Geometry

Info

ID:

13733

ICSD:

18307

Name:

Oxovanadium(IV) sulfate(VI) - alpha

Comp.:

O5S1V1

Symm.:

 P4/nS(85)

Latt.:

 tetragonal

Spin:

 1.929

Eg/Eg':

2.270/2.124 eV

me/mh:

78.871/-51.676

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