element(s):
['Ni']
AFLOW prototype label:
A_hP2_194_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.582', '1.5943455']
model name:
EAM_Dynamo_ZhangAshcraftMendelev_2016_NiNb__MO_047308317761_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.582, 0, 0], [-1.291, 2.2360775925714, 0], [0, 0, 4.1166]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:04:28       -9.637246        0.9083
BFGS:    1 15:04:28       -9.661761        0.8012
BFGS:    2 15:04:28       -9.721588        0.2404
BFGS:    3 15:04:28       -9.724084        0.1881
BFGS:    4 15:04:28       -9.725078        0.0990
BFGS:    5 15:04:28       -9.725248        0.0814
BFGS:    6 15:04:28       -9.725693        0.0022
BFGS:    7 15:04:28       -9.725693        0.0002
BFGS:    8 15:04:28       -9.725693        0.0000
BFGS:    9 15:04:28       -9.725693        0.0000
BFGS:   10 15:04:28       -9.725693        0.0000
Minimization converged after 10 steps.
Maximum force component: 9.166494015200997e-32 eV/Angstrom
Maximum stress component: 2.156764508091624e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.4789144832763768, 2.5580834045586337e-17, -3.746633062514948e-36], [-1.2394572416381884, 2.146802916326516, 1.306209082015067e-36], [2.1619965275552028e-35, -3.5856785664755213e-35, 4.075122770265195]])
forces =  [[-9.16649402e-32  1.76409260e-32  1.33882361e-67]
 [ 9.16649402e-32 -1.76409260e-32 -1.33882361e-67]]
stress =  [-2.15676451e-12 -2.15676451e-12 -7.17150897e-13 -7.04462030e-34
  4.06721343e-34  8.77687584e-28]
energy per atom =  -4.862846525264673
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0