element(s):
['Cl', 'Li']
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:
['5.1545']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cl', 'Li']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[5.1545, 0, 0], [0, 5.1545, 0], [0, 0, 5.1545]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:40:18      -56.944010        11.070114
BFGS:    1 16:40:18      -58.623468        11.317715
BFGS:    2 16:40:19      -60.337011        11.527259
BFGS:    3 16:40:19      -62.080889        11.721663
BFGS:    4 16:40:20      -63.852587        11.897602
BFGS:    5 16:40:20      -65.649058        12.051284
BFGS:    6 16:40:20      -67.466645        12.178395
BFGS:    7 16:40:21      -69.304378        12.328053
BFGS:    8 16:40:21      -71.158668        12.389163
BFGS:    9 16:40:22      -73.020403        12.433451
BFGS:   10 16:40:22      -74.883749        12.402115
BFGS:   11 16:40:23      -76.738113        12.312246
BFGS:   12 16:40:23      -78.574036        12.154595
BFGS:   13 16:40:23      -80.380580        11.918673
BFGS:   14 16:40:24      -82.145132        11.592584
BFGS:   15 16:40:24      -83.853175        11.162841
BFGS:   16 16:40:25      -85.488040        10.614154
BFGS:   17 16:40:25      -87.030612         9.929188
BFGS:   18 16:40:25      -88.465467         9.149279
BFGS:   19 16:40:26      -89.765439         8.194811
BFGS:   20 16:40:26      -90.906157         6.978627
BFGS:   21 16:40:27      -91.847445         5.530674
BFGS:   22 16:40:27      -92.552154         3.818461
BFGS:   23 16:40:28      -92.977935         1.805115
BFGS:   24 16:40:28      -93.083070         0.290269
BFGS:   25 16:40:29      -93.085600         0.017665
BFGS:   26 16:40:29      -93.085610         0.000159
BFGS:   27 16:40:30      -93.085610         0.000000
BFGS:   28 16:40:30      -93.085610         0.000000
Minimization converged after 28 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.3254753239039754e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cl', 'Cl', 'Cl', 'Cl', 'Li', 'Li', 'Li', 'Li']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.51092576e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.23665698e-49 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [6.23665698e-49 1.75546288e-34 5.00000000e-01]]
cellpar =  Cell([[4.388426475582628, -4.852375070996272e-32, -1.6743189494352643e-32], [-3.1482365825673246e-32, 4.388426475582628, -5.966376309707449e-18], [-7.824131086004286e-33, -5.966376309707445e-18, 4.388426475582628]])
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 =  [ 3.32547532e-14  3.32547532e-14  3.32547532e-14  1.27842260e-30
 -4.00021030e-35 -4.96316728e-52]
energy per atom =  -11.635701239125906
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0