Geometry

Info

ID:

6387

ICSD:

63329

Name:

Iron(III) chloride

Comp.:

Cl3Fe1

Symm.:

 R-3H(148)

Latt.:

 rhombohedral

Spin:

 28.104

Eg/Eg':

5.435/None eV

me/mh:

5.087/-23.545

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands