Geometry

Info

ID:

3658

ICSD:

37162

Name:

Tribarium strontium ditantalum oxide

Comp.:

Ba3O9Sr1Ta2

Symm.:

P63/m(176)

Latt.:

hexagonal

Spin:

0.000

Eg/Eg':

3.998/None eV

me/mh:

9.891/-29.621

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