element(s):
['C']
AFLOW prototype label:
A_hP12_194_bc2f
Parameter names:
['a', 'c/a', 'z3', 'z4']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4678', '13.950077', '0.86916696', '0.13083843']
model name:
Sim_LAMMPS_MEAM_LiyanageKimHouze_2014_FeC__SM_652425777808_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C', 'C', 'C']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]
 [0.33333333 0.66666667 0.86916696]
 [0.33333333 0.66666667 0.13083843]]
spacegroup =  194
cell =  [[2.4678, 0, 0], [-1.2339, 2.1371774914592, 0], [0, 0, 34.426]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:52:50      -87.965239         1.548615
BFGS:    1 10:52:51      -88.031026         1.425466
BFGS:    2 10:52:51      -88.159798         1.153546
BFGS:    3 10:52:51      -88.261928         0.890202
BFGS:    4 10:52:51      -88.337991         0.635357
BFGS:    5 10:52:51      -88.389176         0.388627
BFGS:    6 10:52:52      -88.416018         0.149952
BFGS:    7 10:52:52      -88.420903         0.061791
BFGS:    8 10:52:52      -88.421015         0.012429
BFGS:    9 10:52:52      -88.421020         0.002332
BFGS:   10 10:52:52      -88.421020         0.002331
BFGS:   11 10:52:52      -88.421035         0.013341
BFGS:   12 10:52:52      -88.421059         0.024678
BFGS:   13 10:52:53      -88.421123         0.041971
BFGS:   14 10:52:53      -88.421231         0.052963
BFGS:   15 10:52:53      -88.421343         0.046152
BFGS:   16 10:52:53      -88.421429         0.021345
BFGS:   17 10:52:53      -88.421443         0.004261
BFGS:   18 10:52:54      -88.421444         0.000781
BFGS:   19 10:52:54      -88.421444         0.000093
BFGS:   20 10:52:54      -88.421444         0.000018
BFGS:   21 10:52:54      -88.421444         0.000001
BFGS:   22 10:52:54      -88.421444         0.000000