Geometry

Info

ID:	9311
ICSD:	16246
Name:	Diiron hexaselenoduo-diphosphate(IV)
Comp.:	Fe2P2Se6
Symm.:	R3H(146)
Latt.:	rhombohedral
Spin:	21.758
E_g/E_g':	None/None eV
m_e/m_h:	None/None

K-data

high symmetry path:

G - L - F - G - Z

high symmetry points:

G: 0.0 0.0 0.0 Z: 0.5 0.5 0.5 L: 0.0 0.5 0.0 F: 0.5 0.5 0.0

DOS

Bands