Geometry

Info

ID:

3278

ICSD:

290230

Name:

Barium titanium cyclo-trisilicate

Comp.:

Ba1O9Si3Ti1

Symm.:

P-6c2(188)

Latt.:

hexagonal

Spin:

0.000

Eg/Eg':

3.090/3.068 eV

me/mh:

124.293/-11.341

K-data

high symmetry path:

G - A - L - M - G - K - H - A

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 H: -0.333 0.667 0.5 K: -0.333 0.667 0.0 M: 0.0 0.5 0.0 L: 0.0 0.5 0.5

DOS

Bands