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 16:35:32      -67.958413         0.788813
BFGS:    1 16:35:32      -67.984895         0.777869
BFGS:    2 16:35:32      -68.097959         0.729157
BFGS:    3 16:35:32      -68.203391         0.675318
BFGS:    4 16:35:32      -68.300104         0.612686
BFGS:    5 16:35:32      -68.386751         0.541136
BFGS:    6 16:35:32      -68.462014         0.460950
BFGS:    7 16:35:33      -68.524690         0.373742
BFGS:    8 16:35:33      -68.573843         0.280679
BFGS:    9 16:35:33      -68.608612         0.182125
BFGS:   10 16:35:33      -68.628393         0.081666
BFGS:   11 16:35:33      -68.633392         0.000366
BFGS:   12 16:35:33      -68.633392         0.000001
BFGS:   13 16:35:33      -68.633392         0.000000
Minimization converged after 13 steps.
Maximum force component: 1.2831847362303246e-30 eV/Angstrom
Maximum stress component: 5.252560740354217e-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]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.38133343e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.22687055e-49 2.45374109e-49]
 [0.00000000e+00 5.00000000e-01 2.76266687e-34]
 [6.13435274e-50 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([[5.577016803723679, 1.866681483305937e-33, -7.683380320814909e-33], [-7.024256247857984e-34, 5.577016803723679, -8.446073471420012e-18], [-4.2848702632094116e-33, -8.446073471420012e-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]
 [ 3.43710197e-32 -4.92651283e-31  6.89210552e-31]
 [ 7.76928258e-31  1.12636696e-30  7.99842271e-31]
 [-2.32720446e-32 -7.10334408e-31 -2.74968158e-31]
 [ 5.38479309e-31  8.65362028e-31 -7.21791414e-31]
 [-1.71855099e-31 -1.28318474e-30 -4.81194276e-31]
 [-7.22686493e-31 -2.47041704e-31 -8.47818486e-31]
 [-7.33248421e-31 -3.68145844e-31  4.61323530e-31]
 [-5.67658873e-31 -9.16560526e-31  1.84386200e-31]]
stress =  [-5.25256074e-13 -5.25256074e-13 -5.25256074e-13  1.61343615e-30
  0.00000000e+00  1.82254487e-62]
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