P. Jund et R. Jullien, Densification effects on the Boson peak in vitreous silica: A molecular-dynamics study, J CHEM PHYS, 113(7), 2000, pp. 2768-2771
We perform classical molecular-dynamics simulation to study the effect of d
ensification on the vibrational spectrum of a model silica glass. We concen
trate this study on the so-called Boson peak and compare our results, obtai
ned from a direct diagonalization of the dynamical matrix, with experimenta
l Raman data. We show that, upon densification, the position of the Boson p
eak shifts towards higher frequencies while its magnitude decreases which i
s in agreement with a recent experimental study. (C) 2000 American Institut
e of Physics. [S0021-9606(00)50431-0].