element(s):
['Co', 'Ni']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.8488']
model name:
EAM_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Ni']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[2.8488, 0, 0], [0, 2.8488, 0], [0, 0, 2.8488]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:49:57       -5.191751        3.9160
BFGS:    1 14:49:57       -5.635108        1.9945
BFGS:    2 14:49:57       -5.841243        1.0305
BFGS:    3 14:49:57       -5.987267        1.0185
BFGS:    4 14:49:57       -6.136156        0.8527
BFGS:    5 14:49:57       -6.213916        0.1045
BFGS:    6 14:49:57       -6.214703        0.0295
BFGS:    7 14:49:57       -6.214771        0.0000
BFGS:    8 14:49:57       -6.214771        0.0000
BFGS:    9 14:49:57       -6.214771        0.0000
BFGS:   10 14:49:57       -6.214771        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.3459255409062438e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.212659398054427, -2.0038879922610805e-32, -3.0402431396898655e-33], [-1.3581695051772977e-32, 3.212659398054427, 8.89197694171653e-18], [1.3300086164866697e-33, 8.89197694171654e-18, 3.212659398054427]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.34592554e-11  2.34592554e-11  2.34592554e-11  1.15539872e-27
 -4.97599401e-35 -2.17147983e-51]
energy per atom =  -3.107385398045893
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0