Geometry

Info

ID:

7801

ICSD:

27689

Name:

Potassium trifluorocuprate

Comp.:

Cu1F3K1

Symm.:

 P4/mmm(123)

Latt.:

 tetragonal

Spin:

 0.993

Eg/Eg':

5.839/4.003 eV

me/mh:

3.193/66.355

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