element(s):
['O', 'Si']
AFLOW prototype label:
A2B_oP24_56_ace_e
Parameter names:
['a', 'b/a', 'c/a', 'z2', '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:
['4.7491', '1.7235055', '1.8103009', '0.63889715', '0.41550114', '0.94700885', '0.19965341', '0.64578714', '0.93695194', '0.34105637']
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.         0.         0.        ]
 [0.25       0.25       0.63889715]
 [0.41550114 0.94700885 0.19965341]
 [0.64578714 0.93695194 0.34105637]]
spacegroup =  56
cell =  [[4.7491, 0, 0], [0, 8.1851, 0], [0, 0, 8.5973]]
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