Geometry

Info

ID:

4543

ICSD:

22140

Name:

Phosphorus(V) bromide

Comp.:

Br5P1

Symm.:

 Pbcm(57)

Latt.:

 orthorhombic

Spin:

 0.000

Eg/Eg':

1.764/1.683 eV

me/mh:

45.432/-6259.155

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