Geometry

Info

ID:

12859

ICSD:

50376

Name:

Disodium phyllo-vanado(IV)diphosphate(V)

Comp.:

Na2O8P2V1

Symm.:

P4bm(100)

Latt.:

tetragonal

Spin:

1.916

Eg/Eg':

2.831/None eV

me/mh:

-109.087/616.023

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