Geometry

Info

ID:

7161

ICSD:

78778

Name:

Chromium(IV) fluoride

Comp.:

Cr1F4

Symm.:

P42/mnm(136)

Latt.:

tetragonal

Spin:

7.875

Eg/Eg':

1.769/1.735 eV

me/mh:

768.327/-120.963

K-data

high symmetry path:

G - X - M - G - Z - R - A - Z

high symmetry points:

A: 0.5 0.5 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.0 R: 0.0 0.5 0.5 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands