Geometry

Info

ID:

12043

ICSD:

62137

Name:

Hexalithium zincate

Comp.:

Li6O4Zn1

Symm.:

 P42/nmcZ(137)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

3.603/None eV

me/mh:

-136.145/-163.812

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