element(s):
['Nb', 'Ni']
AFLOW prototype label:
A2B_cF24_227_c_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.4857']
model name:
EAM_Dynamo_ZhangAshcraftMendelev_2016_NiNb__MO_047308317761_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Nb', 'Ni']
representative atom coordinates =  [[0.125 0.125 0.125]
 [0.5   0.5   0.5  ]]
spacegroup =  227
cell =  [[7.4857, 0, 0], [0, 7.4857, 0], [0, 0, 7.4857]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:17:09     -135.427647         0.525304
BFGS:    1 16:17:09     -135.439420         0.520593
BFGS:    2 16:17:09     -135.515098         0.488117
BFGS:    3 16:17:09     -135.585744         0.453416
BFGS:    4 16:17:09     -135.650987         0.415989
BFGS:    5 16:17:09     -135.710378         0.375318
BFGS:    6 16:17:09     -135.763393         0.330862
BFGS:    7 16:17:09     -135.809420         0.282057
BFGS:    8 16:17:09     -135.847763         0.228313
BFGS:    9 16:17:09     -135.877635         0.169007
BFGS:   10 16:17:09     -135.898154         0.103478
BFGS:   11 16:17:09     -135.908333         0.031035
BFGS:   12 16:17:10     -135.909264         0.002293
BFGS:   13 16:17:10     -135.909269         0.000046
BFGS:   14 16:17:10     -135.909269         0.000000
BFGS:   15 16:17:10     -135.909269         0.000000
Minimization converged after 15 steps.
Maximum force component: 2.105610968572943e-31 eV/Angstrom
Maximum stress component: 1.1612122196124215e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Nb', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.125 0.125 0.125]
 [0.875 0.375 0.625]
 [0.375 0.625 0.875]
 [0.625 0.875 0.375]
 [0.375 0.875 0.625]
 [0.875 0.625 0.375]
 [0.625 0.375 0.875]
 [0.125 0.625 0.625]
 [0.875 0.875 0.125]
 [0.375 0.125 0.375]
 [0.375 0.375 0.125]
 [0.875 0.125 0.875]
 [0.625 0.125 0.625]
 [0.125 0.875 0.875]
 [0.125 0.375 0.375]
 [0.625 0.625 0.125]
 [0.5   0.5   0.5  ]
 [0.5   0.    0.   ]
 [0.    0.    0.5  ]
 [0.    0.5   0.   ]
 [0.25  0.75  0.25 ]
 [0.75  0.75  0.75 ]
 [0.75  0.25  0.25 ]
 [0.25  0.25  0.75 ]]
cellpar =  Cell([[7.321176708092255, 1.1317490312248677e-33, 4.056381413632326e-35], [1.4882922279803155e-33, 7.321176708092255, -1.846928223493527e-18], [1.1112130694790588e-35, -1.8469282234935273e-18, 7.321176708092255]])
forces =  [[-1.22754012e-65 -6.01603134e-32 -3.00801567e-32]
 [-9.01251350e-66 -4.51202350e-32  1.05280548e-31]
 [ 2.25601175e-32  7.52003917e-33  3.00801567e-32]
 [ 6.01603134e-32  1.50400783e-32  6.01603134e-32]
 [-6.01603134e-32 -1.50400783e-32 -3.00801567e-32]
 [-1.50400783e-32 -9.02404701e-32  4.51202350e-32]
 [ 4.51202350e-32 -7.52003917e-32  4.51202350e-32]
 [-1.50400783e-32  3.00801567e-32 -6.01603134e-32]
 [-3.00801567e-32  9.02404701e-32  1.50400783e-32]
 [-3.00801567e-32 -4.51202350e-32  6.01603134e-32]
 [ 7.52003917e-33 -1.50400783e-32  1.35360705e-31]
 [ 4.51202350e-32  6.01603134e-32  3.00801567e-32]
 [ 1.50400783e-32 -4.51202350e-32 -3.00801567e-32]
 [-2.10561097e-31 -4.51202350e-32  1.35360705e-31]
 [ 7.52003917e-32  1.50400783e-32  4.51202350e-32]
 [-1.50400783e-32 -3.00801567e-32 -4.51202350e-32]
 [ 7.52003917e-33  1.31894437e-32  2.06801077e-32]
 [ 7.52003917e-33 -2.44401273e-32 -7.99004162e-33]
 [-9.40004897e-33  1.50400783e-32  6.58003428e-33]
 [ 1.88000979e-33  3.87752020e-33 -6.58003428e-33]
 [-4.99377601e-33 -1.59800832e-32 -3.76001959e-33]
 [-1.69200881e-32 -1.62150845e-32  1.73900906e-32]
 [-1.88000979e-32  1.12800588e-32 -1.31600686e-32]
 [-1.41000735e-33 -2.44401273e-32  5.64002938e-33]]
stress =  [-1.16121222e-13 -1.16121222e-13 -1.16121222e-13 -1.37566653e-30
  6.47864127e-65 -9.99589534e-64]
energy per atom =  -5.662886217496783
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0