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We report a multiscale modeling study for charged cylindrical nanopores using three modeling levels that include (1) an all-atom explicit-water model studied with molecular dynamics (MD), and reduced models with implicit water containing…

The Poisson-Nernst-Planck (PNP) diffusional model for the immittance or impedance spectroscopy response of an electrolytic cell in a finite-length situation is extended to a general framework. In this new formalism, the bulk behavior of the…

A semi-explicit formula of solution to the boundary layer system for thermal layer derived from the compressible Navier-Stokes equations with the non-slip boundary condition when the viscosity coefficients vanish is given, in particular in…

Analysis of PDEs · Mathematics 2016-08-10 Cheng-Jie Liu , Ya-Guang Wang , Tong Yang

In ionic solutions, there are multi-species charged particles (ions) with different properties like mass, charge etc. Macroscopic continuum models like the Poisson-Nernst-Planck (PNP) systems have been extensively used to describe the…

Analysis of PDEs · Mathematics 2024-08-21 Hao Wu , Tai-Chia Lin , Chun Liu

By using a formulation of a class of compressible viscous flows with a heat source via vorticity and expansion-rate, we study the Oberbeck-Boussinesq flows. To this end we establish a new integral representation for solutions of parabolic…

Analysis of PDEs · Mathematics 2024-10-07 Zihao Guo , Zhongmin Qian , Zihao Shen

Astrophysical fluids under the influence of magnetic fields are often subjected to single-fluid or two-fluid approximations. In the case of weakly ionized plasmas however, this can be inappropriate due to distinct responses from the…

Astrophysics · Physics 2008-11-26 S. O'Sullivan , T. P. Downes

In this paper, we derive asymptotic models for the propagation of two and three-dimensional gravity waves at the free surface and the interface between two layers of immiscible fluids of different densities, over an uneven bottom. We assume…

Analysis of PDEs · Mathematics 2021-11-18 Vincent Duchene

The second entropy theory for non-equilibrium thermodynamics is used to show that the optimum structure or pattern of a time-dependent system corresponds to the maximum entropy. A formula for the total entropy of convective heat flow is…

Statistical Mechanics · Physics 2012-09-11 Phil Attard

The non-equilibrium steady states of a semi-infinite quasi-one-dimensional univalent binary electrolyte solution, characterised by non-vanishing electric currents, are investigated by means of Poisson-Nernst-Planck (PNP) theory. Exact…

Soft Condensed Matter · Physics 2024-01-09 Markus Bier

Poisson-Boltzmann (PB) theory is the classic approach to soft matter electrostatics which has been applied to numerous problems of physical chemistry and biophysics. Its essential limitations are the neglect of correlation effects and of…

Soft Condensed Matter · Physics 2016-08-03 Sahin Buyukdagli , Ralf Blossey

A cross-diffusion system describing ion transport through biological membranes or nanopores in a bounded domain with mixed Dirichlet-Neumann boundary conditions is analyzed. The ion concentrations solve strongly coupled diffusion equations…

Analysis of PDEs · Mathematics 2017-06-23 Anita Gerstenmayer , Ansgar Jüngel

This paper is concerned with the Cauchy problem of the 3D compressible bipolar Navier--Stokes--Poisson (BNSP) system with unequal viscosities, and our main purpose is three--fold: First, under the assumption that $H^l\cap L^1$($l\geq…

Analysis of PDEs · Mathematics 2021-04-20 Qing Chen , Guochun Wu , Yinghui Zhang

The numerical approximation of some Boussinesq systems in two spatial dimensions is here considered. The differential systems under study are proposed as asymptotic models for the propagation of waves along the interface of two layers of…

Numerical Analysis · Mathematics 2026-05-05 A. Durán

Numerical studies of ionic motion through solid electrolytes commonly involve static nudged-elastic band (NEB) methods or costly \emph{ab initio} molecular dynamics (AIMD). Building on a time-local model of current carrier-electrolyte…

Materials Science · Physics 2025-04-10 Aleksandr Rodin , Ben Andrew Olsen , Andrey Ustyuzhanin , Artem Maevskiy

The inviscid 2D Boussinesq system with thermal diffusivity and multiplicative noise of transport type is studied in the $L^2$-setting. It is shown that, under a suitable scaling of the noise, weak solutions to the stochastic 2D Boussinesq…

Probability · Mathematics 2021-12-08 Dejun Luo

Space-time behaviors for 3D compressible bipolar Navier-Stokes-Poisson system (BNSP) with unequal viscosities are given. The space-time estimate of electric field $\nabla\phi$ is the most important thing when deducing generalized Huygens'…

Analysis of PDEs · Mathematics 2023-03-16 Zhigang Wu , Weike Wang

In this work, we justify a Baer$-$Nunziato system including appropriate closure terms as the macroscopic description of a compressible viscous fluid that can occur in a liquid or a vapor phase in the isothermal framework. As a mathematical…

Analysis of PDEs · Mathematics 2025-04-15 Christian Rohde , Florian Wendt

Thermal conduction is an important energy transfer and damping mechanism in astrophysical flows. Fourier's law - the heat flux is proportional to the negative temperature gradient, leading to temperature diffusion - is a well-known…

Solar and Stellar Astrophysics · Physics 2015-06-23 Daniel Lecoanet , Benjamin P. Brown , Ellen G. Zweibel , Keaton J. Burns , Jeffrey S. Oishi , Geoffrey M. Vasil

A novel thermodynamically consistent diffuse interface model is derived for compressible electrolytes with phase transitions. The fluid mixtures may consist of N constituents with the phases liquid and vapor, where both phases may coexist.…

Analysis of PDEs · Mathematics 2014-11-13 Wolfgang Dreyer , Jan Giesselmann , Christiane Kraus

In this paper, we investigate the well-posedness of a nonlinear dispersive model with variable coefficients that describes the evolution of surface waves propagating through a one-dimensional shallow water channel of finite length with…

Numerical Analysis · Mathematics 2025-10-14 Juan Carlos Muñoz Grajales , Deissy Marcela Pizo
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