Jl. Feldman et al., MODES IN AMORPHOUS-SILICON, Philosophical magazine. B. Physics of condensed matter.Statistical mechanics, electronic, optical and magnetic, 77(2), 1998, pp. 507-512
We discuss how the vibrational modes in an amorphous material can be c
haracterized by various correlation functions. The spectrum of modes c
an be expected to contain both extended and localized states separated
by mobility edges. The inverse participation ratio can be used as a m
easure of localization. To examine the vibrational modes in more detai
l, we propose to study mod;li of Fourier transforms of powers of the e
igenvector components. We have applied the analysis to vibrational mod
es of amorphous silicon. The structural and potential models that we u
se are based on the Wooten-Winer-Weaire bond-switching algorithm and S
tillinger-Weber classical potential. The structural models are cubic s
upercells, periodically repealed. Whereas models ranging in size from
216 to 4096 atoms have been studied, only the 4096-atom model results
are included here. In the analysis, we employ only q vectors that are
consistent with the boundary conditions used to obtain the modes. Upon
averaging over q-vector direction, systematic dependences result. The
structural aspects of the model are briefly considered. In particular
, no unusual structural ordering has been detected in the pair distrib
ution function for the 4096-atom model.