Geometry

Info

ID:

6601

ICSD:

410101

Name:

Trichloroselenium tetrachlorooxomolybdate(V) - beta

Comp.:

Cl7Mo1O1Se1

Symm.:

P-1(2)

Latt.:

triclinic

Spin:

1.918

Eg/Eg':

2.368/2.365 eV

me/mh:

551.933/199.157

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