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 20:25:26      -56.944010        11.070114
BFGS:    1 20:25:26      -58.623468        11.317715
BFGS:    2 20:25:26      -60.337011        11.527259
BFGS:    3 20:25:26      -62.080889        11.721663
BFGS:    4 20:25:26      -63.852587        11.897602
BFGS:    5 20:25:27      -65.649058        12.051284
BFGS:    6 20:25:27      -67.466645        12.178395
BFGS:    7 20:25:27      -69.304378        12.328053
BFGS:    8 20:25:27      -71.158668        12.389163
BFGS:    9 20:25:27      -73.020403        12.433451
BFGS:   10 20:25:27      -74.883749        12.402115
BFGS:   11 20:25:27      -76.738113        12.312246
BFGS:   12 20:25:27      -78.574036        12.154595
BFGS:   13 20:25:27      -80.380580        11.918673
BFGS:   14 20:25:27      -82.145132        11.592584
BFGS:   15 20:25:27      -83.853175        11.162841
BFGS:   16 20:25:27      -85.488040        10.614154
BFGS:   17 20:25:27      -87.030612         9.929188
BFGS:   18 20:25:27      -88.465467         9.149279
BFGS:   19 20:25:27      -89.765439         8.194811
BFGS:   20 20:25:27      -90.906157         6.978627
BFGS:   21 20:25:27      -91.847445         5.530674
BFGS:   22 20:25:27      -92.552154         3.818461
BFGS:   23 20:25:27      -92.977935         1.805115
BFGS:   24 20:25:27      -93.083070         0.290269
BFGS:   25 20:25:27      -93.085600         0.017665
BFGS:   26 20:25:27      -93.085610         0.000159
BFGS:   27 20:25:27      -93.085610         0.000000
BFGS:   28 20:25:27      -93.085610         0.000000
Minimization converged after 28 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.2689337914856725e-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]
 [6.23665698e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.40437030e-33]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.23665698e-49 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 7.02185152e-34]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[4.388426475582629, 2.6612408539984367e-32, 3.825486679581079e-32], [-1.2658339543348613e-32, 4.388426475582629, 4.316036422521138e-17], [-2.913254312255531e-33, 4.316036422521139e-17, 4.3884264755826266]])
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 =  [ 3.26893379e-14  3.26893379e-14  3.26893379e-14  9.93781440e-31
  5.33361374e-35 -1.74408192e-50]
energy per atom =  -11.63570123912591
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0