element(s):
['C', 'Fe']
AFLOW prototype label:
AB4_cP5_215_a_e
Parameter names:
['a', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.088', '0.26455447']
model name:
EAM_Dynamo_HepburnAckland_2008_FeC__MO_143977152728_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'Fe']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.26455447 0.26455447 0.26455447]]
spacegroup =  215
cell =  [[4.088, 0, 0], [0, 4.088, 0], [0, 0, 4.088]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:50:16      -18.683749         2.211062
BFGS:    1 12:50:17      -19.027786         2.181891
BFGS:    2 12:50:17      -19.534167         2.790900
BFGS:    3 12:50:17      -19.815683         6.753627
BFGS:    4 12:50:17      -20.223088         6.497383
BFGS:    5 12:50:17      -20.575918         4.958390
BFGS:    6 12:50:17      -20.761975         1.533649
BFGS:    7 12:50:18      -20.782326         1.361438
BFGS:    8 12:50:18      -20.881692         0.297291
BFGS:    9 12:50:18      -20.885719         0.035198
BFGS:   10 12:50:18      -20.885811         0.001240
BFGS:   11 12:50:18      -20.885811         0.000005
BFGS:   12 12:50:18      -20.885811         0.000000
BFGS:   13 12:50:19      -20.885811         0.000000
Minimization converged after 13 steps.
Maximum force component: 2.2418777755441393e-10 eV/Angstrom
Maximum stress component: 2.722256751024636e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 6.68310832e-86 0.00000000e+00]
 [2.82001347e-01 2.82001347e-01 2.82001347e-01]
 [7.17998653e-01 7.17998653e-01 2.82001347e-01]
 [7.17998653e-01 2.82001347e-01 7.17998653e-01]
 [2.82001347e-01 7.17998653e-01 7.17998653e-01]]
cellpar =  Cell([[3.8511702503956995, -3.6117569156814595e-33, 1.792542202797086e-34], [6.975327570208882e-33, 3.8511702503956995, -3.940401451958835e-18], [-3.5703929103048306e-34, -3.940401451958833e-18, 3.8511702503956995]])
forces =  [[-6.32924510e-32 -6.32924510e-32 -6.32924510e-32]
 [ 2.24187778e-10  2.24187778e-10  2.24187778e-10]
 [-2.24187778e-10 -2.24187778e-10  2.24187778e-10]
 [-2.24187778e-10  2.24187778e-10 -2.24187778e-10]
 [ 2.24187778e-10 -2.24187778e-10 -2.24187778e-10]]
stress =  [-2.72225675e-11 -2.72225675e-11 -2.72225675e-11 -8.39895418e-30
 -5.54043373e-34 -8.32963172e-51]
energy per atom =  -4.177162292511435
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0