element(s):
['Fe', 'Ni']
AFLOW prototype label:
AB2_cF24_227_a_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.6153']
model name:
EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[6.6153, 0, 0], [0, 6.6153, 0], [0, 0, 6.6153]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:18:37      -98.277363        0.8405
BFGS:    1 17:18:37      -98.307278        0.8205
BFGS:    2 17:18:37      -98.424042        0.7359
BFGS:    3 17:18:37      -98.527930        0.6488
BFGS:    4 17:18:37      -98.618568        0.5593
BFGS:    5 17:18:37      -98.695585        0.4672
BFGS:    6 17:18:37      -98.758608        0.3727
BFGS:    7 17:18:37      -98.807262        0.2756
BFGS:    8 17:18:37      -98.841174        0.1761
BFGS:    9 17:18:37      -98.859970        0.0741
BFGS:   10 17:18:37      -98.863932        0.0016
BFGS:   11 17:18:37      -98.863934        0.0000
BFGS:   12 17:18:38      -98.863934        0.0000
Minimization converged after 12 steps.
Maximum force component: 1.333654344600182e-31 eV/Angstrom
Maximum stress component: 1.492752822434164e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 5.44872932e-33 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [6.25000000e-01 6.25000000e-01 6.25000000e-01]
 [3.75000000e-01 8.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 3.75000000e-01]
 [1.25000000e-01 3.75000000e-01 8.75000000e-01]
 [8.75000000e-01 3.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 8.75000000e-01]
 [1.25000000e-01 8.75000000e-01 3.75000000e-01]
 [6.25000000e-01 1.25000000e-01 1.25000000e-01]
 [3.75000000e-01 3.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 8.75000000e-01]
 [8.75000000e-01 8.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 3.75000000e-01]
 [1.25000000e-01 6.25000000e-01 1.25000000e-01]
 [6.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 1.25000000e-01 6.25000000e-01]]
cellpar =  Cell([[6.49193368484892, -5.3736978447250646e-33, -3.120939104276285e-32], [-5.624707079218619e-33, 6.49193368484892, -7.894072565021936e-18], [-9.860351276218269e-33, -7.894072565021935e-18, 6.49193368484892]])
forces =  [[ 1.33365434e-32  6.66827172e-33  6.66827172e-33]
 [ 2.33389510e-32  6.08137229e-51 -5.00120379e-33]
 [ 1.66706793e-32  5.00120379e-33 -3.33413586e-33]
 [-2.00048152e-32 -1.50036114e-32 -3.66754945e-32]
 [-2.00048152e-32 -3.66754945e-32 -2.00048152e-32]
 [-1.66706793e-33 -6.66827172e-33 -2.00048152e-32]
 [ 2.66730869e-32  3.24339856e-50 -2.66730869e-32]
 [-2.66730869e-32  6.66827172e-33 -3.33413586e-32]
 [ 1.06692348e-31 -1.10026483e-31 -3.33413586e-32]
 [ 4.66779021e-32  1.33365434e-32  2.66730869e-32]
 [-5.33461738e-32 -2.66730869e-32  2.66730869e-32]
 [-3.33413586e-32  2.66730869e-32 -2.00048152e-32]
 [ 8.56076096e-66 -8.00192607e-32  4.00096303e-32]
 [-3.33413586e-32 -4.00096303e-32 -4.66779021e-32]
 [ 3.46649337e-65 -4.00096303e-32  4.86509784e-50]
 [ 9.33558041e-32 -5.33461738e-32  6.48679711e-50]
 [ 3.66754945e-32 -6.00144455e-32  2.66730869e-32]
 [-2.66730869e-32 -9.00216683e-32 -6.66827172e-33]
 [-5.33461738e-32  1.33365434e-32 -8.00192607e-32]
 [-2.33389510e-32  2.33389510e-32  4.00096303e-32]
 [ 1.06692348e-31 -7.33509890e-32 -2.66730869e-32]
 [ 2.66730869e-32  3.24339856e-50 -2.66730869e-32]
 [-4.66779021e-32  6.66827172e-33  6.00144455e-32]
 [ 1.33365434e-31 -1.33365434e-31  1.62169928e-49]]
stress =  [-1.49275282e-10 -1.49275282e-10 -1.49275282e-10 -2.98888444e-26
 -2.43719941e-35  6.83780062e-52]
energy per atom =  -4.09502909384029
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0