element(s):
['O', 'Zn']
AFLOW prototype label:
AB_cF8_225_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2106']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'Zn']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[4.2106, 0, 0], [0, 4.2106, 0], [0, 0, 4.2106]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:55:20      -24.472856         4.601809
BFGS:    1 16:55:20      -25.168840         4.676864
BFGS:    2 16:55:21      -25.875545         4.744524
BFGS:    3 16:55:21      -26.591754         4.803311
BFGS:    4 16:55:22      -27.316011         4.851542
BFGS:    5 16:55:22      -28.046993         4.890888
BFGS:    6 16:55:23      -28.782421         4.912193
BFGS:    7 16:55:23      -29.521696         4.941194
BFGS:    8 16:55:24      -30.262056         4.926730
BFGS:    9 16:55:24      -30.998568         4.889320
BFGS:   10 16:55:25      -31.727527         4.825398
BFGS:   11 16:55:26      -32.444661         4.730929
BFGS:   12 16:55:26      -33.145051         4.601343
BFGS:   13 16:55:27      -33.823334         4.433987
BFGS:   14 16:55:27      -34.472856         4.218095
BFGS:   15 16:55:28      -35.095686         4.018338
BFGS:   16 16:55:28      -35.674826         3.692849
BFGS:   17 16:55:29      -36.200115         3.298815
BFGS:   18 16:55:29      -36.660566         2.826642
BFGS:   19 16:55:30      -37.044512         2.292052
BFGS:   20 16:55:31      -37.340432         1.633595
BFGS:   21 16:55:31      -37.528793         0.857450
BFGS:   22 16:55:32      -37.591123         0.049637
BFGS:   23 16:55:32      -37.591311         0.003677
BFGS:   24 16:55:33      -37.591312         0.000014
BFGS:   25 16:55:34      -37.591312         0.000000
Minimization converged after 25 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.900989576204035e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['O', 'O', 'O', 'O', 'Zn', 'Zn', 'Zn', 'Zn']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [7.53350944e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.06024720e-33 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 6.36148319e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 4.70844340e-49]
 [0.00000000e+00 5.00000000e-01 2.12049440e-34]
 [3.01340378e-48 4.24098879e-34 5.00000000e-01]]
cellpar =  Cell([[3.632982852623771, -4.285795030000989e-32, -3.6224238102980266e-33], [-2.7479803391080674e-32, 3.632982852623771, -7.314301888000603e-18], [2.920276994368435e-32, -7.314301888000617e-18, 3.6329828526237713]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-5.90098958e-10 -5.90098958e-10 -5.90098958e-10 -2.37821206e-27
  6.80958383e-35 -3.05099174e-51]
energy per atom =  -4.698914034636439
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0