H. Werheit et al., INTERBAND AND GAP STATE RELATED TRANSITIONS IN BETA-RHOMBOHEDRAL BORON, Physica status solidi. b, Basic research, 176(2), 1993, pp. 415-432
The anisotropy of the electronic interband transitions of beta-rhomboh
edral boron is determined by optical absorption measurements. The band
gaps (indirect allowed transitions) are 1.32(1) and 1.50(1) eV for E
parallel-to c, respectively, 1.29(1) and 1.46(1) eV for E perpendicula
r-to c (extrapolated to T = 0 K). At low temperatures these gaps decre
ase, while the thermal equilibrium develops. The temperature dependenc
e of the gap is attributed to the thermal disorder caused by phonons o
f 121.9 (E parallel-to c) and 94.1 meV (E perpendicular-to c) represen
ting the most prominent intraicosahedral vibrations. Six intrinsic tra
pping levels for electrons in distances between 0. 1 7 and 1. 1 5 eV f
rom the conduction band edge are determined, the closer ones in agreem
ent with different photo effects. The trapping levels are attributed t
o distortion states of the icosahedra due to a dynamical Jahn-Teller e
ffect. This conception allows the interpretation of other physical pro
perties like internal friction, discontinuities of thermal expansion,
and electrical conductivity, of the temperature dependence of the ESR
linewidth, and of the density of paramagnetic centers (spin density an
d magnetic susceptibility).