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:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_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 14:50:02      -25.201462        8.1984
BFGS:    1 14:50:02      -26.080660        3.0080
BFGS:    2 14:50:02      -26.147806        1.7129
BFGS:    3 14:50:02      -26.171492        0.1753
BFGS:    4 14:50:02      -26.171762        0.0089
BFGS:    5 14:50:02      -26.171762        0.0000
BFGS:    6 14:50:02      -26.171762        0.0000
BFGS:    7 14:50:02      -26.171762        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.35423913284196e-15 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7498173437652196, -2.679971524402716e-32, 6.2705565837269e-33], [-1.6300717261665522e-32, 2.7498173437652196, 4.514785499584438e-18], [8.816362680448341e-33, 4.514785499584419e-18, 2.7498173437652196]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 7.35423913e-15  7.35423913e-15  7.35423913e-15 -5.77301304e-31
 -3.26018888e-33  3.24490717e-49]
energy per atom =  -13.08588123443424
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0