Geometry

Info

ID:

3432

ICSD:

6133

Name:

Dibarium chromate(IV)

Comp.:

Ba2Cr1O4

Symm.:

 Pn21a(33)

Latt.:

 orthorhombic

Spin:

 7.687

Eg/Eg':

1.915/None eV

me/mh:

17.013/-36.500

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