Geometry

Info

ID:

11964

ICSD:

291154

Name:

Dilithium zirconium trioxide

Comp.:

Li2O3Zr1

Symm.:

 C12/c1(15)

Latt.:

 monoclinic

Spin:

 0.000

Eg/Eg':

4.236/None eV

me/mh:

-71.509/223.064

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