Geometry

Info

ID:

7744

ICSD:

62225

Name:

Tricesium tetraoxotetramolybdenum tris(phosphate(V))

Comp.:

Cs3Mo4O16P3

Symm.:

 P-43m(215)

Latt.:

 cubic

Spin:

 1.996

Eg/Eg':

2.098/2.098 eV

me/mh:

-53.423/-279.677

K-data

high symmetry path:

G - M - R - X - G - R

high symmetry points:

G: 0.0 0.0 0.0 R: 0.5 0.5 0.5 M: 0.5 0.5 0.0 X: 0.0 0.5 0.0

DOS

Bands