Geometry

Info

ID:

9085

ICSD:

632802

Name:

Iron niobium sulfide (1/3/6)

Comp.:

Fe1Nb3S6

Symm.:

 P6322(182)

Latt.:

 hexagonal

Spin:

 1.893

Eg/Eg':

0.223/0.077 eV

me/mh:

-39.690/-14.681

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