element(s):
['Co', 'Fe']
AFLOW prototype label:
AB15_cP16_221_a_bcdg
Parameter names:
['a', 'x5']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.9305', '0.24462472']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'Fe', 'Fe', 'Fe', 'Fe']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.5        0.5        0.5       ]
 [0.         0.5        0.5       ]
 [0.5        0.         0.        ]
 [0.24462472 0.24462472 0.24462472]]
spacegroup =  221
cell =  [[5.9305, 0, 0], [0, 5.9305, 0], [0, 0, 5.9305]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:07:57     -148.709916         4.196601
BFGS:    1 17:07:57     -149.442759         3.796215
BFGS:    2 17:07:57     -150.015296         3.310847
BFGS:    3 17:07:57     -150.480835         2.773075
BFGS:    4 17:07:57     -150.853526         2.190125
BFGS:    5 17:07:57     -151.134442         1.563228
BFGS:    6 17:07:57     -151.319067         0.891082
BFGS:    7 17:07:57     -151.400594         0.174856
BFGS:    8 17:07:57     -151.403881         0.013543
BFGS:    9 17:07:57     -151.403900         0.004767
BFGS:   10 17:07:57     -151.403902         0.000296
BFGS:   11 17:07:57     -151.403902         0.000017
BFGS:   12 17:07:58     -151.403902         0.000000
BFGS:   13 17:07:58     -151.403902         0.000000
Minimization converged after 13 steps.
Maximum force component: 3.6897624578557432e-09 eV/Angstrom
Maximum stress component: 1.0804052551107928e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe', 'Fe']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [1.77063385e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.32903766e-34]
 [5.00000000e-01 1.29505081e-66 0.00000000e+00]
 [1.23944370e-48 5.00000000e-01 1.32903766e-34]
 [0.00000000e+00 1.32903766e-34 5.00000000e-01]
 [2.47870654e-01 2.47870654e-01 2.47870654e-01]
 [7.52129346e-01 7.52129346e-01 2.47870654e-01]
 [7.52129346e-01 2.47870654e-01 7.52129346e-01]
 [2.47870654e-01 7.52129346e-01 7.52129346e-01]
 [2.47870654e-01 2.47870654e-01 7.52129346e-01]
 [7.52129346e-01 7.52129346e-01 7.52129346e-01]
 [2.47870654e-01 7.52129346e-01 2.47870654e-01]
 [7.52129346e-01 2.47870654e-01 2.47870654e-01]]
cellpar =  Cell([[5.796464620322421, 6.370470892555983e-32, -6.013293395161606e-32], [-5.31799060096848e-33, 5.796464620322421, 7.949183197237273e-18], [2.3302925456178273e-32, 7.949183197237174e-18, 5.796464620322421]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 3.68976246e-09  3.68976246e-09  3.68976246e-09]
 [-3.68976246e-09 -3.68976246e-09  3.68976246e-09]
 [-3.68976246e-09  3.68976246e-09 -3.68976246e-09]
 [ 3.68976246e-09 -3.68976246e-09 -3.68976246e-09]
 [ 3.68976246e-09  3.68976246e-09 -3.68976246e-09]
 [-3.68976246e-09 -3.68976246e-09 -3.68976246e-09]
 [ 3.68976246e-09 -3.68976246e-09  3.68976246e-09]
 [-3.68976246e-09  3.68976246e-09  3.68976246e-09]]
stress =  [ 1.08040526e-10  1.08040526e-10  1.08040526e-10 -4.29882096e-26
  3.98080696e-58 -4.66513539e-59]
energy per atom =  -9.462743845369427
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0