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_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005
==== 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 16:17:27       -8.685751         0.567937
BFGS:    1 16:17:27       -8.699039         0.524107
BFGS:    2 16:17:27       -8.747187         0.007438
BFGS:    3 16:17:27       -8.747190         0.004858
BFGS:    4 16:17:27       -8.747192         0.000010
BFGS:    5 16:17:27       -8.747192         0.000000
BFGS:    6 16:17:27       -8.747192         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.7748540855684214e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.865912385570587, -4.751230154539745e-32, 7.620455521918181e-33], [-1.7163250486897113e-32, 2.865912385570587, -2.7152872736269467e-19], [2.0490433946698094e-33, -2.7152872736269073e-19, 2.865912385570587]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.77485409e-15  2.77485409e-15  2.77485409e-15  5.31336426e-32
 -3.12646379e-35 -3.06646247e-52]
energy per atom =  -4.373595886829731
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0