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Characteristic times in the nanometer-picosecond translational collective dynamics of molecular liquids

Articolo
Data di Pubblicazione:
2009
Abstract:
Molecular-dynamics calculations of the translational dynamic structure factor in liquid CO(2) and CD(4) are analyzed by means of the generalized Langevin equation for the intermediate scattering function in the second-order memory function approximation. We give a rigorous general relation among the decay times of the memory and the lifetimes of the modes of the density-density correlation function. The comparison of the various characteristic times among them and with the collision time, carried out as a function of the wave vector, reveals strong relationships between the memory relaxation and the density-density correlation modes, some of which have purely "collisional" and other "collective" character. We show that essential information about the life time of structural properties in a molecular liquid at nanometer dimensions can be obtained if the time behavior of the correlation function is considered in addition to that of the memory function.
Tipologia CRIS:
01.01 Articolo in rivista
Elenco autori:
Bafile, Ubaldo
Link alla scheda completa:
https://iris.cnr.it/handle/20.500.14243/35661
Pubblicato in:
PHYSICAL REVIEW. E, STATISTICAL, NONLINEAR AND SOFT MATTER PHYSICS
Journal
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