Geometry

Info

ID:

12548

ICSD:

643974

Name:

Sodium molybdenum selenide (1/3/3)

Comp.:

Mo3Na1Se3

Symm.:

 P63/m(176)

Latt.:

 hexagonal

Spin:

 0.000

Eg/Eg':

1.407/0.910 eV

me/mh:

51.961/-4.800

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