Geometry

Info

ID:

9269

ICSD:

61069

Name:

Diiron trimolybdate(IV)

Comp.:

Fe2Mo3O8

Symm.:

 P63mc(186)

Latt.:

 hexagonal

Spin:

 15.459

Eg/Eg':

0.193/0.078 eV

me/mh:

6.587/-66.572

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