Geometry

Info

ID:

5661

ICSD:

166533

Name:

Dicalcium phosphide iodide

Comp.:

Ca2I1P1

Symm.:

R-3mH(166)

Latt.:

rhombohedral

Spin:

0.000

Eg/Eg':

1.970/1.719 eV

me/mh:

4.471/-14.195

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands