Geometry

Info

ID:

4398

ICSD:

202822

Name:

Niobium(IV) diselenide bromide - High Temperature

Comp.:

Br2Nb1Se2

Symm.:

C12/m1(12)

Latt.:

monoclinic

Spin:

0.000

Eg/Eg':

1.008/0.977 eV

me/mh:

-96.677/2436.343

K-data

high symmetry path:

G - Y - V - G - A - M - L - V

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.5 L: 0.5 0.0 0.5 V: 0.5 0.0 0.0 Y: 0.5 0.5 0.0

DOS

Bands