Geometry

Info

ID:

5149

ICSD:

101

Name:

Rubidium tris(thiocyanato)mercurate

Comp.:

C3Hg1N3Rb1S3

Symm.:

P121/m1(11)

Latt.:

monoclinic

Spin:

0.000

Eg/Eg':

2.150/2.117 eV

me/mh:

17.443/-13.911

K-data

high symmetry path:

G - Z - C - Y - G - B - D - E0 - A0 - Y

high symmetry points:

G: 0.0 0.0 0.0 C: 0.5 0.5 0.0 B: 0.0 0.0 0.5 D: 0.0 0.5 0.5 A0: 0.5 0.0 0.5 Y: 0.5 0.0 0.0 Z: 0.0 0.5 0.0 E0: 0.5 0.5 0.5

DOS

Bands