Geometry

Info

ID:

4276

ICSD:

39441

Name:

Bromine(III) fluoride

Comp.:

Br1F3

Symm.:

Cmc21(36)

Latt.:

orthorhombic

Spin:

0.000

Eg/Eg':

2.317/None eV

me/mh:

83.854/183.052

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