Geometry

Info

ID:

7821

ICSD:

195375

Name:

Distrontium copper iron trioxide sulfide

Comp.:

Cu1Fe1O3S1Sr2

Symm.:

P4/nmmZ(129)

Latt.:

tetragonal

Spin:

9.668

Eg/Eg':

1.546/None eV

me/mh:

2.883/-7.834

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