element(s):
['O', 'Si']
AFLOW prototype label:
A2B_mC96_12_4i6j_2i3j
Parameter names:
['a', 'b/a', 'c/a', 'beta', 'x1', 'z1', 'x2', 'z2', 'x3', 'z3', 'x4', 'z4', 'x5', 'z5', 'x6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14', 'x15', 'y15', 'z15']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['19.3472', '0.97092086', '0.28175136', '83.0987', '0.51795616', '0.2830057', '0.82319391', '0.7979883', '0.016632632', '0.28310881', '0.67376256', '0.8672251', '0.55868987', '0.53573905', '0.94121748', '0.46175961', '0.39209395', '0.57148861', '0.44314462', '0.31846241', '0.35556756', '0.8281281', '0.2504042', '0.72640409', '0.20314943', '0.10621322', '0.57167318', '0.56324248', '0.17887551', '0.64470287', '0.88981277', '0.24811723', '0.42187112', '0.51649826', '0.32154029', '0.57584284', '0.64236652', '0.24896125', '0.69173278', '0.92189502', '0.1751813', '0.42461072', '0.70969088']
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', 'O', 'O', 'Si', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.48204384 0.         0.7169943 ]
 [0.17680609 0.         0.2020117 ]
 [0.98336737 0.         0.71689119]
 [0.32623744 0.         0.1327749 ]
 [0.10790605 0.07148861 0.55685538]
 [0.18153759 0.85556756 0.1718719 ]
 [0.2495958  0.22640409 0.79685057]
 [0.39378678 0.07167318 0.43675752]
 [0.32112449 0.14470287 0.11018723]
 [0.25188277 0.92187112 0.48350174]
 [0.44131013 0.         0.46426095]
 [0.05878252 0.         0.53824039]
 [0.17845971 0.07584284 0.35763348]
 [0.25103875 0.19173278 0.07810498]
 [0.3248187  0.92461072 0.29030912]]
spacegroup =  12
cell =  [[19.3472, 0, 0], [0, 18.7846, 0], [0.65500070775561, 0, 5.4116046864899]]
=========================================