Geometry

Info

ID:

7508

ICSD:

260887

Name:

Cesium iron(III) bis(molybdate)

Comp.:

Cs1Fe1Mo2O8

Symm.:

P-3m1(164)

Latt.:

hexagonal

Spin:

0.946

Eg/Eg':

2.880/2.696 eV

me/mh:

365.183/-31.811

K-data

high symmetry path:

G - A - L - M - G - K - H - A

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 H: -0.333 0.667 0.5 K: -0.333 0.667 0.0 M: 0.0 0.5 0.0 L: 0.0 0.5 0.5

DOS

Bands