Size dependence of self-diffusion in dense binary liquid of hard spheres

Citation
H. Kawai et al., Size dependence of self-diffusion in dense binary liquid of hard spheres, J PHYS IV, 10(P7), 2000, pp. 41-45
Citations number
6
Categorie Soggetti
Physics
Journal title
JOURNAL DE PHYSIQUE IV
ISSN journal
11554339 → ACNP
Volume
10
Issue
P7
Year of publication
2000
Pages
41 - 45
Database
ISI
SICI code
1155-4339(200005)10:P7<41:SDOSID>2.0.ZU;2-S
Abstract
For a very dense binary liquid of hard spheres the dependence of the veloci ty-autocorrelation function (VAF) of tagged particles and of the self-diffu sion coefficient on system size is derived from the coupling of self diffus ion to modes of collective flow. Collective flow is described by longitudin al and transverse current-current correlation functions for different wavev ectors which are obtained by molecular dynamics simulation. The size depend ence of the VAF is reproduced rather accurately for longer times t > 7 tau, where tau is the mean time of free flight. The result for the size depende nce of the self-diffusion coefficient is in satisfactory agreement with a d irect calculation, but this result also depends on the VAF's at shorter tim es.