Geometry

Info

ID:

6191

ICSD:

59936

Name:

Lithium chlorate(III)

Comp.:

Cl1Li1O2

Symm.:

 P42/ncmZ(138)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

2.638/None eV

me/mh:

23.930/-30.307

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