Geometry

Info

ID:

837

ICSD:

15910

Name:

Aluminium tetrathiophosphate(V)

Comp.:

Al1P1S4

Symm.:

P222(16)

Latt.:

orthorhombic

Spin:

0.000

Eg/Eg':

2.892/2.757 eV

me/mh:

28.793/None

K-data

high symmetry path:

G - Z - T - Y - S - R - U - X - G - Y

high symmetry points:

G: 0.0 0.0 0.0 S: -0.5 0.5 0.0 R: -0.5 0.5 0.5 U: 0.0 0.5 0.5 T: -0.5 0.0 0.5 Y: -0.5 0.0 0.0 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands