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Indexed by:期刊论文

Date of Publication:2012-03-10

Journal:MOLECULAR PHYSICS

Included Journals:SCIE、EI

Volume:110

Issue:5

Page Number:283-291

ISSN No.:0026-8976

Key Words:molecular dynamics simulation; glycerol; diffusion coefficient; hydrogen bond

Abstract:Water self-diffusion coefficients for glycerol-water binary and glycerol-water-sodium chloride ternary solutions at low glucose concentrations have been predicted using the mean square displacements method. It was found that the water self-diffusion coefficient decreases as the glycerol concentration increases. The reasons for the decrease have been analysed from the viewpoint of the hydrogen bonds.