Geometry

Info

ID:

5461

ICSD:

189134

Name:

Calcium manganate(IV)

Comp.:

Ca1Mn1O3

Symm.:

 Pnma(62)

Latt.:

 orthorhombic

Spin:

 11.818

Eg/Eg':

0.471/None eV

me/mh:

-18.829/258.109

K-data

high symmetry path:

G - Z - T - Y - S - R - U - X - G - Y

high symmetry points:

G: 0.0 0.0 0.0 S: -0.5 0.5 0.0 R: -0.5 0.5 0.5 U: 0.0 0.5 0.5 T: -0.5 0.0 0.5 Y: -0.5 0.0 0.0 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands