Geometry

Info

ID:

13512

ICSD:

1502

Name:

Vanadium(IV) oxide - Al-doped

Comp.:

O2V1

Symm.:

 P-1(2)

Latt.:

 triclinic

Spin:

 3.797

Eg/Eg':

1.235/1.214 eV

me/mh:

1575.998/-24.435

K-data

high symmetry path:

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

high symmetry points:

G: 0.0 0.0 0.0 R: 0.5 0.5 0.5 U: 0.5 0.0 0.5 T: 0.0 0.5 0.5 V: 0.5 0.5 0.0 Y: 0.0 0.5 0.0 X: 0.5 0.0 0.0 Z: 0.0 0.0 0.5

DOS

Bands