Intramolecular Diffusive Motion in Alkane Monolayers Studied by High-Resolution Quasielastic Neutron Scattering and Molecular Dynamics Simulations
Hansen, Flemming Y.
Criswell, Leah, 1971-
Herwig, K. W.
Diama, Armand, 1965-
Dimeo, R. M.
Neumann, Dan A.
Volkmann, Ulrich G.
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Molecular dynamics simulations of a tetracosane (n-C24H50) monolayer adsorbed on a graphite basal-plane surface show that there are diffusive motions associated with the creation and annihilation of gauche defects occurring on a time scale of ∼0.1-4 ns. We present evidence that these relatively slow motions are observable by high-energy-resolution quasielastic neutron scattering (QNS) thus demonstrating QNS as a technique, complementary to nuclear magnetic resonance, for studying conformational dynamics on a nanosecond time scale in molecular monolayers.
Missouri Research Reactor publications (MU)
Phys. Rev. Lett. 92, 046103 (2004)