 14:52:07     -116.169902        0.113344
LBFGSLineSearch:   32 14:52:08     -116.170001        0.025316
LBFGSLineSearch:   33 14:52:08     -116.170020        0.012242
LBFGSLineSearch:   34 14:52:09     -116.170022        0.002591
LBFGSLineSearch:   35 14:52:09     -116.170022        0.000186
LBFGSLineSearch:   36 14:52:10     -116.170022        0.000021
LBFGSLineSearch:   37 14:52:12     -116.170022        0.000004