Geometry

Info

ID:

2395

ICSD:

88453

Name:

Iron iron(III) oxide borate - LT

Comp.:

B1Fe2O4

Symm.:

P121/c1(14)

Latt.:

monoclinic

Spin:

35.201

Eg/Eg':

3.497/None eV

me/mh:

3.131/-8.797

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