Geometry

Info

ID:

1660

ICSD:

201733

Name:

Tricopper bis(arsenate(V))

Comp.:

As2Cu3O8

Symm.:

 P121/a1(14)

Latt.:

 monoclinic

Spin:

 1.920

Eg/Eg':

0.719/0.625 eV

me/mh:

-73.002/-28.347

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