element(s):
['O', 'Si']
AFLOW prototype label:
A2B_hR72_148_8f_4f
Parameter names:
['a', 'c/a', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4', 'x5', 'y5', 'z5', 'x6', 'y6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', '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:
['13.794229', '1.434787', '0.85893138', '0.22979394', '0.11991875', '0.75467824', '0.29022042', '0.40040932', '0.73596048', '0.94768126', '0.89719171', '0.75960952', '0.041023857', '0.33359589', '0.84471815', '0.51843482', '0.43865797', '0.70571111', '0.44872596', '0.061254388', '0.98092357', '0.34918425', '0.28372019', '0.61326156', '0.24118526', '0.21965969', '0.99737508', '0.23783748', '0.17967101', '0.67143124', '0.18054872', '0.35784479', '0.88150258', '0.36337612', '0.41793163', '0.71060037', '0.28965427', '0.090649953']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.45605002 0.28296261 0.40288136]
 [0.27290891 0.08136001 0.48176933]
 [0.87568266 0.96308611 0.86027782]
 [0.3815331  0.04448053 0.37807642]
 [0.2441145  0.16194568 0.60060365]
 [0.30048062 0.3439761  0.40523049]
 [0.4429809  0.25422248 0.53794267]
 [0.25522606 0.13837581 0.3580355 ]
 [0.52574722 0.29195685 0.47162786]
 [0.26815632 0.04543013 0.40327492]
 [0.32723247 0.13633848 0.55427011]
 [0.34696551 0.27298491 0.36363486]]
spacegroup =  148
cell =  [[13.7942, 0, 0], [-6.8971, 11.946127624883, 0], [0, 0, 19.7918]]
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