Geometry

Info

ID:

8327

ICSD:

50541

Name:

Dipotassium tricopper tetrakis(selenate(IV))

Comp.:

Cu3K2O12Se4

Symm.:

P-1(2)

Latt.:

triclinic

Spin:

0.930

Eg/Eg':

0.614/0.606 eV

me/mh:

56.368/-108.565

K-data

high symmetry path:

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

high symmetry points:

G: 0.0 0.0 0.0 R: 0.5 0.5 0.5 U: 0.5 0.0 0.5 T: 0.0 0.5 0.5 V: 0.5 0.5 0.0 Y: 0.0 0.5 0.0 X: 0.5 0.0 0.0 Z: 0.0 0.0 0.5

DOS

Bands