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 14:55:02     -135.427647        0.5253
BFGS:    1 14:55:03     -135.439420        0.5206
BFGS:    2 14:55:03     -135.515098        0.4881
BFGS:    3 14:55:03     -135.585744        0.4534
BFGS:    4 14:55:03     -135.650987        0.4160
BFGS:    5 14:55:03     -135.710378        0.3753
BFGS:    6 14:55:03     -135.763393        0.3309
BFGS:    7 14:55:03     -135.809420        0.2821
BFGS:    8 14:55:03     -135.847763        0.2283
BFGS:    9 14:55:03     -135.877635        0.1690
BFGS:   10 14:55:03     -135.898154        0.1035
BFGS:   11 14:55:03     -135.908333        0.0310
BFGS:   12 14:55:04     -135.909264        0.0023
BFGS:   13 14:55:04     -135.909269        0.0000
BFGS:   14 14:55:04     -135.909269        0.0000
BFGS:   15 14:55:04     -135.909269        0.0000
Minimization converged after 15 steps.
Maximum force component: 4.483823357184348e-31 eV/Angstrom
Maximum stress component: 1.15986928058134e-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, 8.993617814780501e-34, 4.862254008272054e-35], [1.2340795836775375e-33, 7.321176708092255, -1.6624418005510457e-18], [3.158647867136931e-36, -1.662441800551046e-18, 7.321176708092255]])
forces =  [[-3.38401763e-32 -7.52003917e-33 -4.88802546e-32]
 [-2.18081136e-31 -1.71550894e-31  1.50400783e-31]
 [-3.00801567e-32 -2.25601175e-31  1.65440862e-31]
 [-2.49101298e-32  2.59441351e-31  1.42880744e-31]
 [ 4.48382336e-31  2.63201371e-31 -2.21841156e-31]
 [ 1.61680842e-31  3.11376622e-33  2.97041547e-31]
 [-4.51202350e-32 -7.52003917e-32  7.52003917e-33]
 [-1.01520529e-31 -2.82001469e-33 -1.12800588e-32]
 [-1.33480695e-31 -3.09261611e-31 -3.42161782e-31]
 [ 2.88581503e-31  8.64804505e-32  2.14321116e-31]
 [ 4.51202350e-32 -2.10561097e-31  9.02404701e-32]
 [-4.18081034e-65 -2.48161293e-31  5.26402742e-32]
 [-5.35802791e-32  3.76001959e-32 -1.50400783e-32]
 [-2.21841156e-31 -1.69200881e-32  1.57920823e-31]
 [-3.38401763e-32  2.57091339e-31 -1.95521019e-31]
 [-1.05280548e-31  4.51202350e-32 -1.50400783e-32]
 [-2.63201371e-32 -1.59800832e-32 -3.76001959e-33]
 [ 1.12800588e-32  9.40004897e-34  2.16201126e-32]
 [-1.71550894e-32  7.52003917e-33 -1.69200881e-32]
 [-1.17500612e-32 -8.46004407e-33 -1.88000979e-33]
 [ 1.12800588e-32  1.73900906e-32 -1.88000979e-33]
 [-1.88000979e-33  6.11003183e-33 -1.41000735e-33]
 [ 1.12800588e-32  5.64002938e-33  9.40004897e-33]
 [ 9.40004897e-34 -2.35001224e-32  3.76001959e-33]]
stress =  [-1.15986928e-13 -1.15986928e-13 -1.15986928e-13  1.11242226e-30
 -4.79090372e-36  8.40166914e-54]
energy per atom =  -5.662886217496756
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0