Geometry

Info

ID:

7954

ICSD:

174134

Name:

Dilithium copper(II) oxide

Comp.:

Cu1Li2O2

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 1.899

Eg/Eg':

2.843/2.823 eV

me/mh:

-499.605/-16.909

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