Geometry

Info

ID:

9034

ICSD:

161649

Name:

Dilithium iron silicate

Comp.:

Fe1Li2O4Si1

Symm.:

 Pmn21(31)

Latt.:

 orthorhombic

Spin:

 7.681

Eg/Eg':

4.062/3.720 eV

me/mh:

-93.243/-3374.644

K-data

high symmetry path:

G - Z - T - Y - S - R - U - X - G - Y

high symmetry points:

G: 0.0 0.0 0.0 S: -0.5 0.5 0.0 R: -0.5 0.5 0.5 U: 0.0 0.5 0.5 T: -0.5 0.0 0.5 Y: -0.5 0.0 0.0 X: 0.0 0.5 0.0 Z: 0.0 0.0 0.5

DOS

Bands