Geometry

Info

ID:

5457

ICSD:

411175

Name:

Calcium dimagnesium nitride

Comp.:

Ca1Mg2N2

Symm.:

 P-3m1(164)

Latt.:

 hexagonal

Spin:

 0.000

Eg/Eg':

1.981/None eV

me/mh:

104.738/-4.150

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