element(s):
['O', 'Si']
AFLOW prototype label:
A2B_hR36_166_2fgh_i
Parameter names:
['a', 'c/a', 'x1', 'x2', 'x3', 'x4', 'z4', 'x5', 'y5', 'z5']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['18.341729', '0.39545162', '0.43632765', '0.28420802', '0.72413643', '0.18764467', '0.67474924', '0.78935612', '0.22947111', '0.62867751']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'O', 'O', 'Si']
representative atom coordinates =  [[0.43632765 0.         0.        ]
 [0.28420802 0.         0.        ]
 [0.22413643 0.         0.5       ]
 [0.50429848 0.49570152 0.68334619]
 [0.68030286 0.75981213 0.54916825]]
spacegroup =  166
cell =  [[18.3417, 0, 0], [-9.17085, 15.884378148593, 0], [0, 0, 7.2533]]
=========================================