element(s):
['Cr', '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:
['6.8546']
model name:
EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cr', 'Ni']
representative atom coordinates =  [[0.    0.    0.   ]
 [0.625 0.625 0.625]]
spacegroup =  227
cell =  [[6.8546, 0, 0], [0, 6.8546, 0], [0, 0, 6.8546]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 11:46:28      -96.855786         1.452049
BFGS:    1 11:46:28      -96.945232         1.422559
BFGS:    2 11:46:28      -97.153197         1.349934
BFGS:    3 11:46:28      -97.350108         1.275259
BFGS:    4 11:46:28      -97.535700         1.199067
BFGS:    5 11:46:28      -97.709751         1.121378
BFGS:    6 11:46:28      -97.872038         1.042187
BFGS:    7 11:46:29      -98.022334         0.961507
BFGS:    8 11:46:29      -98.160413         0.879287
BFGS:    9 11:46:29      -98.286035         0.795398
BFGS:   10 11:46:29      -98.398952         0.710006
BFGS:   11 11:46:29      -98.498989         0.623532
BFGS:   12 11:46:29      -98.585921         0.535240
BFGS:   13 11:46:29      -98.659465         0.445006
BFGS:   14 11:46:29      -98.719320         0.352700
BFGS:   15 11:46:29      -98.765163         0.258167
BFGS:   16 11:46:29      -98.796669         0.161575
BFGS:   17 11:46:29      -98.813531         0.062881
BFGS:   18 11:46:29      -98.816486         0.001195
BFGS:   19 11:46:29      -98.816487         0.000009
BFGS:   20 11:46:29      -98.816487         0.000000
Minimization converged after 20 steps.
Maximum force component: 1.1816058228146393e-30 eV/Angstrom
Maximum stress component: 1.334094945169292e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Cr', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 9.62945087e-33 1.96046179e-33]
 [2.24677133e-33 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.72877600e-33]
 [5.00000000e-01 2.33048500e-34 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([[6.6112588381755515, -7.791436750478514e-33, 6.506601914701466e-33], [-3.2871146043346226e-33, 6.6112588381755515, -1.766555764567352e-17], [1.1784200269681245e-32, -1.7665557645673515e-17, 6.6112588381755515]])
forces =  [[ 2.46167880e-32 -4.96580033e-32  3.39541903e-33]
 [ 3.14076260e-32  1.35816761e-32  8.48854758e-33]
 [ 1.01862571e-32 -1.69770952e-32 -1.35816761e-32]
 [ 2.37679332e-32 -3.05587713e-32 -8.48854758e-34]
 [ 3.39541903e-33  6.79083806e-33 -4.07450284e-32]
 [-2.71633522e-32  2.37679332e-32 -1.35816761e-32]
 [-3.39541903e-33 -3.39541903e-33 -3.73496093e-32]
 [-2.71633522e-32 -2.71633522e-32 -1.69770952e-32]
 [ 1.08653409e-31 -8.14900567e-32 -1.08653409e-31]
 [ 7.60573863e-31 -8.55645596e-31  4.34613636e-31]
 [ 4.49044167e-31 -2.02823234e-31  2.99645729e-31]
 [-3.80286931e-31 -6.51920454e-31  2.71633522e-32]
 [ 2.17306818e-31  7.33410511e-31 -6.79083806e-31]
 [ 5.97593749e-31 -2.17306818e-31 -4.61776988e-31]
 [-2.47865589e-31  6.99456320e-31 -1.15444247e-31]
 [-2.71633522e-32 -1.35816761e-31 -5.43267045e-32]
 [-7.06247158e-31  6.79083806e-31 -2.44470170e-31]
 [ 7.87737215e-31 -2.17306818e-31 -3.80286931e-31]
 [-1.18160582e-30  3.59914417e-31  1.39212180e-31]
 [ 4.88940340e-31 -1.90143466e-31  2.71633522e-31]
 [ 6.79083806e-32  8.14900567e-32 -3.53123579e-31]
 [ 1.62980113e-31 -2.17306818e-31 -7.60573863e-31]
 [-1.35816761e-31  6.38338778e-31 -3.53123579e-31]
 [ 2.85215199e-31 -3.05587713e-32 -2.11364835e-31]]
stress =  [ 1.33409495e-10  1.33409495e-10  1.33409495e-10 -1.16409829e-26
  5.54201930e-59 -1.10638886e-60]
energy per atom =  -4.117353616817523
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0