Geometry

Info

ID:

3461

ICSD:

65611

Name:

Comp.:

Ba2F18Ni7

Symm.:

 P-1(2)

Latt.:

 triclinic

Spin:

 11.882

Eg/Eg':

4.999/4.975 eV

me/mh:

223.886/1727.918

K-data

high symmetry path:

G - Z - T - Y - G - X - V - R - U

high symmetry points:

G: 0.0 0.0 0.0 R: 0.5 0.5 0.5 U: 0.5 0.0 0.5 T: 0.0 0.5 0.5 V: 0.5 0.5 0.0 Y: 0.0 0.5 0.0 X: 0.5 0.0 0.0 Z: 0.0 0.0 0.5

DOS

Bands