Geometry

Info

ID:

3626

ICSD:

239731

Name:

Tribarium manganese(II) diniobate

Comp.:

Ba3Mn1Nb2O9

Symm.:

P-3m1(164)

Latt.:

hexagonal

Spin:

4.802

Eg/Eg':

2.281/2.079 eV

me/mh:

6.516/86.109

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