element(s):
['Al', '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:
['5.6016']
model name:
EAM_Dynamo_PunYamakovMishin_2013_NiAlCo__MO_826591359508_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Ni', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.6016, 0, 0], [0, 5.6016, 0], [0, 0, 5.6016]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 13:16:16      -73.484886         0.367271
BFGS:    1 13:16:16      -73.490585         0.356804
BFGS:    2 13:16:16      -73.536470         0.254100
BFGS:    3 13:16:17      -73.566540         0.145907
BFGS:    4 13:16:17      -73.579957         0.032010
BFGS:    5 13:16:18      -73.580611         0.001059
BFGS:    6 13:16:18      -73.580612         0.000007
BFGS:    7 13:16:18      -73.580612         0.000000
Minimization converged after 7 steps.
Maximum force component: 1.4688026278681443e-30 eV/Angstrom
Maximum stress component: 1.4737406477528092e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [2.46902887e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.17257217e-50 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [0.00000000e+00 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([[5.542484934947286, -5.3265066173284994e-33, 7.725467601790851e-34], [-1.8783883974775028e-32, 5.542484934947286, 4.811258508255959e-18], [3.0634079678132505e-33, 4.8112585082559596e-18, 5.542484934947286]])
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]
 [-2.16335271e-31  1.09306242e-30 -1.39479319e-31]
 [ 1.21688590e-30 -1.12152759e-30  1.07313680e-30]
 [ 1.73637520e-31  1.33216983e-30 -1.36632803e-31]
 [ 1.09306242e-30 -1.45457004e-30 -6.14847612e-31]
 [-6.60391879e-31  6.26233679e-31 -1.46880263e-30]
 [-8.51108499e-31 -1.16991837e-30 -2.27721338e-31]
 [-4.04205374e-31 -1.09590894e-30  4.44056608e-31]
 [-5.15219526e-31  5.69303344e-31  2.03525946e-31]]
stress =  [ 1.47374065e-10  1.47374065e-10  1.47374065e-10  8.30005589e-27
 -6.68744413e-35 -2.63334092e-51]
energy per atom =  -4.598788227322189
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0