Geometry

Info

ID:

11953

ICSD:

71421

Name:

Dilithium nickel oxide - 1T

Comp.:

Li2Ni1O2

Symm.:

 P-3m1(164)

Latt.:

 hexagonal

Spin:

 1.969

Eg/Eg':

4.146/3.973 eV

me/mh:

1.038/-12.732

K-data

high symmetry path:

G - A - L - M - G - K - H - A

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 H: -0.333 0.667 0.5 K: -0.333 0.667 0.0 M: 0.0 0.5 0.0 L: 0.0 0.5 0.5

DOS

Bands