Geometry

Info

ID:

5174

ICSD:

23882

Name:

Trimagnesium calcium carbonate

Comp.:

C4Ca1Mg3O12

Symm.:

 R32R(155)

Latt.:

 rhombohedral

Spin:

 0.000

Eg/Eg':

4.945/4.932 eV

me/mh:

306.927/-1058.968

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