Geometry

Info

ID:

1853

ICSD:

280027

Name:

Lithium barium arsenide (4/3/4)

Comp.:

As4Ba3Li4

Symm.:

 Immm(71)

Latt.:

 orthorhombic

Spin:

 0.000

Eg/Eg':

0.396/0.288 eV

me/mh:

-19.488/15.134

K-data

high symmetry path:

R - G - X - S - W - T

high symmetry points:

G: 0.0 0.0 0.0 S: 0.5 0.0 -0.5 R: 0.5 0.0 0.0 T: 0.5 -0.5 0.0 W: 0.75 -0.25 -0.25 X: 0.5 0.5 -0.5

DOS

Bands