Berlin 2005 – scientific programme
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DY: Dynamik und Statistische Physik
DY 34: Poster
DY 34.102: Poster
Monday, March 7, 2005, 15:30–18:00, Poster TU D
Rotational Diffusion near Confining Walls — •Heidrun Gleisberg, Patrick Ilg, and Siegfried Hess — Institut für Theoretische Physik, Hardenbergstr. 36, Technische Universität Berlin
A simple model is proposed to study the influence of confining walls on the rotational dynamics of a molecule, with emphasis on the rotational diffusion coefficient.
In particular, a time reversible dynamics is considered which employs a recently introduced thermostat for rotational motion [1]. This model is compared to the corresponding approach via the irreversible Langevin equation.
Analytical and numerical results for a molecule in a channel are presented, exhibiting an interesting dependence of the rotational diffusion coefficient on the imposed spatial restrictions.
[1] S.Hess, Z. Naturforsch. 58a, 377 (2003)