Geometry

Info

ID:

13417

ICSD:

173933

Name:

Oxygen - alpha

Comp.:

O2

Symm.:

C12/m1(12)

Latt.:

monoclinic

Spin:

3.252

Eg/Eg':

6.940/None eV

me/mh:

24.177/-85.888

K-data

high symmetry path:

G - Y - V - G - A - M - L - V

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.5 L: 0.5 0.0 0.5 V: 0.5 0.0 0.0 Y: 0.5 0.5 0.0

DOS

Bands