Y. Fukaya et al., Wide range temperature dependence of reflection high-energy electron diffraction rocking curve from a Si(111)7x7 surface, J VAC SCI A, 18(3), 2000, pp. 968-971
In order to determine the Debye parameter for the surface layer of Si cryst
al, we have measured the rocking curves of reflection high-energy electron
diffraction (RHEED) from a Si(111)-7x7 surface at temperatures extending ov
er a wide range, 293-1073 K. From the analysis of the dynamical calculation
of RHEED intensity taking account of the thermal diffuse scattering, the a
datoms and rest atoms largely shifted upward compared with the atomic posit
ions derived by Brommer et al. using ab initio molecular-dynamics scheme [P
hys. Rev. Lett. 68, 1355 (1992)] and the optimum Debye temperature has been
estimated at 420 K, which is much lower than that of bulk Si (505-658 K).
Since the Debye temperature is considered to be an averaged value in a few
surface layers, the difference means that the vibrational amplitude of surf
ace atom is large compared to bulk atom. (C) 2000 American Vacuum Society.
[S0734-2101(00)02303-4].