Geometry

Info

ID:

3448

ICSD:

81457

Name:

Dibarium copper phosphate(V)

Comp.:

Ba2Cu1O8P2

Symm.:

 C12/m1(12)

Latt.:

 monoclinic

Spin:

 1.920

Eg/Eg':

3.625/None eV

me/mh:

4.389/-10.508

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