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This paper explores the mechanical behaviour of the composite materials used in modern lithium-ion battery electrodes. These contain relatively high modulus active particle inclusions within a two-component matrix of liquid electrolyte…

计算物理 · 物理学 2024-10-16 J. M. Foster , A. F. Galvis , B. Protas , S. J. Chapman

The transport and dispersion of multiple species of charged ions are central to many biological and physical processes, including electrokinetic ion separation. However, most theoretical studies of dispersion in channels have focused on…

软凝聚态物质 · 物理学 2026-05-04 Thakurdas Mahata , Anirban Chatterjee , Ameeya Kumar Nayak

We analyze the simplest problem of electrochemical relaxation in more than one dimension - the response of an uncharged, ideally polarizable metallic sphere (or cylinder) in a symmetric, binary electrolyte to a uniform electric field. In…

材料科学 · 物理学 2009-11-11 Kevin T. Chu , Martin Z. Bazant

We report dynamic and coagulation properties of a dispersion of polyelectrolyte multilayer microcapsules filled with solutions of a strong polyelectrolyte. The capsule self-diffusion coefficient in the vicinity of the wall is measured using…

软凝聚态物质 · 物理学 2007-05-23 Byoung-Suhk Kim , Vladimir Lobaskin , Olga I. Vinogradova

Counterion distribution around an isolated flexible polyelectrolyte in the presence of a divalent salt is evaluated using the adsorption model [M. Muthukumar, J. Chem. Phys. {\bf 120}, 9343 (2004)] that considers Bjerrum length, salt…

软凝聚态物质 · 物理学 2008-12-29 Arindam Kundagrami , M. Muthukumar

The effects of surfactant coating on a deformable viscous drop under the combined action of a shear flow and a uniform electric field, are investigated by solving the coupled equations of electrostatics, fluid flow and surfactant transport.…

流体动力学 · 物理学 2019-10-30 Antarip Poddar , Shubhadeep Mandal , Aditya Bandopadhyay , Suman Chakraborty

Numerical simulations are a powerful tool for the development and improvement of Li-ion batteries. Modeling the mass transport of the involved electrolytic solutions requires precise determination of the corresponding electrolyte…

化学物理 · 物理学 2024-11-21 Lukas Lehnert , Maryam Nojabaee , Arnulf Latz , Birger Horstmann

We analyse the dynamics of different routes to collapse of a constrained polyelectrolyte gel in contact with an ionic bath. The evolution of the gel is described by a model that incorporates non-linear elasticity, Stefan-Maxwell diffusion…

软凝聚态物质 · 物理学 2025-01-22 Giulia L. Celora , Matthew G. Hennessy , Andreas Münch , Barbara Wagner , Sarah L. Waters

Electrophoretic (EP) mobility reversal is commonly observed for strongly charged macromolecules in multivalent salt solutions. This curious effect takes place, e.g., when a charged polymer, such as DNA, adsorbs excess counterions so that…

软凝聚态物质 · 物理学 2023-03-28 Xiang Yang , Sahin Buyukdagli , Alberto Scacchi , Maria Sammalkorpi , Tapio Ala-Nissila

Asymptotic homogenisation is considered for problems with integral constraints imposed on a slowly-varying microstructure; an insulator with an array of perfectly dielectric inclusions of slowly varying size serves as a paradigm. Although…

经典分析与常微分方程 · 数学 2023-04-03 A. Kent , S. L. Waters , J. Oliver , S. J. Chapman

The electric field dielectric polarization-based separations mechanism represents a novel method for separating solutions at small length scales. An electric field gradient with a maximum strength of $\mathrm{0.4~MV/m}$ applied across a…

化学物理 · 物理学 2023-11-29 Gaurav Anand , Samira Safaripour , Craig Snoeyink

In this letter we analyze the effects of an externally applied electric field on thermal fluctuations for a fluid containing charged species. We show in particular that the fluctuating Poisson-Nernst-Planck equations for charged…

流体动力学 · 物理学 2022-06-08 Jean-Philippe Péraud , Andy Nonaka , John B. Bell , Aleksandar Donev , Alejandro L. Garcia

When applied to binary solutions, thermal gradients lead to the generation of concentration-gradients and thus to inhomogeneous systems. While being known for more than 150 years, the molecular origins for this phenomenon are still debated,…

软凝聚态物质 · 物理学 2023-12-21 Mario Araujo-Rocha , Alejandro Diaz-Marquez , Guillaume Stirnemann

Ionic liquids are promising candidates for novel electrolytes as they possess large electrochemical and thermodynamic stability and offer a high degree of tunability. As purely-ionic electrolyte without neutral solvent they exhibit…

化学物理 · 物理学 2022-01-12 Max Schammer , Birger Horstmann , Arnulf Latz

Molecular dynamics simulation and recent theory are used to examine density correlations in semidilute solutions of highly charged, intrinsically flexible and hydrophilic polyelectrolytes in low salt. Quantitative comparison with no…

软凝聚态物质 · 物理学 2021-07-06 James P. Donley , David R. Heine

Polyelectrolyte surfactant mixtures and their interactions with fluid interfaces are an important research field due to their use in technological applications. Most of the existing knowledge on these systems is based on models in which the…

We present a theoretical study of the phase diagram and the structure of a fluid adsorbed in high-porosity aerogels by means of an integral-equation approach combined with the replica formalism. To simulate a realistic gel environment, we…

无序系统与神经网络 · 物理学 2009-11-07 V. Krakoviack , E. Kierlik , M. -L. Rosinberg , G. Tarjus

Polyelectrolyte gels are a very attractive class of actuation materials with remarkable electronic and mechanical properties with a great similarity to biological contractile tissues. They consist of a polymer network with ionizable groups…

材料科学 · 物理学 2015-09-16 Thomas Wallmersperger , Falk K. Wittel , Michele D'Ottavio , Bernd Kröplin

The influence of the chain degree of ionization on the adsorption of weak polyelectrolytes on neutral and on oppositely and likely charged surfaces is investigated for the first time, by means of Monte Carlo simulations with the mesoscopic…

生物物理 · 物理学 2012-10-02 F. Alarcón , E. Pérez , A. Gama Goicochea

Using a numerical approach based on the coupling of the discrete and finite element methods, we explore the variation of the bulk modulus K of soft particle assemblies undergoing isotropic compression. As the assemblies densify under…