element(s):
['Ni']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.7844']
model name:
EAM_Dynamo_FoilesHoyt_2006_Ni__MO_776437554506_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.7844, 0, 0], [0, 2.7844, 0], [0, 0, 2.7844]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:18:36       -8.732395         0.030550
BFGS:    1 16:18:36       -8.732431         0.025494
BFGS:    2 16:18:36       -8.732516         0.000447
BFGS:    3 16:18:36       -8.732516         0.000007
BFGS:    4 16:18:36       -8.732516         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6934331234187427e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.78812661887822, 1.4747194335682455e-33, -1.0308663345029488e-33], [-2.5787564351498424e-33, 2.78812661887822, 1.3199380133941166e-21], [2.4293100870271035e-33, 1.3199380133926424e-21, 2.78812661887822]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.69343312e-10 -1.69343312e-10 -1.69343312e-10  1.44832569e-26
  1.32133892e-34  9.09717864e-51]
energy per atom =  -4.366258226231737
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0