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_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
==== 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 13:01:30      -99.138631         0.326537
BFGS:    1 13:01:31      -99.143134         0.317104
BFGS:    2 13:01:31      -99.183214         0.217865
BFGS:    3 13:01:31      -99.208665         0.122042
BFGS:    4 13:01:31      -99.219998         0.029634
BFGS:    5 13:01:31      -99.220727         0.000723
BFGS:    6 13:01:32      -99.220727         0.000004
BFGS:    7 13:01:32      -99.220727         0.000000
Minimization converged after 7 steps.
Maximum force component: 9.649239701882087e-31 eV/Angstrom
Maximum stress component: 5.6500166763008714e-11 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 8.99860375e-34 6.80895261e-34]
 [1.41295156e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 8.38308201e-34]
 [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([[6.662462365868603, 9.936569868387567e-35, 3.5629920619832074e-34], [4.6134637087768595e-34, 6.662462365868603, -2.5871230881244913e-18], [-1.0933495256479376e-34, -2.5871230881244913e-18, 6.662462365868603]])
forces =  [[-7.21768262e-34 -2.78014442e-33  4.27714526e-34]
 [ 2.88707305e-33 -1.06928631e-33 -1.60392947e-33]
 [ 1.60392947e-33  3.20785894e-33  1.06928631e-34]
 [-1.28314358e-33 -4.27714526e-34  2.43262637e-33]
 [-1.06928631e-33  9.62357683e-34  2.13857263e-34]
 [-1.28314358e-33  5.13257431e-33  5.34643157e-33]
 [-3.84943073e-33 -4.27714526e-34 -3.20785894e-33]
 [ 2.13857263e-34 -2.13857263e-33  1.17621495e-33]
 [-2.46363567e-31 -2.46363567e-31 -2.18989837e-31]
 [ 4.10605945e-31  7.11716971e-31  5.47474593e-32]
 [-1.09494919e-31  8.21211890e-32  1.36868648e-31]
 [-8.83106685e-66 -8.21211890e-32  1.91616108e-31]
 [-1.91616108e-31 -9.58080538e-31  2.73737297e-32]
 [-8.21211890e-32 -5.47474593e-32 -2.73737297e-32]
 [ 7.01451822e-32 -1.06073202e-31 -1.26603500e-31]
 [-1.36868648e-31 -5.47474593e-32 -2.73737297e-32]
 [-1.36868648e-32  8.48585619e-31  8.21211890e-32]
 [ 1.09494919e-31  1.09494919e-31  8.21211890e-32]
 [ 3.42171621e-32 -9.64923970e-31 -1.28314358e-32]
 [-1.64242378e-31  2.46363567e-31 -8.21211890e-32]
 [-8.21211890e-32 -1.36868648e-31  5.47474593e-32]
 [-8.21211890e-32 -5.47474593e-32 -3.83232215e-31]
 [ 2.73737297e-32  2.73737297e-32  2.18989837e-31]
 [-1.57398945e-31 -1.23181783e-31 -1.84772675e-31]]
stress =  [-5.65001668e-11 -5.65001668e-11 -5.65001668e-11 -9.72518850e-27
 -1.55800190e-62 -1.66798675e-61]
energy per atom =  -4.134196964214699
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0