element(s):
['Fe', 'Ni']
AFLOW prototype label:
A3B_cF16_225_ac_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.8545']
model name:
EAM_Dynamo_BonnyPasianotMalerba_2009_FeNi__MO_267721408934_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Fe', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]
 [0.5  0.5  0.5 ]]
spacegroup =  225
cell =  [[5.8545, 0, 0], [0, 5.8545, 0], [0, 0, 5.8545]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:24:37      -64.677061         1.307728
BFGS:    1 10:24:37      -64.749616         1.281342
BFGS:    2 10:24:37      -64.936431         1.209144
BFGS:    3 10:24:38      -65.112243         1.134627
BFGS:    4 10:24:38      -65.276704         1.057810
BFGS:    5 10:24:39      -65.429470         0.978705
BFGS:    6 10:24:39      -65.570116         0.895470
BFGS:    7 10:24:39      -65.697777         0.805580
BFGS:    8 10:24:40      -65.811457         0.709052
BFGS:    9 10:24:40      -65.910163         0.605911
BFGS:   10 10:24:40      -65.992904         0.496205
BFGS:   11 10:24:41      -66.058697         0.379966
BFGS:   12 10:24:41      -66.106591         0.257637
BFGS:   13 10:24:41      -66.135696         0.129463
BFGS:   14 10:24:42      -66.145139         0.004523
BFGS:   15 10:24:42      -66.145150         0.000092
BFGS:   16 10:24:42      -66.145150         0.000000
BFGS:   17 10:24:42      -66.145150         0.000000
Minimization converged after 17 steps.
Maximum force component: 4.909926453304997e-30 eV/Angstrom
Maximum stress component: 1.7899809469946877e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', '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 1.37310674e-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 9.14672830e-50]
 [1.82934566e-49 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[5.61043039153446, 3.834627119839062e-34, -1.1956326301113386e-33], [2.7252105703628876e-33, 5.61043039153446, -5.701506767914287e-18], [1.0586895642729034e-33, -5.70150676791429e-18, 5.61043039153446]])
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]
 [-8.06795427e-31 -5.99333745e-31 -2.98226167e-31]
 [ 1.34850093e-30  1.43206188e-30 -4.15355574e-30]
 [-8.50016610e-31 -7.83744129e-31  2.37428368e-30]
 [ 1.06035970e-30  1.25773644e-30  1.17561619e-30]
 [-5.99333745e-31 -6.45436341e-31  4.90992645e-30]
 [-8.06795427e-32  7.73659186e-31  1.61359085e-31]
 [ 2.76615575e-31  6.88297348e-31 -2.44343758e-30]
 [ 2.07461681e-31 -1.15256490e-30 -1.84986666e-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 =  [-1.78998095e-14 -1.78998095e-14 -1.78998095e-14  3.97700596e-31
 -5.87380280e-34  6.24206714e-51]
energy per atom =  -4.124958847767532
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0