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 13:18:47      -69.102846         0.489059
BFGS:    1 13:18:47      -69.113007         0.480524
BFGS:    2 13:18:48      -69.180435         0.418082
BFGS:    3 13:18:48      -69.238320         0.353433
BFGS:    4 13:18:48      -69.286413         0.287740
BFGS:    5 13:18:48      -69.324656         0.222286
BFGS:    6 13:18:48      -69.353160         0.158105
BFGS:    7 13:18:48      -69.372228         0.096746
BFGS:    8 13:18:48      -69.382406         0.039770
BFGS:    9 13:18:48      -69.384599         0.002408
BFGS:   10 13:18:48      -69.384607         0.000069
BFGS:   11 13:18:49      -69.384607         0.000000
BFGS:   12 13:18:49      -69.384607         0.000000
Minimization converged after 12 steps.
Maximum force component: 1.3905496698056221e-30 eV/Angstrom
Maximum stress component: 2.3301426827931805e-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]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.39418135e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.09127202e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.86963059e-51 0.00000000e+00]
 [4.95312715e-49 5.00000000e-01 1.39418135e-34]
 [1.23828179e-49 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([[5.525622460843143, -6.659376833780737e-35, -3.6675844194128136e-33], [-4.009326629129301e-32, 5.525622460843143, -3.516930402323844e-18], [6.493834578712486e-33, -3.516930402323843e-18, 5.525622460843143]])
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]
 [ 2.04325666e-31  1.11243974e-30  1.39054967e-30]
 [ 3.54732059e-31 -1.27703541e-30  8.68384080e-31]
 [ 1.36217111e-31  1.24865685e-30 -1.13514259e-31]
 [ 1.13514259e-31 -7.74734816e-31  1.13514259e-31]
 [-7.03788404e-31  9.53519774e-31 -1.15784544e-30]
 [-4.45543466e-31 -4.14327044e-31 -7.26491256e-31]
 [-2.27028518e-32 -6.30004136e-31  8.22978376e-32]
 [-4.42705609e-31  6.58382701e-31 -3.09326355e-31]]
stress =  [ 2.33014268e-13  2.33014268e-13  2.33014268e-13 -4.12616239e-30
 -8.41040299e-36 -1.85916553e-53]
energy per atom =  -4.336537935983339
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0