element(s):
['Fe', '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:
['5.6652']
model name:
EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.6652, 0, 0], [0, 5.6652, 0], [0, 0, 5.6652]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:59:25      -69.102846         0.489059
BFGS:    1 15:59:25      -69.113007         0.480524
BFGS:    2 15:59:25      -69.180435         0.418082
BFGS:    3 15:59:25      -69.238320         0.353433
BFGS:    4 15:59:25      -69.286413         0.287740
BFGS:    5 15:59:25      -69.324656         0.222286
BFGS:    6 15:59:25      -69.353160         0.158105
BFGS:    7 15:59:25      -69.372228         0.096746
BFGS:    8 15:59:25      -69.382406         0.039770
BFGS:    9 15:59:25      -69.384599         0.002408
BFGS:   10 15:59:25      -69.384607         0.000069
BFGS:   11 15:59:25      -69.384607         0.000000
BFGS:   12 15:59:25      -69.384607         0.000000
Minimization converged after 12 steps.
Maximum force component: 1.1351425875964264e-30 eV/Angstrom
Maximum stress component: 2.331944126654245e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [3.71484536e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.39418135e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.23828179e-49 1.23828179e-49]
 [2.47656357e-49 5.00000000e-01 1.39418135e-34]
 [1.39575331e-67 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([[5.5256224608431435, 1.0502460663393023e-32, 1.0094153813981806e-32], [1.1063705338272367e-32, 5.5256224608431435, 5.176936559524927e-18], [-1.086418769026604e-32, 5.17693655952495e-18, 5.5256224608431435]])
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]
 [ 1.36217111e-31  2.95137073e-31 -8.91086931e-31]
 [ 6.24328423e-32 -8.17302663e-31 -1.36217111e-31]
 [ 4.82435600e-32  4.76759887e-31  3.40542776e-31]
 [ 6.81085553e-32 -1.11811545e-30 -2.72434221e-31]
 [ 3.85948480e-31  1.06703403e-30  1.58919962e-31]
 [-6.38517706e-31 -5.43449514e-31  8.40005515e-31]
 [-4.54057035e-32 -5.29260231e-31  6.24328423e-32]
 [ 7.46356251e-31  1.13514259e-30 -1.02446619e-30]]
stress =  [ 2.33194413e-13  2.33194413e-13  2.33194413e-13 -2.90505031e-30
 -1.17745642e-34  1.00603588e-51]
energy per atom =  -4.336537935983341
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0