Geometry

Info

ID:

5188

ICSD:

85619

Name:

Cobalt bis(dicyanamide)

Comp.:

C4Co1N6

Symm.:

Pnnm(58)

Latt.:

orthorhombic

Spin:

5.790

Eg/Eg':

4.352/4.322 eV

me/mh:

-107.175/4545.938

K-data

high symmetry path:

G - Z - T - Y - S - R - U - X - G - Y

high symmetry points:

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

DOS

Bands