element(s):
['Cr', 'Ni']
AFLOW prototype label:
AB3_cF16_225_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.7577']
model name:
EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Ni', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.7577, 0, 0], [0, 5.7577, 0], [0, 0, 5.7577]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 13:55:42      -67.958413        0.7888
BFGS:    1 13:55:42      -67.984895        0.7779
BFGS:    2 13:55:42      -68.097959        0.7292
BFGS:    3 13:55:42      -68.203391        0.6753
BFGS:    4 13:55:42      -68.300104        0.6127
BFGS:    5 13:55:42      -68.386751        0.5411
BFGS:    6 13:55:42      -68.462014        0.4609
BFGS:    7 13:55:42      -68.524690        0.3737
BFGS:    8 13:55:42      -68.573843        0.2807
BFGS:    9 13:55:42      -68.608612        0.1821
BFGS:   10 13:55:42      -68.628393        0.0817
BFGS:   11 13:55:42      -68.633392        0.0004
BFGS:   12 13:55:42      -68.633392        0.0000
BFGS:   13 13:55:43      -68.633392        0.0000
Minimization converged after 13 steps.
Maximum force component: 2.2455732884030678e-30 eV/Angstrom
Maximum stress component: 5.251883168959026e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [4.90748219e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.38133343e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.14400030e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 1.22687055e-49]
 [2.45374109e-49 5.00000000e-01 1.38133343e-34]
 [8.83586142e-67 2.07200015e-34 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([[5.577016803723679, 7.80306383497978e-33, -6.759016370638379e-33], [-2.3782694979348518e-32, 5.577016803723679, -4.3779655554447405e-18], [2.775256528198789e-32, -4.3779655554447775e-18, 5.577016803723679]])
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]
 [ 2.29140131e-32  1.90186309e-30 -4.88354905e-31]
 [ 8.67152185e-31 -1.54383164e-30 -1.90078900e-30]
 [ 1.17792349e-31  1.64980895e-30  2.29140131e-31]
 [ 7.56162434e-31 -1.23306033e-30  8.47818486e-31]
 [-2.29140131e-31  2.17683125e-30  2.10808921e-30]
 [ 6.06147254e-31 -1.61758612e-30  7.10334408e-31]
 [ 3.43710197e-31 -1.91511026e-30 -6.74173231e-31]
 [-1.99781552e-31  2.24557329e-30 -5.67121825e-31]]
stress =  [-5.25188317e-13 -5.25188317e-13 -5.25188317e-13  2.03795639e-28
  1.15585499e-34  4.89270321e-51]
energy per atom =  -4.289586997276261
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0