T. Held et al., INFLUENCE OF ISOTOPIC DISORDER ON PHONON FREQUENCIES AND PHONON LINEWIDTHS OF AN ANHARMONIC CRYSTAL, Physical review. B, Condensed matter, 55(1), 1997, pp. 231-236
Based on a perturbation theory using Matsubara functions and a diagram
matic treatment, it is shown that the phonon linewidths of an anharmon
ic crystal with isotopic impurities include two different contribution
s, a disorder-induced temperature-independent part, caused by harmonic
scattering processes of phonons at isotopic impurities, and a disorde
r-influenced temperature-dependent part, caused by anharmonic decay pr
ocesses. Whereas in case of an anharmonic ideal crystal it is usual to
restrict the corresponding self-energy on diagonal elements only, thi
s is no longer sufficient in the presence of impurities. For that reas
on it is shown that only nondiagonal elements of the effective vertex
function of the harmonic phonon propagator contribute to the disorder-
induced contribution to the phonon linewidth, whereas the correspondin
g harmonic and the anharmonic frequency shifts are determined by diago
nal and nondiagonal elements as well. As an application, numerical res
ults of the disorder-induced temperature-independent as well as the di
sorder-influenced temperature-dependent contribution to the phonon lin
ewidths of a diatomic linear chain with a single mass defect are prese
nted.