element(s):
['Ni']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.5048']
model name:
EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.5048, 0, 0], [0, 3.5048, 0], [0, 0, 3.5048]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:07:57      -17.788661        0.2052
BFGS:    1 17:07:57      -17.790322        0.1725
BFGS:    2 17:07:57      -17.794594        0.0161
BFGS:    3 17:07:57      -17.794636        0.0015
BFGS:    4 17:07:57      -17.794636        0.0000
BFGS:    5 17:07:57      -17.794636        0.0000
BFGS:    6 17:07:57      -17.794636        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.8795713264217084e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.522467418179915, 5.467775613177328e-34, 3.281642667933137e-33], [1.6293467770855485e-32, 3.522467418179915, -2.131849472288149e-23], [-1.797311691160313e-32, -2.1318494701339308e-23, 3.522467418179915]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.87957133e-14 -1.87957133e-14 -1.87957133e-14 -7.76514110e-31
 -8.27837783e-35  1.49687164e-50]
energy per atom =  -4.448659106990821
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0