Recent progress on polymer dynamics by neutron scattering: From simple polymers to complex materials

J Colmenero, A Arbe - Journal of Polymer Science Part B …, 2013 - Wiley Online Library
The recent (from 2010 onward) contributions of quasielastic neutron scattering techniques
(time of flight, backscattering, and neutron spin echo) to the characterization and …

Molecular dynamics simulation study of nonconcatenated ring polymers in a melt. II. Dynamics

JD Halverson, WB Lee, GS Grest… - The Journal of …, 2011 - pubs.aip.org
Molecular dynamics simulations were conducted to investigate the dynamic properties of
melts of nonconcatenated ring polymers and compared to melts of linear polymers. The …

Translationally invariant slip-spring model for entangled polymer dynamics

VC Chappa, DC Morse, A Zippelius, M Müller - Physical review letters, 2012 - APS
The topological effect of noncrossability of long flexible macromolecules is effectively
described by a slip-spring model, which represents entanglements by local, pairwise …

Slowing Down of Ring Polymer Diffusion Caused by Inter‐Ring Threading

E Lee, S Kim, YJ Jung - Macromolecular Rapid …, 2015 - Wiley Online Library
Diffusion of long ring polymers in a melt is much slower than the reorganization of their
internal structures. While direct evidence for entanglements has not been observed in the …

Scale-free static and dynamical correlations in melts of monodisperse and flory-distributed homopolymers: a review of recent bond-fluctuation model studies

JP Wittmer, A Cavallo, H Xu, JE Zabel… - Journal of Statistical …, 2011 - Springer
It has been assumed until very recently that all long-range correlations are screened in three-
dimensional melts of linear homopolymers on distances beyond the correlation length ξ …

Polymer diffusion is fastest at intermediate levels of cylindrical confinement

JF Pressly, RA Riggleman, KI Winey - Macromolecules, 2018 - ACS Publications
The behavior of polymer melts under cylindrical confinement was investigated using
molecular dynamics simulations. A range of polymer chains, from unentangled to highly …

Increased polymer diffusivity in thin-film confinement

JF Pressly, RA Riggleman, KI Winey - Macromolecules, 2019 - ACS Publications
The behavior of polymer melts under planar confinement was investigated using molecular
dynamics simulations. Polymers with a range of lengths, from unentangled to highly …

Computer Simulation Insight into the Adsorption and Diffusion of Polyelectrolytes on Oppositely Charged Surface

AA Glagoleva, AA Yaroslavov, VV Vasilevskaya - Polymers, 2023 - mdpi.com
In the present work, by means of computer simulation, we studied the adsorption and
diffusion of polyelectrolyte macromolecules on oppositely charged surfaces. We considered …

Polymers under extreme two-dimensional confinement: Poly (ethylene oxide) in graphite oxide

F Barroso-Bujans, F Fernandez-Alonso, S Cerveny… - Soft Matter, 2011 - pubs.rsc.org
The confinement of poly (ethylene oxide) in graphite oxide is studied using a combination of
diffraction, calorimetric, and spectroscopic methods. Polymer intercalation into …

Macromolecular structure and vibrational dynamics of confined poly (ethylene oxide): from subnanometer 2D-intercalation into graphite oxide to surface adsorption …

F Barroso-Bujans, F Fernandez-Alonso… - ACS Macro …, 2012 - ACS Publications
In this work, high-resolution inelastic neutron scattering (INS) has been used to provide
novel insights into the properties of confined poly (ethylene oxide)(PEO) chains. Two limits …