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Variational representations of divergences and distances between high-dimensional probability distributions offer significant theoretical insights and practical advantages in numerous research areas. Recently, they have gained popularity in…

Machine Learning · Computer Science 2022-03-25 Jeremiah Birrell , Markos A. Katsoulakis , Yannis Pantazis

The proliferation of 3D representations, from explicit meshes to implicit neural fields and more, motivates the need for simulators agnostic to representation. We present a data-, mesh-, and grid-free solution for elastic simulation for any…

Computer Vision and Pattern Recognition · Computer Science 2024-07-16 Vismay Modi , Nicholas Sharp , Or Perel , Shinjiro Sueda , David I. W. Levin

The Poisson equation is commonly encountered in engineering, for instance in computational fluid dynamics (CFD) where it is needed to compute corrections to the pressure field to ensure the incompressibility of the velocity field. In the…

In this work, we propose a geometric framework for analyzing mechanical manipulation, for instance, by a robotic agent. Under the assumption of conservative forces and quasi-static manipulation, we use energy methods to derive a metric. In…

Optimization and Control · Mathematics 2024-02-27 Domenico Campolo , Franco Cardin

Although EDM aims to unify the design space of diffusion models, its reliance on fixed Gaussian noise prevents it from explaining emerging flow-based methods that diffuse arbitrary noise. Moreover, our study reveals that EDM's forcible…

Computer Vision and Pattern Recognition · Computer Science 2026-03-06 Xingyu Qiu , Mengying Yang , Xinghua Ma , Dong Liang , Fanding Li , Gongning Luo , Wei Wang , Kuanquan Wang , Shuo Li

The cubic regularized Newton method of Nesterov and Polyak has become increasingly popular for non-convex optimization because of its capability of finding an approximate local solution with second-order guarantee. Several recent works…

Optimization and Control · Mathematics 2018-11-29 Junyu Zhang , Lin Xiao , Shuzhong Zhang

We propose a communication efficient quasi-Newton method for large-scale multi-agent convex composite optimization. We assume the setting of a network of agents that cooperatively solve a global minimization problem with strongly convex…

Optimization and Control · Mathematics 2022-02-18 Yichuan Li , Petros G. Voulgaris , Nikolaos M. Freris

Precise tracking and measurement of the energy carried by the individual magnetohydrodynamic (MHD) modes has important implications and utility in astrophysical and laboratory plasmas. Previously, this was only achievable in limited linear…

Solar and Stellar Astrophysics · Physics 2025-02-25 Abbas Raboonik , David I. Pontin , Lucas A. Tarr

We present a collection of algorithms which utilize dimensional reduction to perform mesh refinement and study possibly singular solutions of time-dependent partial differential equations. The algorithms are inspired by constructions used…

Numerical Analysis · Mathematics 2007-06-21 Panagiotis Stinis

Optimization in Deep Learning is mainly dominated by first-order methods which are built around the central concept of backpropagation. Second-order optimization methods, which take into account the second-order derivatives are far less…

Machine Learning · Computer Science 2021-04-09 Fares B. Mehouachi , Chaouki Kasmi

The layout optimization of the heat conduction is essential during design in engineering, especially for thermal sensible products. When the optimization algorithm iteratively evaluates different loading cases, the traditional numerical…

Machine Learning · Computer Science 2022-01-26 Hao Ma , Yang Sun , Mario Chiarelli

We propose a numerical method for fluid deformable surfaces governed by surface Stokes flow and Helfrich bending energy under active growth, aiming to model shape evolution of the epithelium in developmental processes. To prevent…

Fluid Dynamics · Physics 2026-02-17 Maik Porrmann , Sören Bartels , Axel Voigt

We analyze Newton's method with lazy Hessian updates for solving general possibly non-convex optimization problems. We propose to reuse a previously seen Hessian for several iterations while computing new gradients at each step of the…

Optimization and Control · Mathematics 2023-06-16 Nikita Doikov , El Mahdi Chayti , Martin Jaggi

To interpret molecular dynamics (MD) simulations, it is common practice to reduce the dimensionality of the molecular coordinates to a low-dimensional collective variable $x$. Projecting the high-dimensional MD data onto $x$ yields a free…

Soft Condensed Matter · Physics 2026-02-25 Sofia Sartore , Daniel Nagel , Georg Diez , Gerhard Stock

Fixed-point or Newton-methods are typically employed for the numerical solution of nonlinear systems arising from discretization of nonlinear magnetic field problems. We here discuss an alternative strategy which uses local Quasi-Newton…

Numerical Analysis · Mathematics 2024-09-11 Herbert Egger , Felix Engertsberger , Lukas Domenig , Klaus Roppert , Manfred Kaltenbacher

We present a second order numerical scheme to compute capillary bridges between arbitrary solids by minimizing the total energy of all interfaces. From a theoretical point of view, this approach can be interpreted as the computation of…

Numerical Analysis · Mathematics 2021-01-01 Stephan Schmidt , Melanie Gräßer , Hans-Joachim Schmid

The potential energy formulation and deep learning are merged to solve partial differential equations governing the deformation in hyperelastic and viscoelastic materials. The presented deep energy method (DEM) is self-contained and…

Machine Learning · Computer Science 2022-05-05 Diab W. Abueidda , Seid Koric , Rashid Abu Al-Rub , Corey M. Parrott , Kai A. James , Nahil A. Sobh

This paper is devoted to the numerical solution of constrained energy minimization problems arising in computational physics and chemistry such as the Gross-Pitaevskii and Kohn-Sham models. In particular, we introduce the Riemannian Newton…

Numerical Analysis · Mathematics 2024-06-28 R. Altmann , D. Peterseim , T. Stykel

Three-dimensional charge density maps computed by first-principles methods provide information about atom positions and the bonds between them, data which is particularly valuable when trying to understand the properties of point defects,…

Materials Science · Physics 2008-10-22 Christoph T. Koch

Recently, 3D Gaussian Splatting (3DGS) greatly accelerated mesh extraction from posed images due to its explicit representation and fast software rasterization. While the addition of geometric losses and other priors has improved the…

Computer Vision and Pattern Recognition · Computer Science 2026-04-23 Lukas Radl , Felix Windisch , Andreas Kurz , Thomas Köhler , Michael Steiner , Markus Steinberger