Geometry

Info

ID:

7768

ICSD:

410387

Name:

Hexacesium hexairon fluoride

Comp.:

Cs6F18Fe6

Symm.:

 P63/mmc(194)

Latt.:

 hexagonal

Spin:

 23.403

Eg/Eg':

4.541/4.537 eV

me/mh:

2.260/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