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 20:05:20      -37.585963         4.312642
BFGS:    1 20:05:20      -38.215938         4.079407
BFGS:    2 20:05:20      -38.807355         3.797548
BFGS:    3 20:05:21      -39.352460         3.460820
BFGS:    4 20:05:21      -39.842510         3.062234
BFGS:    5 20:05:21      -40.267648         2.593958
BFGS:    6 20:05:21      -40.616776         2.047219
BFGS:    7 20:05:21      -40.877401         1.412188
BFGS:    8 20:05:21      -41.037595         0.692533
BFGS:    9 20:05:21      -41.080322         0.118737
BFGS:   10 20:05:21      -41.081499         0.006917
BFGS:   11 20:05:21      -41.081503         0.000064
BFGS:   12 20:05:21      -41.081503         0.000000
BFGS:   13 20:05:22      -41.081503         0.000000
Minimization converged after 13 steps.
Maximum force component: 2.145531003572732e-30 eV/Angstrom
Maximum stress component: 3.104363869701585e-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([[3.6138301977962066, 2.1780962662818386e-33, 1.7801080132068573e-34], [-3.2849249357820485e-35, 3.6138301977962066, 4.405910094018721e-18], [-1.733164560979606e-34, 4.4059100940187194e-18, 3.6138301977962066]])
forces =  [[-2.07871516e-31 -1.18783723e-31 -1.78175585e-31]
 [ 8.90877925e-32  8.90877925e-32  1.48479654e-31]
 [ 1.18783723e-31 -5.93918617e-32  8.90877925e-32]
 [-5.93918617e-32  1.48479654e-31  1.18783723e-31]
 [-9.50269787e-31  2.25374194e-48  1.84857170e-30]
 [ 9.46557796e-31 -1.12844537e-30  9.02013899e-31]
 [-1.32889291e-30  8.31486064e-31 -1.42540468e-30]
 [ 9.50269787e-31 -2.14553100e-30 -1.06905351e-30]]
stress =  [ 3.10436387e-14  3.10436387e-14  3.10436387e-14 -3.92223074e-32
  4.01461394e-64 -1.68396525e-65]
energy per atom =  -5.135187919834722
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0