Geometry

Info

ID:

2554

ICSD:

84683

Name:

Barium copper diborate

Comp.:

B2Ba1Cu1O5

Symm.:

 C121(5)

Latt.:

 monoclinic

Spin:

 1.895

Eg/Eg':

3.344/None eV

me/mh:

5.980/-54.702

K-data

high symmetry path:

G - Y - V - G - A - M - L - V

high symmetry points:

A: 0.0 0.0 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.5 L: 0.5 0.0 0.5 V: 0.5 0.0 0.0 Y: 0.5 0.5 0.0

DOS

Bands