element(s):
['O', 'Si']
AFLOW prototype label:
A2B_hR36_167_def_f
Parameter names:
['a', 'c/a', 'x2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['8.0495301', '3.6759176', '0.50600817', '0.90363734', '0.17688175', '0.25203044', '0.041032101', '0.95060742', '0.36070685']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'O', 'Si']
representative atom coordinates =  [[0.5        0.         0.        ]
 [0.74399183 0.         0.25      ]
 [0.47451393 0.60063476 0.27751651]
 [0.57659139 0.83350804 0.28411546]]
spacegroup =  167
cell =  [[8.0495, 0, 0], [-4.02475, 6.9710714877628, 0], [0, 0, 29.5894]]
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