Geometry

Info

ID:

2309

ICSD:

150328

Name:

Tribarium borate phosphate(V)

Comp.:

B1Ba3O7P1

Symm.:

P63mc(186)

Latt.:

hexagonal

Spin:

0.000

Eg/Eg':

3.337/None eV

me/mh:

10.134/-8.838

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