Geometry

Info

ID:

5685

ICSD:

24847

Name:

Dicalcium trimanganese(IV) oxide

Comp.:

Ca2Mn3O8

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 17.785

Eg/Eg':

1.636/1.498 eV

me/mh:

26.004/-111.759

K-data

high symmetry path:

G - Y - V - G - A - M - L - V

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.5 L: 0.5 0.0 0.5 V: 0.5 0.0 0.0 Y: 0.5 0.5 0.0

DOS

Bands