Geometry

Info

ID:

5201

ICSD:

280028

Name:

Zinc mercury thiocyanate

Comp.:

C4Hg1N4S4Zn1

Symm.:

 I-4(82)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

2.611/2.455 eV

me/mh:

278.943/-64.204

K-data

high symmetry path:

G - X - P - N - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: -0.5 0.5 0.5 N: 0.0 0.5 0.0 P: 0.25 0.25 0.25 X: 0.0 0.0 0.5

DOS

Bands