Geometry

Info

ID:

5223

ICSD:

169759

Name:

Palladium zinc tetracyanide

Comp.:

C4N4Pd1Zn1

Symm.:

 P42/mcm(132)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

4.252/4.176 eV

me/mh:

-85.834/-220.743

K-data

high symmetry path:

G - X - M - G - Z - R - A - Z

high symmetry points:

A: 0.5 0.5 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.0 R: 0.0 0.5 0.5 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands