Geometry

Info

ID:

13252

ICSD:

73837

Name:

Strontium dinickel phosphate

Comp.:

Ni2O8P2Sr1

Symm.:

P-1(2)

Latt.:

triclinic

Spin:

7.855

Eg/Eg':

4.501/4.438 eV

me/mh:

60.869/108.884

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