Geometry

Info

ID:	12997
ICSD:	600246
Name:	Thallium tetrathioniobate(V)
Comp.:	Nb1S4Tl3
Symm.:	I-43m(217)
Latt.:	cubic
Spin:	0.000
E_g/E_g':	2.600/2.533 eV
m_e/m_h:	72.849/None

K-data

high symmetry path:

G - P - N - G - H - P | H - N

high symmetry points:

G: 0.0 0.0 0.0 N: 0.0 0.0 0.5 H: 0.5 -0.5 0.5 P: 0.25 0.25 0.25

DOS

Bands