Universal dynamics of dilute and semidilute solutions of flexible linear polymers

JR Prakash - Current opinion in colloid & interface science, 2019 - Elsevier
Experimental observations and computer simulations have recently revealed universal
aspects of polymer solution behaviour that were previously unknown. This progress has …

Utility of Brownian dynamics simulations in chemistry and biology: A comprehensive review

KM ElSawy - Biochimica et Biophysica Acta (BBA)-General Subjects, 2024 - Elsevier
Brownian dynamics (BD) simulations, a powerful computer simulation tool that has gained
significant attraction in investigating the intricate dynamics of chemical and biological …

[HTML][HTML] Dynamics and rheology of ring-linear blend semidilute solutions in extensional flow: Single molecule experiments

Y Zhou, CD Young, M Lee, S Banik, D Kong… - Journal of …, 2021 - pubs.aip.org
Ring polymers exhibit unique flow properties due to their closed chain topology. Despite
recent progress, we have not yet achieved a full understanding of the nonequilibrium flow …

Nonmonotonic dependence of comb polymer relaxation on branch density in semidilute solutions of linear polymers

SF Patel, CD Young, CE Sing, CM Schroeder - Physical Review Fluids, 2020 - APS
The dynamics of branched polymers in semidilute solutions are thought to depend on a
coupling between polymer chain architecture, intermolecular excluded volume interactions …

[HTML][HTML] Dynamics and rheology of ring-linear blend semidilute solutions in extensional flow. Part I: Modeling and molecular simulations

CD Young, Y Zhou, CM Schroeder, CE Sing - Journal of Rheology, 2021 - pubs.aip.org
We use Brownian dynamics (BD) simulations and single molecule experiments to
investigate the influence of topological constraints and hydrodynamic interactions on the …

Effect of hydrodynamic interactions and flow on charge transport in redox-active polymer solutions

DW Walker, CE Sing - The Journal of Physical Chemistry B, 2024 - ACS Publications
Redox-active polymers (RAPs) are a subclass of polyelectrolytes that can store charge and
undergo redox self-exchange reactions. RAPs are of great interest in the field of redox flow …

[HTML][HTML] Simulation of semidilute polymer solutions in planar extensional flow via conformationally averaged Brownian noise

CD Young, CE Sing - The Journal of Chemical Physics, 2019 - pubs.aip.org
The dynamics and rheology of semidilute polymer solutions in strong flows are of great
practical relevance. Processing applications can in principle be designed utilizing the …

[图书][B] Heterophase polymerization: basic concepts and principles

H Hernandez, K Tauer - 2021 - taylorfrancis.com
Heterophase polymerization is a century-old technology with a wide range of relevant
industrial applications, including coatings, adhesives, rubbers, and many other specialized …

Stochastic kinetic theory applied to coarse-grained polymer model

S Zhu, PT Underhill - The Journal of Chemical Physics, 2024 - pubs.aip.org
A stochastic field theory approach is applied to a coarse-grained polymer model that will
enable studies of polymer behavior under non-equilibrium conditions. This article is focused …

Universal scaling and characterization of gelation in associative polymer solutions

A Santra, B Dünweg, J Ravi Prakash - Journal of Rheology, 2021 - pubs.aip.org
A multiparticle Brownian dynamics simulation algorithm with a Soddemann–Dünweg–
Kremer potential that accounts for pairwise excluded volume interactions between both …