Geometry

Info

ID:

5617

ICSD:

153101

Name:

Dicalcium nitride chloride

Comp.:

Ca2Cl1N1

Symm.:

 R-3mH(166)

Latt.:

 rhombohedral

Spin:

 0.000

Eg/Eg':

2.468/None eV

me/mh:

-23.545/-47.457

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands