element(s):
['Be', 'O']
AFLOW prototype label:
AB_cF8_216_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:
['3.8249']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Be', 'O']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.25 0.25 0.25]]
spacegroup =  216
cell =  [[3.8249, 0, 0], [0, 3.8249, 0], [0, 0, 3.8249]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:18:02      -37.585963         4.312642
BFGS:    1 12:18:02      -38.215938         4.079407
BFGS:    2 12:18:02      -38.807355         3.797548
BFGS:    3 12:18:02      -39.352460         3.460820
BFGS:    4 12:18:03      -39.842510         3.062234
BFGS:    5 12:18:03      -40.267648         2.593958
BFGS:    6 12:18:03      -40.616776         2.047219
BFGS:    7 12:18:03      -40.877401         1.412188
BFGS:    8 12:18:03      -41.037595         0.692533
BFGS:    9 12:18:03      -41.080322         0.118737
BFGS:   10 12:18:03      -41.081499         0.006917
BFGS:   11 12:18:03      -41.081503         0.000064
BFGS:   12 12:18:03      -41.081503         0.000000
BFGS:   13 12:18:03      -41.081503         0.000000
Minimization converged after 13 steps.
Maximum force component: 1.1878372338118935e-30 eV/Angstrom
Maximum stress component: 3.2700447518391806e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Be', 'Be', 'Be', 'Be', 'O', 'O', 'O', 'O']
basis =  [[0.   0.   0.  ]
 [0.   0.5  0.5 ]
 [0.5  0.   0.5 ]
 [0.5  0.5  0.  ]
 [0.25 0.25 0.25]
 [0.75 0.75 0.25]
 [0.75 0.25 0.75]
 [0.25 0.75 0.75]]
cellpar =  Cell([[3.613830197796207, -2.6612319829634926e-33, -4.0142724457822024e-33], [8.76910822734775e-34, 3.613830197796207, -1.2153697457319178e-17], [4.864755977840296e-34, -1.2153697457319182e-17, 3.613830197796207]])
forces =  [[ 3.60292013e-66  1.48479654e-32 -4.99352957e-50]
 [ 1.48479654e-32  1.48479654e-32  1.48479654e-32]
 [ 1.48479654e-32 -1.09340722e-65 -1.64932427e-65]
 [ 1.99875823e-66 -4.99352957e-50  1.48479654e-32]
 [-2.96959308e-31  8.90877925e-32 -4.75134894e-31]
 [-2.39423442e-31  6.86718401e-32  1.18783723e-30]
 [-7.42398271e-32  2.37567447e-31  5.04830824e-31]
 [-3.56351170e-31  2.31535461e-31  6.23614548e-31]]
stress =  [ 3.27004475e-14  3.27004475e-14  3.27004475e-14  4.61507487e-31
 -2.51682898e-33  5.40637529e-49]
energy per atom =  -5.135187919834721
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0