Geometry

Info

ID:

13513

ICSD:

22303

Name:

Vanadium(IV) oxide

Comp.:

O2V1

Symm.:

 Pbnm(62)

Latt.:

 orthorhombic

Spin:

 3.868

Eg/Eg':

1.212/1.128 eV

me/mh:

15.192/-53.187

K-data

high symmetry path:

G - Z - T - Y - S - R - U - X - G - Y

high symmetry points:

G: 0.0 0.0 0.0 S: -0.5 0.5 0.0 R: -0.5 0.5 0.5 U: 0.0 0.5 0.5 T: -0.5 0.0 0.5 Y: -0.5 0.0 0.0 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands