element(s):
['C']
AFLOW prototype label:
A_hP8_194_ef
Parameter names:
['a', 'c/a', 'z1', 'z2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.5188', '3.2978799', '0.092975226', '0.65554043']
model name:
MEAM_LAMMPS_LiyanageKimHouze_2014_FeC__MO_075279800195_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'C']
representative atom coordinates =  [[0.         0.         0.09297523]
 [0.33333333 0.66666667 0.65554043]]
spacegroup =  194
cell =  [[2.5188, 0, 0], [-1.2594, 2.1813447870522, 0], [0, 0, 8.3067]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 21:10:38      -58.879422         2.268720
BFGS:    1 21:10:38      -58.754976         5.078345
BFGS:    2 21:10:38      -58.947577         0.534174
BFGS:    3 21:10:38      -58.950358         0.497703
BFGS:    4 21:10:38      -58.953727         0.215725
BFGS:    5 21:10:38      -58.954924         0.161706
BFGS:    6 21:10:38      -58.958733         0.132595
BFGS:    7 21:10:38      -58.959815         0.097826
BFGS:    8 21:10:38      -58.959963         0.023105
BFGS:    9 21:10:38      -58.959975         0.011540
BFGS:   10 21:10:38      -58.959981         0.009837
BFGS:   11 21:10:38      -58.959992         0.016604
BFGS:   12 21:10:38      -58.959998         0.011800
BFGS:   13 21:10:38      -58.960000         0.003312
BFGS:   14 21:10:38      -58.960000         0.000299
BFGS:   15 21:10:38      -58.960000         0.000010
BFGS:   16 21:10:38      -58.960000         0.000001
BFGS:   17 21:10:38      -58.960000         0.000000
BFGS:   18 21:10:38      -58.960000         0.000000
Minimization converged after 18 steps.
Maximum force component: 1.0885661174547814e-09 eV/Angstrom
Maximum stress component: 5.0300689609953646e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C']
basis =  [[0.00000000e+00 1.50306544e-35 9.37500000e-02]
 [0.00000000e+00 0.00000000e+00 5.93750000e-01]
 [2.32304278e-35 0.00000000e+00 9.06250000e-01]
 [0.00000000e+00 5.26095941e-35 4.06250000e-01]
 [3.33333333e-01 6.66666667e-01 6.56250000e-01]
 [6.66666667e-01 3.33333333e-01 1.56250000e-01]
 [6.66666667e-01 3.33333333e-01 3.43750000e-01]
 [3.33333333e-01 6.66666667e-01 8.43750000e-01]]
cellpar =  Cell([[2.522249882738157, -1.6343495652445706e-19, 7.744223382806164e-37], [-1.2611249413690786, 2.184332473143566, 1.778274266063665e-36], [3.99528193491979e-36, 1.0439949444687275e-35, 8.237633621985971]])
forces =  [[ 1.65808694e-31 -2.87189082e-31  1.31104712e-10]
 [-4.66336951e-31  5.20530211e-31  1.31104712e-10]
 [-6.63234775e-31 -1.66112334e-46 -1.31104712e-10]
 [ 3.31617388e-31 -1.66176798e-46 -1.31104712e-10]
 [ 4.97426081e-31  1.37955999e-45  1.08856612e-09]
 [ 5.80330428e-31 -4.30783623e-31  1.08856612e-09]
 [ 6.63234775e-31 -5.74378164e-31 -1.08856612e-09]
 [ 8.29043469e-32  4.30783623e-31 -1.08856612e-09]]
stress =  [-4.16899683e-11 -4.16899683e-11  5.03006896e-11  5.48010945e-33
  9.49182799e-33 -1.03089961e-26]
energy per atom =  -7.369999999987206
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0