Geometry

Info

ID:

2768

ICSD:

27872

Name:

Tetraboron(I) chloride

Comp.:

B4Cl4

Symm.:

P42/nmcS(137)

Latt.:

tetragonal

Spin:

0.000

Eg/Eg':

3.335/3.317 eV

me/mh:

-166.636/141.050

K-data

high symmetry path:

G - X - M - G - Z - R - A - Z

high symmetry points:

A: 0.5 0.5 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.0 R: 0.0 0.5 0.5 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands