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_MishinMehlPapaconstantopoulos_2002_NiAl__MO_109933561507_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 18:05:11       -8.768227        0.0293
BFGS:    1 18:05:11       -8.768258        0.0197
BFGS:    2 18:05:11       -8.768284        0.0001
BFGS:    3 18:05:11       -8.768284        0.0000
BFGS:    4 18:05:11       -8.768284        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6549142746676282e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.78262473593062, 4.1439535396305124e-36, 1.0684817381383214e-33], [3.659242448651799e-36, 2.78262473593062, -7.759851457461642e-22], [-2.6867898720619674e-34, -7.7598514574136645e-22, 2.78262473593062]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.65491427e-12  1.65491427e-12  1.65491427e-12 -3.63535492e-28
  8.29105790e-35  2.02367815e-52]
energy per atom =  -4.38414178148326
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0