element(s):
['Fe', 'Ni']
AFLOW prototype label:
A2B_cF24_227_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:
['6.7867']
model name:
EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.125 0.125 0.125]
 [0.5   0.5   0.5  ]]
spacegroup =  227
cell =  [[6.7867, 0, 0], [0, 6.7867, 0], [0, 0, 6.7867]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:51:17      -93.635045        0.8902
BFGS:    1 14:51:17      -93.668905        0.8850
BFGS:    2 14:51:17      -93.800003        0.8624
BFGS:    3 14:51:17      -93.927464        0.8365
BFGS:    4 14:51:17      -94.050771        0.8070
BFGS:    5 14:51:17      -94.169379        0.7738
BFGS:    6 14:51:17      -94.282738        0.7370
BFGS:    7 14:51:17      -94.390301        0.6966
BFGS:    8 14:51:17      -94.491524        0.6525
BFGS:    9 14:51:17      -94.585867        0.6048
BFGS:   10 14:51:17      -94.672790        0.5536
BFGS:   11 14:51:17      -94.751781        0.4994
BFGS:   12 14:51:17      -94.822583        0.4445
BFGS:   13 14:51:17      -94.885076        0.3886
BFGS:   14 14:51:17      -94.939127        0.3319
BFGS:   15 14:51:18      -94.984589        0.2741
BFGS:   16 14:51:18      -95.021289        0.2150
BFGS:   17 14:51:18      -95.049017        0.1543
BFGS:   18 14:51:18      -95.067465        0.0912
BFGS:   19 14:51:18      -95.076169        0.0241
BFGS:   20 14:51:18      -95.076787        0.0012
BFGS:   21 14:51:18      -95.076788        0.0000
BFGS:   22 14:51:18      -95.076788        0.0000
Minimization converged after 22 steps.
Maximum force component: 3.752545564489709e-31 eV/Angstrom
Maximum stress component: 7.920305193245299e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[1.25000000e-01 1.25000000e-01 1.25000000e-01]
 [8.75000000e-01 3.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 8.75000000e-01]
 [6.25000000e-01 8.75000000e-01 3.75000000e-01]
 [3.75000000e-01 8.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 3.75000000e-01]
 [6.25000000e-01 3.75000000e-01 8.75000000e-01]
 [1.25000000e-01 6.25000000e-01 6.25000000e-01]
 [8.75000000e-01 8.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 3.75000000e-01]
 [3.75000000e-01 3.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 8.75000000e-01]
 [6.25000000e-01 1.25000000e-01 6.25000000e-01]
 [1.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 6.25000000e-01 1.25000000e-01]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.63588051e-17 6.54352203e-17]
 [6.54352203e-17 1.63588051e-17 5.00000000e-01]
 [6.54352203e-17 5.00000000e-01 6.54352203e-17]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[6.523771388172562, 1.0617258619811187e-32, 2.410347213460365e-33], [8.662384528666e-34, 6.523771388172562, -1.690477889413585e-17], [-7.435573309482047e-33, -1.6904778894135824e-17, 6.523771388172562]])
forces =  [[ 8.04116907e-32  1.34019484e-31 -2.68038969e-32]
 [-1.60823381e-31  1.34019484e-31  5.36077938e-32]
 [-1.60823381e-31 -1.38911658e-49  5.36077938e-32]
 [-1.60823381e-31  1.07215588e-31  1.07215588e-31]
 [ 2.68038969e-31 -5.36077938e-32 -5.36077938e-32]
 [ 8.04116907e-32  2.41235072e-31  1.07215588e-31]
 [ 5.36077938e-32 -5.36077938e-32  1.07215588e-31]
 [ 1.30800299e-64  2.94842866e-31 -8.04116907e-32]
 [-8.04116907e-32 -1.87627278e-31 -2.41235072e-31]
 [-2.68038969e-32  2.14431175e-31  1.60823381e-31]
 [ 3.21646763e-31  2.68038969e-31 -1.60823381e-31]
 [-5.36077938e-32  1.87627278e-31  1.07215588e-31]
 [ 5.36077938e-32  1.87627278e-31 -2.68038969e-32]
 [-8.04116907e-32  3.75254556e-31  2.41235072e-31]
 [ 2.14431175e-31  8.04116907e-32 -2.41235072e-31]
 [ 1.07215588e-31  1.60823381e-31  5.36077938e-32]
 [-4.18810889e-34  4.60691978e-33  3.35048711e-33]
 [ 3.24578439e-33 -4.18810889e-34  1.00514613e-32]
 [-2.09405444e-33  1.25643267e-33 -3.35048711e-33]
 [ 7.11978511e-33 -1.73577482e-33 -5.02573067e-33]
 [-6.70097422e-33  1.25643267e-32 -6.70097422e-33]
 [-7.53859600e-33 -3.63841960e-33 -1.25643267e-33]
 [-1.25643267e-33  1.08524733e-51 -4.18810889e-34]
 [-8.37621778e-34 -8.37621778e-34  1.00514613e-32]]
stress =  [ 7.92030519e-10  7.92030519e-10  7.92030519e-10 -1.10692520e-25
  9.65387647e-35 -7.03351435e-51]
energy per atom =  -3.961532853279652
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0