Geometry

Info

ID:

12502

ICSD:

262320

Name:

Dibarium calcium molybdate

Comp.:

Mo1O6Sr2Zn1

Symm.:

 I4/m(87)

Latt.:

 tetragonal

Spin:

 0.000

Eg/Eg':

2.719/2.614 eV

me/mh:

28.880/-17.567

K-data

high symmetry path:

G - X - P - N - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 -0.5 N: 0.0 0.5 0.0 P: 0.25 0.25 0.25 X: 0.0 0.0 0.5

DOS

Bands