Geometry

Info

ID:

2733

ICSD:

400339

Name:

Lithium tetracalcium tris(dinitridoborate)

Comp.:

B3Ca4Li1N6

Symm.:

 Im-3m(229)

Latt.:

 cubic

Spin:

 0.000

Eg/Eg':

2.201/None eV

me/mh:

3.108/-6.123

K-data

high symmetry path:

G - P - N - G - H - P | H - N

high symmetry points:

G: 0.0 0.0 0.0 N: 0.0 0.0 0.5 H: 0.5 -0.5 0.5 P: 0.25 0.25 0.25

DOS

Bands