Water motion in reverse micelles studied by quasielastic neutron scattering and molecular dynamics simulations

Michael R. Harpham, Branka M. Ladanyi, Nancy E. Levinger, Kenneth W. Herwig

Research output: Contribution to journalArticlepeer-review

142 Scopus citations

Abstract

The result of motion of water molecules in Aerosol OT reverse micelles (RM) with water content w 0 was presented. The result explored experimentally through quasielectric neutron scattering (QENS) and with molecular dynamics (MD) simulations. The QENS analysis indicates that in RM with low water content translational diffusion rate is too slow to be detected, whereas for w 0 =5 the diffussion coefficient is much smaller than for bulk water. MD simulations were performed to calculate the self-intermediate scattering function F s (Q, t) for water hydrogens. The results show that water mobility in RMs is strongly w 0 dependent and quite different from bulk water mobility.

Original languageEnglish
Pages (from-to)7855-7868
Number of pages14
JournalJournal of Chemical Physics
Volume121
Issue number16
DOIs
StatePublished - Oct 22 2004
Externally publishedYes

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