Legendre transforms of electrostatic free-energy functionals

DOI10.1137/18M1167644MaRDI QIDQ4553349zbMATH OpenWikidataFDO

Authors Benjamin Ciotti, Bo Li

Publication date 2 November 2018

Published in SIAM Journal on Applied Mathematics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1137/18M1167644

zbMATH Keywords

electrostatic free-energy functionalsLegendre transformsPoisson-Boltzmann functionalvariational principles

Mathematics Subject Classification ID

Special integral transforms (Legendre, Hilbert, etc.) (44A15) Variational inequalities (49J40) Variational principles of physics (49S05) Electro- and magnetostatics (78A30)

Recommendations

• A fluctuation-corrected functional of convex Poisson-Boltzmann theory
• Minimization of Electrostatic Free Energy and the Poisson–Boltzmann Equation for Molecular Solvation with Implicit Solvent
• The calculus of boundary variations and the dielectric boundary force in the Poisson-Boltzmann theory for molecular solvation
• Legendre transforms in nonequilibrium thermodynamics: an illustration in electrical systems
• Analysis of the mean field free energy functional of electrolyte solution with nonhomogenous boundary conditions and the generalized PB/PNP equations with inhomogeneous dielectric permittivity

Cites work

• Continuum electrostatics for ionic solutions with non-uniform ionic sizes
• Convergence of phase-field free energy and boundary force for molecular solvation
• Convex Analysis
• Dielectric boundary force in molecular solvation with the Poisson-Boltzmann free energy: a shape derivative approach
• Diffused Solute-Solvent Interface with Poisson--Boltzmann Electrostatics: Free-Energy Variation and Sharp-Interface Limit
• Elliptic partial differential equations of second order
• scientific article; zbMATH DE number 3906935 (Why is no real title available?)
• scientific article; zbMATH DE number 3491650 (Why is no real title available?)
• scientific article; zbMATH DE number 5681750 (Why is no real title available?)
• scientific article; zbMATH DE number 3044887 (Why is no real title available?)
• Ionic size effects: generalized Boltzmann distributions, counterion stratification and modified Debye length
• Minimization of Electrostatic Free Energy and the Poisson–Boltzmann Equation for Molecular Solvation with Implicit Solvent

Cited in

(6)

• On a class of integrals of Legendre polynomials with complicated arguments - with applications in electrostatics and biomolecular modeling
• Free Energies of Macroionic Suspensions and the Equation of State for Osmotic Pressure
• A fluctuation-corrected functional of convex Poisson-Boltzmann theory
• Modified Poisson-Nernst-Planck model with Coulomb and hard-sphere correlations
• Legendre transforms in nonequilibrium thermodynamics: an illustration in electrical systems
• Variational implicit solvation with Legendre-transformed Poisson-Boltzmann electrostatics

This page was built for publication: Legendre transforms of electrostatic free-energy functionals

Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q4553349)