Geometry

Info

ID:

7666

ICSD:

423923

Name:

Dicesium nickel dioxide

Comp.:

Cs2Ni1O2

Symm.:

 I4/mmm(139)

Latt.:

 tetragonal

Spin:

 3.947

Eg/Eg':

2.846/2.798 eV

me/mh:

11.549/-11.004

K-data

high symmetry path:

G - X - P - N - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 -0.5 N: 0.0 0.5 0.0 P: 0.25 0.25 0.25 X: 0.0 0.0 0.5

DOS

Bands