Geometry

Info

ID:

6269

ICSD:

66645

Name:

Copper chloride

Comp.:

Cl2Cu1

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 1.824

Eg/Eg':

4.122/None eV

me/mh:

6.632/-13.640

K-data

high symmetry path:

G - Y - V - G - A - M - L - V

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.5 L: 0.5 0.0 0.5 V: 0.5 0.0 0.0 Y: 0.5 0.5 0.0

DOS

Bands