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:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== 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 15:23:17      -67.539436         8.877792
BFGS:    1 15:23:17      -68.622002         5.496044
BFGS:    2 15:23:17      -69.111547         0.814609
BFGS:    3 15:23:17      -69.120452         0.139775
BFGS:    4 15:23:17      -69.120713         0.002820
BFGS:    5 15:23:17      -69.120713         0.000009
BFGS:    6 15:23:17      -69.120713         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 6.350372551581765e-11 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([[3.4106510121947187, -4.325152232100465e-32, 6.698772663836031e-33], [-4.217959390163326e-32, 3.4106510121947187, 1.1126512017557654e-19], [-4.6703435886413273e-32, 1.112651201756275e-19, 3.4106510121947187]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-6.35037255e-11 -6.35037255e-11 -6.35037255e-11 -5.74227147e-27
  2.47242245e-33  4.70128438e-49]
energy per atom =  -17.28017833539113
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0