Geometry

Info

ID:

4071

ICSD:

1142

Name:

Tricesium nonabromodibismuthate(III)

Comp.:

Bi2Br9Cs3

Symm.:

P-3m1(164)

Latt.:

hexagonal

Spin:

0.003

Eg/Eg':

2.595/None eV

me/mh:

-77.865/-21.704

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