Geometry

Info

ID:

5358

ICSD:

246245

Name:

Calcium ferrate(II)

Comp.:

Ca1Fe1O2

Symm.:

 P-421m(113)

Latt.:

 tetragonal

Spin:

 7.777

Eg/Eg':

1.381/None eV

me/mh:

5.049/-12.189

K-data

high symmetry path:

G - X - M - G - Z - R - A - Z

high symmetry points:

A: 0.5 0.5 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.0 R: 0.0 0.5 0.5 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands