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:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Ni__MO_381861218831_004
==== 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 16:08:39       -8.424323         0.180454
BFGS:    1 16:08:39       -8.425521         0.129702
BFGS:    2 16:08:39       -8.426828         0.003256
BFGS:    3 16:08:39       -8.426829         0.000061
BFGS:    4 16:08:39       -8.426829         0.000000
BFGS:    5 16:08:39       -8.426829         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.3230159977377775e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7974018020517866, -6.976156602557324e-33, -1.2577675145636158e-33], [-7.344610126105788e-34, 2.7974018020517866, -4.796495722948164e-21], [-2.8403209514506972e-33, -4.79649572294853e-21, 2.7974018020517866]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.32301600e-14 -2.32301600e-14 -2.32301600e-14 -2.60580281e-30
  4.71712489e-35 -7.47492486e-52]
energy per atom =  -4.213414269553785
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0