Geometry

Info

ID:

12231

ICSD:

39504

Name:

Disodium manganate(VI)

Comp.:

Mn1Na2O4

Symm.:

P63mc(186)

Latt.:

hexagonal

Spin:

1.992

Eg/Eg':

0.084/0.060 eV

me/mh:

360.537/-192.534

K-data

high symmetry path:

G - A - L - M - G - K - H - A

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 H: -0.333 0.667 0.5 K: -0.333 0.667 0.0 M: 0.0 0.5 0.0 L: 0.0 0.5 0.5

DOS

Bands