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1.
Simulation of non-stationary electrodiffusion processes in charged membranes by the network approach
Single techniques of network approach have been used to obtain the numerical solution for a boundary value problem involving the Nernst-Planck and Poisson equations system. A network model has been proposed for a particular physical situation, namely, ionic transport in charged membranes including the Donnan equilibrium relations at the membrane/solution interfaces. With this network model and using the electrical circuit simulation program PSPICE, the ionic concentration profiles as well as electric potentials and ionic fluxes have been simulated as a function of time for the ternary systems HClKCl and NaClKCl. 相似文献
2.
We derive two expansions of the Randles–Sevcik function
: an asymptotic expansion of
for x and its Taylor expansion at any x
0
. These expansions are accompanied by error bounds for the remainder at any order of the approximation. 相似文献
3.
Mathematical homogenization theory as a multiscale modeling strategy for deriving macroscopic models is gaining relevance in modeling electrochemical energy storage systems (ESSs) for its ability to capture the detailed microstructural properties of a material. Stochastic modeling, on the other hand, captures molecular fluctuations and uncertainties associated with ESSs. In this short review, modeling ESSs using both tools is presented. Integrating mathematical homogenization theory and stochastic modeling provides an effective tool for deriving macroscopic models that accurately predict various macroscopic behavior and electrochemical properties of ESSs to enable optimization and manufacturing of high performance ESSs. 相似文献
4.
Colloidal nano/micro-(bio)particles carry an electrostatic charge in aqueous media, and this charge is critical in defining their stability, (bio)adhesion properties, or toxicity toward humans and biota. Determination of interfacial electrostatics of these particles is often performed from zeta potential estimation using the electrophoresis theory by Smoluchowski. The latter, however, strictly applies to the ideal case of hard particles defined by a surface charge distribution under the strict conditions of particle impermeability to electrolyte ions and to flow. Herein, we review sound theoretical alternatives for capturing electrokinetic and therewith electrostatic features of soft colloids of practical interest defined by a 3D distribution of their structural charges and by a finite permeability to ions and/or flow (e.g., bacteria, viruses, nanoplastics, (bio)functionalized particles or engineered nanoparticles). Reasons for the inadequacy of commonly adopted hard particle electrophoresis models when applied to soft particulate materials are motivated, and analytical expressions that properly capture their electrophoretic response are comprehensively reviewed. 相似文献