Geometry

Info

ID:

9023

ICSD:

391306

Name:

Iron tetralanthanum oxohexaselenide

Comp.:

Fe1La4O1Se6

Symm.:

P63mc(186)

Latt.:

hexagonal

Spin:

0.033

Eg/Eg':

2.198/2.133 eV

me/mh:

84.187/None

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