Geometry

Info

ID:

4281

ICSD:

31690

Name:

Bromine(V) fluoride

Comp.:

Br1F5

Symm.:

 Cmc21(36)

Latt.:

 orthorhombic

Spin:

 0.000

Eg/Eg':

3.484/3.437 eV

me/mh:

408.048/-41.649

K-data

high symmetry path:

R - S - G - Z - T - Y - G

high symmetry points:

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

DOS

Bands