Geometry

Info

ID:

5621

ICSD:

160557

Name:

Calcium cobalt oxide (2/1/3)

Comp.:

Ca2Co1O3

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 5.836

Eg/Eg':

1.855/1.362 eV

me/mh:

-49.470/-10.572

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