Geometry

Info

ID:

3225

ICSD:

78170

Name:

Barium divanadium(III) bis(diphosphate) - beta

Comp.:

Ba1O14P4V2

Symm.:

P-1(2)

Latt.:

triclinic

Spin:

3.765

Eg/Eg':

2.145/2.092 eV

me/mh:

-1977.295/105.227

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