element(s):
['Te', '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:
['5.7184']
model name:
SW_ZhouWardMartin_2013_CdTeZnSeHgS__MO_503261197030_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Te', 'Zn']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  225
cell =  [[5.7184, 0, 0], [0, 5.7184, 0], [0, 0, 5.7184]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:39:20      -14.919381        3.0233
BFGS:    1 14:39:20      -15.259825        2.2473
BFGS:    2 14:39:20      -15.536520        1.4613
BFGS:    3 14:39:20      -15.703782        0.7864
BFGS:    4 14:39:20      -15.777438        0.2112
BFGS:    5 14:39:20      -15.783826        0.0225
BFGS:    6 14:39:20      -15.783902        0.0008
BFGS:    7 14:39:20      -15.783902        0.0000
BFGS:    8 14:39:20      -15.783902        0.0000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.4300988880310244e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Te', 'Te', 'Te', 'Te', 'Zn', 'Zn', 'Zn', 'Zn']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 0.0000000e+00 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 1.3121111e-34]
 [5.0000000e-01 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 0.0000000e+00 0.0000000e+00]
 [0.0000000e+00 5.0000000e-01 0.0000000e+00]
 [0.0000000e+00 0.0000000e+00 5.0000000e-01]]
cellpar =  Cell([[5.871240465558914, -2.6425653245646773e-32, -3.781274472968739e-33], [-2.6380950650448035e-32, 5.871240465558914, -1.052670374257467e-17], [-2.6387474635953184e-33, -1.052670374257467e-17, 5.871240465558914]])
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 =  [-1.43009889e-11 -1.43009889e-11 -1.43009889e-11 -4.31884452e-28
 -5.10809526e-60 -7.25912390e-60]
energy per atom =  -1.9729877886165021
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0