element(s):
['O', 'Si']
AFLOW prototype label:
A2B_oC108_63_acd2fg2h_cfgh
Parameter names:
['a', 'b/a', 'c/a', 'y2', 'y3', 'y5', 'z5', 'y6', 'z6', 'y7', 'z7', 'x8', 'y8', 'x9', 'y9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['7.5665', '2.5181788', '1.866768', '0.26200049', '0.86030297', '0.65544236', '0.46365388', '0.91053845', '0.34461499', '0.92039629', '0.46057213', '0.17435447', '0.80899331', '0.29342561', '0.73743129', '0.25168176', '0.68617247', '0.33880011', '0.32207365', '0.61503488', '0.49711501', '0.20572012', '0.6763121', '0.44978242']
model name:
Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.         0.26200049 0.25      ]
 [0.25       0.25       0.        ]
 [0.         0.65544236 0.46365388]
 [0.         0.91053845 0.34461499]
 [0.67435447 0.30899331 0.25      ]
 [0.75168176 0.18617247 0.33880011]
 [0.82207365 0.11503488 0.49711501]
 [0.         0.86030297 0.25      ]
 [0.         0.92039629 0.46057213]
 [0.79342561 0.23743129 0.25      ]
 [0.70572012 0.1763121  0.44978242]]
spacegroup =  63
cell =  [[7.5665, 0, 0], [0, 19.0538, 0], [0, 0, 14.1249]]
=========================================