element(s):
['Co', 'V']
AFLOW prototype label:
AB3_cP8_223_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:
['4.6652']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Co', 'V']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.   0.5 ]]
spacegroup =  223
cell =  [[4.6652, 0, 0], [0, 4.6652, 0], [0, 0, 4.6652]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:20:28      105.333762       196.301578
BFGS:    1 12:20:28       77.442457       175.917482
BFGS:    2 12:20:28       52.454742       157.524880
BFGS:    3 12:20:28       30.102110       140.785138
BFGS:    4 12:20:28       10.137040       125.647201
BFGS:    5 12:20:28       -7.667226       111.943106
BFGS:    6 12:20:28      -23.509154        99.487502
BFGS:    7 12:20:28      -37.572038        88.203502
BFGS:    8 12:20:28      -50.028440        78.027350
BFGS:    9 12:20:28      -61.026701        68.769255
BFGS:   10 12:20:28      -70.705773        60.416685
BFGS:   11 12:20:28      -79.189691        52.828474
BFGS:   12 12:20:28      -86.590418        45.962539
BFGS:   13 12:20:28      -93.011247        39.752687
BFGS:   14 12:20:28      -98.546017        34.138894
BFGS:   15 12:20:28     -103.281617        29.096463
BFGS:   16 12:20:28     -107.296638        24.515315
BFGS:   17 12:20:28     -110.658575        20.381564
BFGS:   18 12:20:28     -113.431495        16.656705
BFGS:   19 12:20:28     -115.674641        13.327819
BFGS:   20 12:20:28     -117.443118        10.305256
BFGS:   21 12:20:28     -118.781489         7.588223
BFGS:   22 12:20:28     -119.735949         5.176732
BFGS:   23 12:20:29     -120.345361         2.988869
BFGS:   24 12:20:29     -120.644083         1.030534
BFGS:   25 12:20:29     -120.687740         0.085021
BFGS:   26 12:20:29     -120.688052         0.002731
BFGS:   27 12:20:29     -120.688052         0.000008
BFGS:   28 12:20:29     -120.688052         0.000000
Minimization converged after 28 steps.
Maximum force component: 1.4151505070237325e-30 eV/Angstrom
Maximum stress component: 4.024831641424384e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Co', 'Co', 'V', 'V', 'V', 'V', 'V', 'V']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [2.50000000e-01 0.00000000e+00 5.00000000e-01]
 [7.50000000e-01 1.14516222e-33 5.00000000e-01]
 [5.00000000e-01 2.50000000e-01 0.00000000e+00]
 [5.00000000e-01 7.50000000e-01 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 2.50000000e-01]
 [5.06034645e-34 5.00000000e-01 7.50000000e-01]]
cellpar =  Cell([[5.3817491689257535, 4.132464333089055e-33, -2.602088367107446e-32], [4.2343007231684424e-32, 5.3817491689257535, -5.761844537632592e-17], [1.237678741742646e-32, -5.761844537632596e-17, 5.3817491689257535]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 5.51352817e-64  4.42234533e-32  8.84469067e-32]
 [ 5.21917860e-64  6.63351800e-32 -7.10202172e-49]
 [ 1.10558633e-31  1.41515051e-30  1.10558633e-31]
 [-1.12868034e-62 -1.41515051e-30 -6.63351800e-32]
 [ 1.10558633e-31  6.63351800e-32 -7.10202172e-49]
 [-6.63351800e-32 -5.09365555e-65  3.20732154e-64]]
stress =  [-4.02483164e-11 -4.02483164e-11 -4.02483164e-11  6.83149166e-28
  7.09287497e-35 -2.80515224e-51]
energy per atom =  -15.08600647866245
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0