element(s):
['O', 'Si']
AFLOW prototype label:
A2B_cP72_205_2d_d
Parameter names:
['a', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['10.5357', '0.54703756', '0.74824173', '0.1654052', '0.71730161', '0.58475025', '0.071044533', '0.64661243', '0.72020308', '0.049244101']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'Si']
representative atom coordinates =  [[0.54703756 0.74824173 0.1654052 ]
 [0.71730161 0.58475025 0.07104453]
 [0.64661243 0.72020308 0.0492441 ]]
spacegroup =  205
cell =  [[10.5357, 0, 0], [0, 10.5357, 0], [0, 0, 10.5357]]
=========================================