Geometry

Info

ID:

7272

ICSD:

109366

Name:

Chromium(VI) oxide

Comp.:

Cr1O3

Symm.:

 C2cm(40)

Latt.:

 orthorhombic

Spin:

 0.000

Eg/Eg':

2.419/2.378 eV

me/mh:

-1052.996/33.458

K-data

high symmetry path:

R - S - G - Z - T - Y - G

high symmetry points:

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

DOS

Bands