element(s):
['O', 'Si']
AFLOW prototype label:
A2B_cI144_206_2de_e
Parameter names:
['a', 'x1', '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:
['12.0878', '0.99990998', '0.72753021', '0.37750788', '0.86225898', '0.36158481', '0.37345964', '0.7551385', '0.44472022']
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 =  [[0.99990998 0.         0.25      ]
 [0.72753021 0.         0.25      ]
 [0.87750788 0.36225898 0.86158481]
 [0.37345964 0.7551385  0.44472022]]
spacegroup =  206
cell =  [[12.0878, 0, 0], [0, 12.0878, 0], [0, 0, 12.0878]]
=========================================