Field-cycling (FC) NMR relaxometry is a very important source of information on dynamical
and structural features of molecules. It is especially well established for liquids and …

This review concerns modeling studies of the fundamental problem of entangled
(reptational) homopolymer diffusion in melts and nanocomposite materials in comparison to …

The dynamics of entangled flexible polymers is dominated by physics general to many
chemical systems. It is an appealing interdisciplinary field where experimental and …

We present coarse-grained molecular dynamics simulations of linear polyethylene (PE)
melts, ranging in chain length from C 80 to C 1000. The employed effective potentials …

Results are presented from 300 ns long atomistic molecular dynamics (MD) simulations of
polyethylene (PE) melts, ranging in molecular length from C78 to C250. Above C156, the …

This contribution considers recent developments in the computer modelling of amorphous
polymeric materials. Progress in our capabilities to build models for the computer simulation …

A microscopic theory for cation diffusion in polymer electrolytes is presented. Based on a
thorough analysis of molecular dynamics simulations on poly (ethylene) oxide with LiBF 4 …

Recent data by Hassager and co-workers [Bach et al. Macromolecules 2003, 36, 5174] of
elongational viscosity of nearly monodisperse polystyrene melts are interpreted by including …

We discuss a phenomenological, coarse‐grained simulation scheme, single‐chain‐in‐
mean‐field (SCMF) simulation, for investigating the kinetics of phase separation in dense …

We present theoretical arguments and numerical results to demonstrate long-range
intrachain correlations in concentrated solutions and melts of long flexible polymers, which …