element(s):
['Al', 'Cr', 'Fe']
AFLOW prototype label:
ABC2_cF16_225_a_b_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.2014']
model name:
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Cr', 'Fe']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[6.2014, 0, 0], [0, 6.2014, 0], [0, 0, 6.2014]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 11:08:17      -63.330374        1.5459
BFGS:    1 11:08:17      -63.431935        1.5197
BFGS:    2 11:08:17      -63.655360        1.4589
BFGS:    3 11:08:17      -63.869491        1.3958
BFGS:    4 11:08:17      -64.073975        1.3302
BFGS:    5 11:08:17      -64.268442        1.2622
BFGS:    6 11:08:17      -64.452516        1.1920
BFGS:    7 11:08:17      -64.626128        1.1232
BFGS:    8 11:08:17      -64.789579        1.0564
BFGS:    9 11:08:17      -64.943136        0.9913
BFGS:   10 11:08:17      -65.087037        0.9277
BFGS:   11 11:08:17      -65.221535        0.8659
BFGS:   12 11:08:17      -65.346838        0.8049
BFGS:   13 11:08:17      -65.463016        0.7441
BFGS:   14 11:08:17      -65.570058        0.6830
BFGS:   15 11:08:17      -65.667876        0.6210
BFGS:   16 11:08:17      -65.756298        0.5577
BFGS:   17 11:08:17      -65.835095        0.4929
BFGS:   18 11:08:17      -65.904185        0.4283
BFGS:   19 11:08:17      -65.963700        0.3657
BFGS:   20 11:08:17      -66.014021        0.3056
BFGS:   21 11:08:18      -66.055461        0.2472
BFGS:   22 11:08:18      -66.088255        0.1904
BFGS:   23 11:08:18      -66.112646        0.1351
BFGS:   24 11:08:18      -66.128832        0.0809
BFGS:   25 11:08:18      -66.136597        0.0207
BFGS:   26 11:08:18      -66.137076        0.0025
BFGS:   27 11:08:18      -66.137082        0.0001
BFGS:   28 11:08:18      -66.137082        0.0000
BFGS:   29 11:08:18      -66.137082        0.0000
Minimization converged after 29 steps.
Maximum force component: 1.6926215272549403e-30 eV/Angstrom
Maximum stress component: 1.3772792177923342e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Cr', 'Cr', 'Cr', 'Cr', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.38557787e-34]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.721740519957193, -1.0401515247622562e-32, -8.955229132947892e-32], [-2.1986411338501068e-32, 5.721740519957193, 3.2929085957469654e-17], [2.155759679598345e-32, 3.292908595746951e-17, 5.721740519957193]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.17366536e-31 -4.34909698e-31 -1.69262153e-30]
 [-2.55656377e-31  4.11401066e-31 -8.19863552e-31]
 [-1.46928952e-31 -3.76138117e-31  1.49279815e-30]
 [-1.99823375e-31  3.61445222e-31  2.35086323e-32]
 [-2.23332007e-31  1.41051794e-31  1.35762352e-30]
 [-4.67234067e-31  2.67410693e-31  1.65735858e-30]
 [-5.52452860e-31  5.87715808e-32 -1.28122046e-30]
 [-1.85130480e-31 -2.35086323e-32 -5.81838650e-31]]
stress =  [-1.37727922e-11 -1.37727922e-11 -1.37727922e-11  2.87386558e-27
  1.56874697e-34 -3.53948531e-50]
energy per atom =  -4.133567648774386
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0