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:
Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Ni__MO_381861218831_004
==== 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 16:33:21      -16.956392         0.198120
BFGS:    1 16:33:21      -16.957955         0.169910
BFGS:    2 16:33:21      -16.962384         0.004599
BFGS:    3 16:33:21      -16.962387         0.000111
BFGS:    4 16:33:21      -16.962387         0.000000
BFGS:    5 16:33:21      -16.962387         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1354684262152002e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.16542244e-48 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[3.5226424717458276, 1.5137599023249778e-32, -8.691459184135295e-33], [1.5182997696583532e-32, 3.5226424717458276, -3.589710833167181e-20], [9.004732830177878e-33, -3.589710833168128e-20, 3.5226424717458276]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.13546843e-13 -1.13546843e-13 -1.13546843e-13 -3.39473702e-31
 -3.36275675e-35 -1.40549338e-52]
energy per atom =  -4.240596781850953
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0