Journal ArticleDOI
Time Correlation Functions for Internal and Anisotropic Rotational Motion of Molecules
TLDR
For an axially symmetric overall diffusion with internal rotation about one and two axes correlation functions of a second rank spherical tensor are calculated in this paper, where the results comprise all the solutions of the pertinent problem as given so far and allow the extension of the theory to a wider field of application.Abstract:
By use of Green's functions for the diffusional motion a very concise formulation and computation of correlation functions is possible. For an axially symmetric overall diffusion with internal rotation about one and two axes correlation functions of a second rank spherical tensor are calculated. The results comprise all the solutions of the pertinent problem as given so far and allow the extension of the theory to a wider field of applicationread more
Citations
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Journal ArticleDOI
Magnetic relaxation under hindered rotation in fluids
D.E. Woessner,B.S. Snowden +1 more
Journal ArticleDOI
The problem of intramolecular rotation in liquids and nuclear magnetic relaxation
TL;DR: In this article, a synthese relatif aux mouvements thermiques de translation and rotation dans les liquides is presented, relatif to mappings between thermiques.
Book ChapterDOI
Nuclear Magnetic Resonance and Relaxation of Molecules Adsorbed on Solids
TL;DR: In this paper, the magnetic resonance (NMR) signals can only be observed from a sample which contains nuclei with a nonvanishing magnetic moment and the resonance frequency is proportional to the magnetic field H 0 applied to the sample and different for nuclei of different kind.
Journal ArticleDOI
Multiscale simulations of anisotropic particles combining molecular dynamics and Green’s function reaction dynamics
Adithya Vijaykumar,Adithya Vijaykumar,Thomas E. Ouldridge,Pieter Rein ten Wolde,Peter G. Bolhuis +4 more
TL;DR: This work presents the novel algorithm focusing on Brownian dynamics only, although the methodology is generic, and will open up the possibility for large scale simulations of protein signalling networks.
Journal ArticleDOI
Re-investigation of the methyl and methoxy group hindered rotations in p-dimethoxybenzene, by comparison of dielectric and far infra-red spectra with 13C N.M.R. relaxation data
TL;DR: In this paper, the same para-dimethoxybenzene/tetrachloroethylene solution was concomitantly analyzed with 13C N.M.R.O. (T 1 and N.E) relaxation data, in order to study the intramolecular dynamics of the methoxy and methyl group internal motions.