element(s):
['C', 'Fe']
AFLOW prototype label:
AB2_hP3_191_a_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9831', '0.6320956']
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.        ]
 [0.33333333 0.66666667 0.        ]]
spacegroup =  191
cell =  [[3.9831, 0, 0], [-1.99155, 3.4494657858138, 0], [0, 0, 2.5177]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:13:10       -9.032378         2.644230
BFGS:    1 15:13:10       -9.303633         2.935878
BFGS:    2 15:13:10       -9.637411         2.618531
BFGS:    3 15:13:10       -9.875201         1.443098
BFGS:    4 15:13:10       -9.941277         0.399823
BFGS:    5 15:13:10       -9.946665         0.435975
BFGS:    6 15:13:10       -9.955440         0.807889
BFGS:    7 15:13:10       -9.982004         2.732213
BFGS:    8 15:13:10      -10.045587         4.485366
BFGS:    9 15:13:10      -10.198805         5.237045
BFGS:   10 15:13:10      -10.391062         3.753630
BFGS:   11 15:13:10      -10.442304         0.912833
BFGS:   12 15:13:10      -10.454038         1.259322
BFGS:   13 15:13:10      -10.457796         0.605487
BFGS:   14 15:13:10      -10.458377         0.466325
BFGS:   15 15:13:10      -10.459339         0.534847
BFGS:   16 15:13:10      -10.460829         0.623818
BFGS:   17 15:13:10      -10.468512         1.004364
BFGS:   18 15:13:10      -10.504461         2.403078
BFGS:   19 15:13:10      -10.542416         3.842438
BFGS:   20 15:13:10      -10.576721         4.902828
BFGS:   21 15:13:10      -10.600684         5.860962
BFGS:   22 15:13:10      -10.640353         5.286111
BFGS:   23 15:13:10      -10.970601         0.960965
BFGS:   24 15:13:10      -10.980913         0.216250
BFGS:   25 15:13:10      -10.981503         0.009866
BFGS:   26 15:13:10      -10.981505         0.000571
BFGS:   27 15:13:10      -10.981505         0.000010
BFGS:   28 15:13:10      -10.981505         0.000000
BFGS:   29 15:13:10      -10.981505         0.000000
Minimization converged after 29 steps.
Maximum force component: 1.9096777033659776e-30 eV/Angstrom
Maximum stress component: 3.897358409971183e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['C', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.33333333e-01 6.66666667e-01 8.77702449e-37]
 [6.66666667e-01 3.33333333e-01 1.53770380e-34]]
cellpar =  Cell([[4.14994986328174, 1.8350043667623157e-17, 1.586818453219434e-36], [-2.07497493164087, 3.5939620060337463, 2.053586092370233e-36], [-1.9780759658119271e-35, 9.402464207281245e-36, 2.102221301107195]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 1.90967770e-30 -9.45045374e-31 -5.39830794e-34]
 [-1.77327215e-30  1.18130672e-30  5.39830794e-34]]
stress =  [ 3.89735841e-11  3.89735841e-11  2.95044133e-11 -4.75833861e-34
 -1.17738346e-34 -3.35956688e-27]
energy per atom =  -3.66050164888818
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0