Geometry

Info

ID:

6362

ICSD:

2064

Name:

Cesium copper chloride

Comp.:

Cl3Cs1Cu1

Symm.:

 P63mc(186)

Latt.:

 hexagonal

Spin:

 1.822

Eg/Eg':

4.245/None eV

me/mh:

503.089/78.928

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