Geometry

Info

ID:

8778

ICSD:

20157

Name:

Trisodium hexafluoroferrate(III)

Comp.:

F6Fe1Na3

Symm.:

P1211(4)

Latt.:

monoclinic

Spin:

9.815

Eg/Eg':

6.083/None eV

me/mh:

-29.237/-271.122

K-data

high symmetry path:

G - Z - C - Y - G - B - D - E0 - A0 - Y

high symmetry points:

G: 0.0 0.0 0.0 C: 0.5 0.5 0.0 B: 0.0 0.0 0.5 D: 0.0 0.5 0.5 A0: 0.5 0.0 0.5 Y: 0.5 0.0 0.0 Z: 0.0 0.5 0.0 E0: 0.5 0.5 0.5

DOS

Bands