Geometry

Info

ID:	9138
ICSD:	633095
Name:	Iron hexaseleno-hypodiphosphate
Comp.:	Fe1P1Se3
Symm.:	R-3H(148)
Latt.:	rhombohedral
Spin:	21.770
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