element(s):
['Cl', 'Cs']
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:
['7.0727']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cl', 'Cs']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[7.0727, 0, 0], [0, 7.0727, 0], [0, 0, 7.0727]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 20:19:06      -50.762761         4.695677
BFGS:    1 20:19:06      -51.434536         4.248851
BFGS:    2 20:19:06      -52.033446         3.722589
BFGS:    3 20:19:06      -52.546849         3.107009
BFGS:    4 20:19:06      -52.960532         2.391059
BFGS:    5 20:19:06      -53.258532         1.562372
BFGS:    6 20:19:06      -53.427275         0.656719
BFGS:    7 20:19:06      -53.457049         0.122204
BFGS:    8 20:19:06      -53.458045         0.005192
BFGS:    9 20:19:06      -53.458047         0.000039
BFGS:   10 20:19:06      -53.458047         0.000000
BFGS:   11 20:19:06      -53.458047         0.000000
Minimization converged after 11 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.024808294765063e-16 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cl', 'Cl', 'Cl', 'Cl', 'Cs', 'Cs', 'Cs', 'Cs']
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 1.13620129e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.11499926e-69 6.30718414e-51]
 [0.00000000e+00 5.00000000e-01 2.27240257e-34]
 [0.00000000e+00 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[6.7802420903040925, -4.2674402328706496e-33, 2.0910107691932338e-34], [-6.194206900359821e-33, 6.7802420903040925, -7.648645798805384e-18], [-5.6734495781901864e-33, -7.648645798805371e-18, 6.7802420903040925]])
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 =  [ 8.02480829e-16  8.02480829e-16  8.02480829e-16 -2.72861023e-31
  1.78747015e-34 -6.60388788e-51]
energy per atom =  -6.682255857409482
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0