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We propose finite-volume schemes for the Cahn-Hilliard equation which unconditionally and discretely preserve the boundedness of the phase field and the dissipation of the free energy. Our numerical framework is applicable to a variety of…

Numerical Analysis · Mathematics 2023-12-18 Rafael Bailo , José A. Carrillo , Serafim Kalliadasis , Sergio P. Perez

We obtain sharp interior Schauder estimates for solutions to nonlocal Poisson problems driven by fractional powers of nondivergence form elliptic operators $(-a^{ij}(x) \partial_{ij})^s$, for $0<s<1$, in bounded domains under minimal…

Analysis of PDEs · Mathematics 2025-03-17 P. R. Stinga , M. Vaughan

A framework for developing new approximate electronic structure methods is presented, in which the correlation energy of a many-electron system in the ground state is computed as in the single-reference second-order many-body perturbation…

Chemical Physics · Physics 2011-06-15 Dimitri Laikov

Aim of this paper is to prove the second order differentiation formula along geodesics in compact $RCD^*(K,N)$ spaces with $N<\infty$. This formula is new even in the context of Alexandrov spaces. We establish this result by showing that…

Analysis of PDEs · Mathematics 2017-01-17 Nicola Gigli , Luca Tamanini

In this paper we study the regularity of the local minima of integral functionals: in particular, not convexity (quasi-convexity, policonvexity or rank one convexity) hypothesis will be made on the density, neither structure hypothesis nor…

Optimization and Control · Mathematics 2023-02-07 Tiziano Granucci

Development of the electronic kinetic-energy density functional is a subject of major interest in theoretical physics and chemistry. In this work, the nonlocal kinetic-energy functional is developed in terms of the response function for the…

Chemical Physics · Physics 2022-06-17 Hideaki Takahashi

This paper studies proximal gradient iterations for solving simple bilevel optimization problems where both the upper and the lower level cost functions are split as the sum of differentiable and (possibly nonsmooth) proximable functions.…

Optimization and Control · Mathematics 2024-03-05 Puya Latafat , Andreas Themelis , Silvia Villa , Panagiotis Patrinos

Motivated by the computation of the non-parametric maximum likelihood estimator (NPMLE) and the Bayesian posterior in statistics, this paper explores the problem of convex optimization over the space of all probability distributions. We…

Statistics Theory · Mathematics 2023-11-03 Rentian Yao , Linjun Huang , Yun Yang

We present a simple formalism for the calculation of the derivatives of the electronic density matrix at any order, within density functional theory. Our approach, contrary to previous ones, is not based on the perturbative expansion of the…

Materials Science · Physics 2009-11-10 Michele Lazzeri , Francesco Mauri

We propose a procedure - partly analytical and partly numerical - to find the frequency and the damping rate of the small-amplitude oscillations of a massless elastic capsule immersed in a two-dimensional viscous incompressible fluid. The…

Fluid Dynamics · Physics 2014-04-03 Marco Martins Afonso , Simon Mendez , Franck Nicoud

We prove an energy inequality for nonlocal diffusion operators of the following type, and some of its generalisations: $Lu (x) := \int_{\mathbb{R}^N} K(x,y) (u(y) - u(x)) dy$, where $L$ acts on a real function $u$ defined on $\mathbb{R}^N$,…

Analysis of PDEs · Mathematics 2019-10-22 J. A. Cañizo , A. Molino

We establish the gradient flow representation of diffusion with mobility $b$ with respect to the modified Wasserstein quasi-metric $W_h$, where $h(r)=rb(r)$. The appropriate selection of the free energy functional depends on the specific…

Probability · Mathematics 2025-01-22 Zhenxin Liu , Xuewei Wang

When approximating a function that depends on a parameter, one encounters many practical examples where linear interpolation or linear approximation with respect to the parameters prove ineffective. This is particularly true for responses…

Numerical Analysis · Mathematics 2018-12-27 Donsub Rim , Kyle T. Mandli

We develop a theory of existence of minimizers of energy functionals in vectorial problems based on a nonlocal gradient under Dirichlet boundary conditions. The model shares many features with the peridynamics model and is also applicable…

Analysis of PDEs · Mathematics 2022-11-07 José C. Bellido , Javier Cueto , Carlos Mora-Corral

In this paper, we develop and analyze a rigorous multiscale upscaling method for dual continuum model, which serves as a powerful tool in subsurface formation applications. Our proposed method is capable of identifying different continua…

Numerical Analysis · Mathematics 2020-11-04 Jingyan Zhang , Siu Wun Cheung

We study a method for calculating the utility function from a candidate of a demand function that is not differentiable, but is locally Lipschitz. Using this method, we obtain two new necessary and sufficient conditions for a candidate of a…

Theoretical Economics · Economics 2024-04-02 Yuhki Hosoya

We consider local energy decay estimates for solutions to scalar wave equations on nontrapping asymptotically flat space-times. Our goals are two-fold. First we consider the stationary case, where we can provide a full spectral…

Analysis of PDEs · Mathematics 2017-03-24 Jason Metcalfe , Jacob Sterbenz , Daniel Tataru

The three-dimensional jump conditions for the pressure and velocity fields, up to the second normal derivative,across an incompressible/inextensible interface in the Stokes regime are derived herein. The fluid viscosity is only piecewise…

Fluid Dynamics · Physics 2013-09-09 Prerna Gera , David Salac

This paper considers optimization of smooth nonconvex functionals in smooth infinite dimensional spaces. A H\"older gradient descent algorithm is first proposed for finding approximate first-order points of regularized polynomial…

Optimization and Control · Mathematics 2021-04-07 Serge Gratton , Sadok Jerad , Philippe L. Toint

We study the gradient-flow structure of a non-Newtonian thin film equation with power-law rheology. The equation is quasilinear, of fourth order and doubly-degenerate parabolic. By adding a singular potential to the natural Dirichlet…

Analysis of PDEs · Mathematics 2023-01-26 Peter Gladbach , Jonas Jansen , Christina Lienstromberg