element(s):
['Nb', '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:
['6.4293']
model name:
EAM_Dynamo_ZhangAshcraftMendelev_2016_NiNb__MO_047308317761_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Nb', 'Nb', 'Ni']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]
 [0.5  0.5  0.5 ]]
spacegroup =  225
cell =  [[6.4293, 0, 0], [0, 6.4293, 0], [0, 0, 6.4293]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 01:08:17     -105.359556        0.1895
BFGS:    1 01:08:17     -105.361056        0.1799
BFGS:    2 01:08:17     -105.374384        0.0052
BFGS:    3 01:08:17     -105.374395        0.0002
BFGS:    4 01:08:17     -105.374395        0.0000
BFGS:    5 01:08:17     -105.374395        0.0000
Minimization converged after 5 steps.
Maximum force component: 1.3494607850540212e-30 eV/Angstrom
Maximum stress component: 1.2572818506061232e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [2.13532259e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.01039878e-35 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 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [8.34110388e-52 1.20207976e-34 5.00000000e-01]]
cellpar =  Cell([[6.408659446602381, -2.0655158706373176e-32, -1.120677764654654e-33], [-2.1035999691825718e-32, 6.408659446602381, 4.461784343042141e-18], [1.0782522364567093e-35, 4.461784343042141e-18, 6.408659446602381]])
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]
 [-6.58273554e-33  8.09676471e-31  1.28692480e-30]
 [-9.54496653e-32 -6.84604496e-31  4.21295074e-31]
 [-5.92446198e-32  7.70180058e-31 -4.34460545e-31]
 [-1.38237446e-31 -7.27392277e-31 -9.74244859e-31]
 [ 1.05323769e-31  5.52949785e-31 -8.16259207e-31]
 [ 7.57014587e-32 -7.83345529e-31 -1.34946079e-30]
 [ 2.04064802e-31 -9.80827595e-31  8.16259207e-31]
 [ 1.57985653e-31  4.60791488e-31  1.07298589e-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 =  [-1.25728185e-12 -1.25728185e-12 -1.25728185e-12 -8.08524394e-30
 -1.75066426e-34 -1.81007903e-51]
energy per atom =  -6.585899664192518
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0