element(s):
['Br', '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:
['7.3847']
model name:
Sim_LAMMPS_EIM_Zhou_2010_BrClCsFIKLiNaRb__SM_259779394709_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Br', 'Cs']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[7.3847, 0, 0], [0, 7.3847, 0], [0, 0, 7.3847]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:20:39      -18.658525        2.6895
BFGS:    1 14:20:39      -18.958520        2.5116
BFGS:    2 14:20:39      -19.315460        2.2395
BFGS:    3 14:20:39      -19.627782        1.9157
BFGS:    4 14:20:39      -19.887254        1.5336
BFGS:    5 14:20:39      -20.085467        1.0952
BFGS:    6 14:20:39      -20.211772        0.5758
BFGS:    7 14:20:39      -20.254055        0.0268
BFGS:    8 14:20:39      -20.254138        0.0019
BFGS:    9 14:20:40      -20.254138        0.0000
BFGS:   10 14:20:40      -20.254138        0.0000
Minimization converged after 10 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.6454726154961277e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Br', 'Br', 'Br', 'Br', '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 8.71188018e-34]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.93442599e-49 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 8.71188018e-34]
 [9.36987590e-50 0.00000000e+00 5.00000000e-01]]
cellpar =  Cell([[7.074220140665606, 1.480885376663587e-32, -7.093058317572225e-34], [1.7713600691356534e-32, 7.074220140665605, -4.586813537246565e-17], [3.797993321503044e-34, -4.5868135372465647e-17, 7.074220140665605]])
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 =  [-2.64547262e-11 -2.64547262e-11 -2.64547262e-11 -3.92397717e-29
 -2.30905669e-35  9.68395400e-53]
energy per atom =  -2.531767287494125
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0