Geometry

Info

ID:

8052

ICSD:

83367

Name:

Copper ditantalate

Comp.:

Cu1O6Ta2

Symm.:

 P42/mnm(136)

Latt.:

 tetragonal

Spin:

 1.919

Eg/Eg':

2.661/2.497 eV

me/mh:

23.868/-20.364

K-data

high symmetry path:

G - X - M - G - Z - R - A - Z

high symmetry points:

A: 0.5 0.5 0.5 G: 0.0 0.0 0.0 M: 0.5 0.5 0.0 R: 0.0 0.5 0.5 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands