Geometry

Info

ID:	9069
ICSD:	37026
Name:	Sodium iron(III) sulfide
Comp.:	Fe1Na1S2
Symm.:	I222(23)
Latt.:	orthorhombic
Spin:	4.760
E_g/E_g':	None/None eV
m_e/m_h:	None/None

K-data

high symmetry path:

R - G - X - S - W - T

high symmetry points:

G: 0.0 0.0 0.0 S: 0.5 0.0 -0.5 R: 0.5 0.0 0.0 T: 0.5 -0.5 0.0 W: 0.75 -0.25 -0.25 X: 0.5 0.5 -0.5

DOS

Bands