Geometry

Info

ID:

12741

ICSD:

415072

Name:

Sodium nickel dioxide

Comp.:

Na1Ni1O2

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 2.078

Eg/Eg':

0.532/0.230 eV

me/mh:

110.175/13.532

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