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 11:30:29      -64.677061         1.307728
BFGS:    1 11:30:29      -64.749616         1.281342
BFGS:    2 11:30:29      -64.936431         1.209144
BFGS:    3 11:30:29      -65.112243         1.134627
BFGS:    4 11:30:29      -65.276704         1.057810
BFGS:    5 11:30:29      -65.429470         0.978705
BFGS:    6 11:30:29      -65.570116         0.895470
BFGS:    7 11:30:29      -65.697777         0.805580
BFGS:    8 11:30:29      -65.811457         0.709052
BFGS:    9 11:30:29      -65.910163         0.605911
BFGS:   10 11:30:29      -65.992904         0.496205
BFGS:   11 11:30:29      -66.058697         0.379966
BFGS:   12 11:30:29      -66.106591         0.257637
BFGS:   13 11:30:29      -66.135696         0.129463
BFGS:   14 11:30:29      -66.145139         0.004523
BFGS:   15 11:30:29      -66.145150         0.000092
BFGS:   16 11:30:29      -66.145150         0.000000
BFGS:   17 11:30:29      -66.145150         0.000000
Minimization converged after 17 steps.
Maximum force component: 3.872618047677181e-30 eV/Angstrom
Maximum stress component: 1.7904819171989965e-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 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.74621348e-34]
 [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 0.00000000e+00]
 [2.43912755e-49 5.00000000e-01 1.37310674e-34]
 [0.00000000e+00 1.37310674e-34 5.00000000e-01]]
cellpar =  Cell([[5.61043039153446, 6.401868385734757e-33, 1.4459611791776972e-32], [8.111123908029095e-33, 5.61043039153446, -7.113938911210044e-18], [7.062826082469005e-32, -7.113938911210107e-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]
 [ 9.22051916e-32  1.49833436e-30 -1.24116832e-30]
 [-8.90356381e-31 -1.20154890e-30 -1.46807954e-30]
 [ 9.79680161e-32  1.47528307e-30 -4.84077256e-31]
 [-4.14923362e-31 -1.18570114e-30 -2.07461681e-31]
 [ 1.01425711e-30  4.14923362e-31  3.87261805e-30]
 [-1.19002325e-30 -1.59414132e-30  2.60479666e-30]
 [-1.08341100e-30 -1.43350259e-30 -8.87474969e-31]
 [ 1.98817444e-31  9.22051916e-31 -8.64423671e-32]
 [ 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 =  [-1.79048192e-14 -1.79048192e-14 -1.79048192e-14 -1.30521195e-31
 -1.10949608e-33 -1.45886245e-49]
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