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_1959LowCutoff_Ni__MO_322509103239_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 16:20:03       -7.811630         0.452245
BFGS:    1 16:20:03       -7.819081         0.317320
BFGS:    2 16:20:03       -7.826638         0.018509
BFGS:    3 16:20:03       -7.826665         0.000826
BFGS:    4 16:20:03       -7.826665         0.000002
BFGS:    5 16:20:03       -7.826665         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.59239821464912e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.8159196766357897, -5.834759337150879e-33, -3.716578303781641e-33], [-1.0214271505322919e-32, 2.8159196766357897, -5.206093831744176e-19], [-2.649744581753302e-32, -5.206093831743987e-19, 2.8159196766357897]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.59239821e-11 -2.59239821e-11 -2.59239821e-11 -9.50277341e-27
  2.59076895e-34  4.75350961e-50]
energy per atom =  -3.9133326400159896
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0