element(s):
['Co', 'Pt']
AFLOW prototype label:
AB3_cP4_221_a_c
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9054']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Pt']
representative atom coordinates =  [[0.  0.  0. ]
 [0.  0.5 0.5]]
spacegroup =  221
cell =  [[3.9054, 0, 0], [0, 3.9054, 0], [0, 0, 3.9054]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 08:58:29      -78.600162       17.5589
BFGS:    1 08:58:29      -81.078297       15.3459
BFGS:    2 08:58:29      -83.157521       12.2029
BFGS:    3 08:58:29      -84.695839        8.0024
BFGS:    4 08:58:29      -85.481664        2.1963
BFGS:    5 08:58:29      -85.532031        0.4678
BFGS:    6 08:58:29      -85.534252        0.0205
BFGS:    7 08:58:29      -85.534257        0.0002
BFGS:    8 08:58:30      -85.534257        0.0000
BFGS:    9 08:58:30      -85.534257        0.0000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6857829053240175e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Pt', 'Pt', 'Pt']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 2.08503441e-34 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.17006882e-34]]
cellpar =  Cell([[3.69476865600466, 2.1188812955694795e-32, 2.1024906353170045e-32], [4.0207670759487185e-33, 3.69476865600466, 1.3816991189797286e-17], [3.620532701713868e-33, 1.3816991189797328e-17, 3.69476865600466]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.68578291e-14  1.68578291e-14  1.68578291e-14  3.96991760e-31
  2.40776829e-33 -1.47840881e-49]
energy per atom =  -21.383564130922583
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0