Geometry

Info

ID:

6430

ICSD:

60261

Name:

Rubidium nickel trichloride

Comp.:

Cl3Ni1Rb1

Symm.:

P63/mmc(194)

Latt.:

hexagonal

Spin:

3.743

Eg/Eg':

4.051/None eV

me/mh:

-75.895/51.285

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