Geometry

Info

ID:

5335

ICSD:

656449

Name:

Calcium difluoride

Comp.:

Ca1F2

Symm.:

Pnma(62)

Latt.:

orthorhombic

Spin:

0.000

Eg/Eg':

7.582/None eV

me/mh:

-1694.197/-316.582

K-data

high symmetry path:

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

high symmetry points:

G: 0.0 0.0 0.0 S: -0.5 0.5 0.0 R: -0.5 0.5 0.5 U: 0.0 0.5 0.5 T: -0.5 0.0 0.5 Y: -0.5 0.0 0.0 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands