element(s):
['Fe', 'Ni']
AFLOW prototype label:
AB2_cF24_227_a_d
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.6153']
model name:
EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Fe', 'Ni']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[6.6153, 0, 0], [0, 6.6153, 0], [0, 0, 6.6153]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:01:28     -103.150859         0.517172
BFGS:    1 13:01:28     -103.162217         0.507641
BFGS:    2 13:01:28     -103.233512         0.442885
BFGS:    3 13:01:28     -103.295058         0.377652
BFGS:    4 13:01:28     -103.346779         0.311858
BFGS:    5 13:01:28     -103.388583         0.245410
BFGS:    6 13:01:28     -103.420364         0.178195
BFGS:    7 13:01:28     -103.441997         0.110079
BFGS:    8 13:01:29     -103.453337         0.040932
BFGS:    9 13:01:29     -103.455133         0.000544
BFGS:   10 13:01:29     -103.455133         0.000003
BFGS:   11 13:01:29     -103.455133         0.000000
Minimization converged after 11 steps.
Maximum force component: 9.359746087556314e-32 eV/Angstrom
Maximum stress component: 1.6765064239953914e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.41234848e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 2.89981134e-33 5.00000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [6.25000000e-01 6.25000000e-01 6.25000000e-01]
 [3.75000000e-01 8.75000000e-01 1.25000000e-01]
 [8.75000000e-01 1.25000000e-01 3.75000000e-01]
 [1.25000000e-01 3.75000000e-01 8.75000000e-01]
 [8.75000000e-01 3.75000000e-01 1.25000000e-01]
 [3.75000000e-01 1.25000000e-01 8.75000000e-01]
 [1.25000000e-01 8.75000000e-01 3.75000000e-01]
 [6.25000000e-01 1.25000000e-01 1.25000000e-01]
 [3.75000000e-01 3.75000000e-01 6.25000000e-01]
 [8.75000000e-01 6.25000000e-01 8.75000000e-01]
 [8.75000000e-01 8.75000000e-01 6.25000000e-01]
 [3.75000000e-01 6.25000000e-01 3.75000000e-01]
 [1.25000000e-01 6.25000000e-01 1.25000000e-01]
 [6.25000000e-01 3.75000000e-01 3.75000000e-01]
 [6.25000000e-01 8.75000000e-01 8.75000000e-01]
 [1.25000000e-01 1.25000000e-01 6.25000000e-01]]
cellpar =  Cell([[6.508738420594057, -8.237636484558e-34, -6.385817585962131e-33], [1.5011315897453984e-33, 6.508738420594057, -6.7839547933156016e-18], [-4.736260226304093e-33, -6.7839547933156016e-18, 6.508738420594057]])
forces =  [[-1.02372223e-32  2.42350568e-32 -2.00565988e-32]
 [ 3.92775059e-32 -8.02263950e-32  1.72883703e-32]
 [-7.35408621e-32 -2.78728996e-50  2.67421317e-32]
 [ 1.33710658e-32  2.25636736e-32 -3.13384356e-32]
 [-3.34276646e-32 -7.35408621e-32  5.68270298e-32]
 [ 7.01980957e-32 -7.35408621e-32 -3.34276646e-32]
 [-3.34276646e-32  3.84418143e-32 -2.00565988e-32]
 [ 9.35974609e-32  5.68270298e-32  6.01697963e-32]
 [ 6.68553292e-33  1.33710658e-32  3.34276646e-32]
 [ 1.33710658e-32  1.33710658e-32 -2.67421317e-32]
 [ 4.01131975e-32 -3.00848981e-32 -1.67138323e-32]
 [-2.00565988e-32 -2.67421317e-32  4.01131975e-32]
 [-2.50707484e-32  1.33710658e-32  6.68553292e-33]
 [-2.40853570e-65 -2.00565988e-32  2.67421317e-32]
 [ 4.01131975e-32  3.34276646e-32  2.75778233e-32]
 [-6.68553292e-33  5.01414969e-33 -1.67138323e-32]
 [-3.86800857e-65 -2.00565988e-32  4.67987304e-32]
 [ 6.68553292e-33  1.33710658e-32  1.33710658e-32]
 [-2.33993652e-32 -3.34276646e-32 -6.01697963e-32]
 [ 2.67421317e-32  4.01131975e-32 -2.59064401e-32]
 [ 6.68553292e-33  1.33710658e-32 -2.67421317e-32]
 [ 2.00565988e-32 -6.68553292e-33  2.08922904e-32]
 [ 6.68553292e-33 -6.68553292e-33  4.01131975e-32]
 [ 3.34276646e-33 -2.00565988e-32  2.33993652e-32]]
stress =  [ 1.67650642e-11  1.67650642e-11  1.67650642e-11 -7.79741049e-27
 -4.84926115e-35  1.11536781e-50]
energy per atom =  -4.3106305487548005
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0