Geometry

Info

ID:

7752

ICSD:

50444

Name:

Tetracesium copper disilicate

Comp.:

Cs4Cu1O7Si2

Symm.:

P-1(2)

Latt.:

triclinic

Spin:

0.942

Eg/Eg':

1.772/1.662 eV

me/mh:

-2267.930/90.007

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