相关论文: Convergence of Phase-Field Free Energy and Boundar…
We construct a new phase-field model for the solvation of charged molecules with a variational implicit solvent. Our phase-field free-energy functional includes the surface energy, solute-solvent van der Waals dispersion energy, and…
In a continuum model of the solvation of charged molecules in an aqueous solvent, the classical Poisson-Boltzmann (PB) theory is generalized to include the solute point charges and the dielectric boundary that separates the high-dielectric…
Phase field models are widely used to describe multiphase systems. Here a smooth indicator function, called phase field, is used to describe the spatial distribution of the phases under investigation. Material properties like density or…
Mobile charge in an electrolytic solution can in principle be represented as the divergence of ionic polarization. After adding explicit solvent polarization a finite volume of electrolyte can then be treated as a composite non-uniform…
In this paper, a phase-field model is introduced to describe the evolution of a deformable, self-propelled object driven by surface-tension effects. The model couples an Allen-Cahn-type equation, which distinguishes the body from the…
We consider the van der Waals' free energy functional, with a scaling small parameter epsilon, in the plane domain given by the first quadrant, and inhomogeneous Dirichlet boundary conditions. The boundary data are chosen in such a way that…
A system of three electrolytes separated by two parallel planes is considered. Each region is described by a dielectric constant and a Coulomb fluid in the Debye-H\"uckel regime. In their book Dispersion Forces, Mahanty and Ninham have…
The model under consideration is a semi-infinite two-dimensional two-component plasma (Coulomb gas), stable against bulk collapse for the dimensionless coupling constant $\beta<2$, in contact with a dielectric wall of dielectric constant…
We study the large scale equilibrium behavior of Van der Waals-Cahn-Hilliard phase transitions in stationary ergodic media. Specifically, we are interested in free energy functionals of the following form \begin{equation*}…
Theories of solvation free energies often involve electrostatic potentials at the position of a solute charge. Simulation calculations that apply cutoffs and periodic boundary conditions based on molecular centers result in center-dependent…
We consider a family of vectorial models for cohesive fracture, which may incorporate $\mathrm{SO}(n)$-invariance. The deformation belongs to the space of generalized functions of bounded variation and the energy contains an (elastic)…
A phase-field model that takes into account the bending energy of fluid vesicles is presented. The Canham-Helfrich model is derived in the sharp-interface limit. A dynamic equation for the phase-field has been solved numerically to find…
A melting transition for a system of hard spheres interacting by a repulsive Yukawa potential of DLVO form is studied. To find the location of the phase boundary, we propose a simple theory to calculate the free energies for the coexisting…
We prove the convergence of phase-field approximations of the Gibbs-Thomson law. This establishes a relation between the first variation of the Van-der-Waals-Cahn-Hilliard energy and the first variation of the area functional. We allow for…
The energy functional, the governing partial differential equation(s) (PDE), and the boundary conditions need to be consistent with each other in a modeling system. In electrolyte solution study, people usually use a free energy form of an…
We consider a Cahn-Hilliard equation which is the conserved gradient flow of a nonlocal total free energy functional. This functional is characterized by a Helmholtz free energy density, which can be of logarithmic type. Moreover, the…
In this paper, we study a hydrodynamic phase-field system modeling the deformation of functionalized membranes in incompressible viscous fluids. The governing PDE system consists of the Navier-Stokes equations coupled with a convective…
We derive van der Waals-London and Casimir forces by calculating the eigenmodes of the electromagnetic field interacting with two semi-infinite bodies (two halves of space) with parallel surfaces separated by distance d. We adopt simple…
We describe a general phase-field model for hyperelastic multiphase materials. The model features an elastic energy functional that depends on the phase-field variable and a surface energy term that depends in turn on the elastic…
In order to find the exact form of the electrostatic interaction between two proteins with dissociable charge groups in aqueous solution, we have studied a model system composed of two macroscopic surfaces with charge dissociation sites…