element(s):
['Al', 'Fe', 'Ni']
AFLOW prototype label:
AB2C_cF16_225_a_c_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.9354']
model name:
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Fe', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]
 [0.5  0.5  0.5 ]]
spacegroup =  225
cell =  [[5.9354, 0, 0], [0, 5.9354, 0], [0, 0, 5.9354]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:12:33      -66.528640         0.858903
BFGS:    1 16:12:33      -66.560014         0.845695
BFGS:    2 16:12:33      -66.682764         0.790625
BFGS:    3 16:12:33      -66.797106         0.733899
BFGS:    4 16:12:33      -66.902940         0.677173
BFGS:    5 16:12:33      -67.000224         0.619744
BFGS:    6 16:12:33      -67.088806         0.561372
BFGS:    7 16:12:33      -67.168705         0.504127
BFGS:    8 16:12:33      -67.240087         0.447718
BFGS:    9 16:12:33      -67.303061         0.392020
BFGS:   10 16:12:33      -67.357710         0.336275
BFGS:   11 16:12:34      -67.403552         0.273328
BFGS:   12 16:12:34      -67.438914         0.194952
BFGS:   13 16:12:34      -67.461251         0.100538
BFGS:   14 16:12:34      -67.468391         0.007638
BFGS:   15 16:12:34      -67.468429         0.000454
BFGS:   16 16:12:34      -67.468429         0.000002
BFGS:   17 16:12:34      -67.468429         0.000000
Minimization converged after 17 steps.
Maximum force component: 2.5077365945060127e-30 eV/Angstrom
Maximum stress component: 5.981474888180476e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', '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 2.87656373e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [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]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 2.40461348e-49]
 [4.80922696e-49 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 1.18446742e-34 5.00000000e-01]]
cellpar =  Cell([[5.690958409827971, -2.5863152801620707e-32, 1.4911426284463402e-32], [-3.2256816478132925e-32, 5.690958409827971, 1.67853831115518e-18], [2.4787332046598765e-32, 1.678538311155164e-18, 5.690958409827971]])
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]
 [-8.41757738e-31 -3.27350231e-31 -2.11608542e-30]
 [ 2.63049293e-32 -2.71817603e-31 -1.09896149e-30]
 [-8.59294358e-31 -3.03968072e-31  1.87057275e-31]
 [ 1.16910797e-31  2.80585913e-31  2.08101219e-30]
 [-3.50732391e-32 -5.84553985e-32 -9.35286376e-32]
 [-1.25679107e-31 -2.04593895e-31  2.03424787e-30]
 [ 3.73410883e-63 -4.88102577e-31  2.22130514e-31]
 [-1.16910797e-32 -7.01464782e-32 -2.50773659e-30]
 [ 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]]
stress =  [-5.98147489e-11 -5.98147489e-11 -5.98147489e-11 -7.85495031e-27
 -2.69579781e-34  8.08199244e-51]
energy per atom =  -4.216776802939
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0