element(s):
['O', 'Si']
AFLOW prototype label:
A2B_mC96_12_g3i6j_4j
Parameter names:
['a', 'b/a', 'c/a', 'beta', 'y1', 'x2', 'z2', 'x3', 'z3', 'x4', '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', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['18.8405', '0.72639261', '0.41057828', '78.437', '0.37265757', '0.5328172', '0.23191263', '0.34443548', '0.45729557', '0.7751963', '0.85427212', '0.43712543', '0.85701395', '0.33642078', '0.57549791', '0.81489625', '0.23453146', '0.32022452', '0.82043186', '0.5795566', '0.70982395', '0.86790756', '0.080947295', '0.30775191', '0.86123763', '0.25043833', '0.3202905', '0.31728785', '0.82179489', '0.51139157', '0.88646785', '0.2002996', '0.3520987', '0.88485661', '0.40507633', '0.7492024', '0.88674477', '0.87640084', '0.66119978', '0.79683108', '0.22773678']
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']
representative atom coordinates =  [[0.         0.37265757 0.        ]
 [0.4671828  0.         0.76808737]
 [0.65556452 0.         0.54270443]
 [0.2248037  0.         0.14572788]
 [0.56287457 0.85701395 0.66357922]
 [0.42450209 0.81489625 0.76546854]
 [0.67977548 0.82043186 0.4204434 ]
 [0.29017605 0.86790756 0.91905271]
 [0.69224809 0.86123763 0.74956167]
 [0.6797095  0.31728785 0.17820511]
 [0.48860843 0.88646785 0.7997004 ]
 [0.6479013  0.88485661 0.59492367]
 [0.2507976  0.88674477 0.12359916]
 [0.33880022 0.79683108 0.77226322]]
spacegroup =  12
cell =  [[18.8405, 0, 0], [0, 13.6856, 0], [1.550544596244, 0, 7.5785072214163]]
=========================================