Geometry

Info

ID:

6606

ICSD:

67743

Name:

Pentalithium chromium chloride

Comp.:

Cl8Cr1Li5

Symm.:

 Cmmm(65)

Latt.:

 orthorhombic

Spin:

 5.583

Eg/Eg':

2.065/2.025 eV

me/mh:

-1996.773/-54.031

K-data

high symmetry path:

R - S - G - Z - T - Y - G

high symmetry points:

G: 0.0 0.0 0.0 S: 0.0 0.5 0.0 R: 0.0 0.5 0.5 T: -0.5 0.5 0.5 Y: -0.5 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands