Geometry

Info

ID:

8664

ICSD:

97453

Name:

Trisodium molybdenum trioxide trifluoride

Comp.:

F3Mo1Na3O3

Symm.:

R3R(146)

Latt.:

rhombohedral

Spin:

0.000

Eg/Eg':

4.310/4.166 eV

me/mh:

206.124/-3023.937

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands