Geometry

Info

ID:

3632

ICSD:

415918

Name:

Tribarium nonaoxotetranitridosilicate

Comp.:

Ba3N4O9Si6

Symm.:

P3(143)

Latt.:

hexagonal

Spin:

0.000

Eg/Eg':

4.646/4.403 eV

me/mh:

33.568/-51.568

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