Geometry

Info

ID:

12717

ICSD:

194368

Name:

Sodium-0.5 dioxovanadate(III/IV)

Comp.:

Na0.5O2V1

Symm.:

 PmmnZ(59)

Latt.:

 orthorhombic

Spin:

 11.423

Eg/Eg':

0.981/None eV

me/mh:

-86.545/65.509

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