Geometry

Info

ID:

7382

ICSD:

16720

Name:

Chromium sulfide (2/3)

Comp.:

Cr2S3

Symm.:

P-31c(163)

Latt.:

hexagonal

Spin:

18.729

Eg/Eg':

0.156/0.006 eV

me/mh:

8.479/-12.438

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