Geometry

Info

ID:

3815

ICSD:

413357

Name:

Dicalcium tetranitridotetraberyllate

Comp.:

Be4Ca2N4

Symm.:

 I4/mcm(140)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

2.551/2.524 eV

me/mh:

14.654/-17.987

K-data

high symmetry path:

G - X - P - N - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 -0.5 N: 0.0 0.5 0.0 P: 0.25 0.25 0.25 X: 0.0 0.0 0.5

DOS

Bands