Geometry

Info

ID:

3393

ICSD:

67395

Name:

Dibarium copper(I) dioxide bromide

Comp.:

Ba2Br1Cu1O2

Symm.:

 R-3mH(166)

Latt.:

 rhombohedral

Spin:

 0.000

Eg/Eg':

2.384/2.209 eV

me/mh:

-52.745/128.986

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands