Geometry

Info

ID:

5514

ICSD:

31864

Name:

Calcium titanate

Comp.:

Ca1O3Ti1

Symm.:

Cmmm(65)

Latt.:

cubic

Spin:

0.000

Eg/Eg':

2.226/2.073 eV

me/mh:

-46.795/213.741

K-data

high symmetry path:

G - M - R - X - G - R

high symmetry points:

G: 0.0 0.0 0.0 R: 0.5 0.5 0.5 M: 0.5 0.5 0.0 X: 0.0 0.5 0.0

DOS

Bands