element(s):
['O', 'Si']
AFLOW prototype label:
A2B_oC72_63_def3g_2c2g
Parameter names:
['a', 'b/a', 'c/a', 'y1', 'y2', 'x4', 'y5', 'z5', 'x6', 'y6', 'x7', 'y7', 'x8', 'y8', 'x9', 'y9', 'x10', 'y10']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['14.1001', '1.2709342', '0.37459309', '0.38053741', '0.72420645', '0.73276095', '0.32844391', '0.9994081', '0.40656221', '0.93327103', '0.59187686', '0.27839884', '0.22975944', '0.876952', '0.29368312', '0.95204216', '0.7059022', '0.28869502']
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', 'Si', 'Si', 'Si', 'Si']
representative atom coordinates =  [[0.25       0.25       0.        ]
 [0.73276095 0.         0.        ]
 [0.         0.32844391 0.9994081 ]
 [0.40656221 0.93327103 0.25      ]
 [0.59187686 0.27839884 0.25      ]
 [0.22975944 0.876952   0.25      ]
 [0.         0.38053741 0.25      ]
 [0.         0.72420645 0.25      ]
 [0.29368312 0.95204216 0.25      ]
 [0.7059022  0.28869502 0.25      ]]
spacegroup =  63
cell =  [[14.1001, 0, 0], [0, 17.9203, 0], [0, 0, 5.2818]]
=========================================