Geometry

Info

ID:

910

ICSD:

56735

Name:

Barium bis(tetrachloroaluminate)

Comp.:

Al2Ba1Cl8

Symm.:

P12/a1(13)

Latt.:

monoclinic

Spin:

0.000

Eg/Eg':

5.345/5.336 eV

me/mh:

8.589/-34.291

K-data

high symmetry path:

G - Z - C - Y - G - B - D - E0 - A0 - Y

high symmetry points:

G: 0.0 0.0 0.0 C: 0.5 0.5 0.0 B: 0.0 0.0 0.5 D: 0.0 0.5 0.5 A0: 0.5 0.0 0.5 Y: 0.5 0.0 0.0 Z: 0.0 0.5 0.0 E0: 0.5 0.5 0.5

DOS

Bands