Geometry

Info

ID:

13889

ICSD:

62230

Name:

Lead phosphorus triselenide

Comp.:

P1Pb1Se3

Symm.:

P121/n1(14)

Latt.:

monoclinic

Spin:

0.000

Eg/Eg':

1.829/1.765 eV

me/mh:

11.701/6647.759

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