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Many chemical reactions and molecular processes occur on timescales that are significantly longer than those accessible by direct simulation. One successful approach to estimating dynamical statistics for such processes is to use many short…

Computational Physics · Physics 2024-10-03 Chatipat Lorpaiboon , Spencer C. Guo , John Strahan , Jonathan Weare , Aaron R. Dinner

Elucidating physical mechanisms with statistical confidence from molecular dynamics simulations can be challenging owing to the many degrees of freedom that contribute to collective motions. To address this issue, we recently introduced a…

Data Analysis, Statistics and Probability · Physics 2020-09-10 John Strahan , Adam Antoszewski , Chatipat Lorpaiboon , Bodhi P. Vani , Jonathan Weare , Aaron R. Dinner

Markov expanding maps, a class of simple chaotic systems, are commonly used as models for chaotic dynamics, but existing numerical methods to study long-time statistical properties such as invariant measures have a poor trade-off between…

Dynamical Systems · Mathematics 2020-11-02 Caroline L. Wormell

The paper deals with a stochastic Galerkin approximation of elliptic Dirichlet boundary control problems with random input data. The expectation of a tracking cost functional with the deterministic constrained control is minimized. Error…

Optimization and Control · Mathematics 2025-06-16 Max Winkler , Hamdullah Yücel

Complementarity problems and variational inequalities arise in a wide variety of areas, including machine learning, planning, game theory, and physical simulation. In all of these areas, to handle large-scale problem instances, we need fast…

Machine Learning · Computer Science 2013-06-21 Geoffrey J. Gordon

In uncertainty quantification, critical parameters of mathematical models are substituted by random variables. We consider dynamical systems composed of ordinary differential equations. The unknown solution is expanded into an orthogonal…

Numerical Analysis · Mathematics 2019-04-10 Roland Pulch , Florian Augustin

We consider linear dynamical systems of ordinary differential equations or differential algebraic equations. Physical parameters are substituted by random variables for an uncertainty quantification. We expand the state variables as well as…

Numerical Analysis · Mathematics 2016-05-24 Roland Pulch

We propose a projection-based model order reduction method for the solution of parameter-dependent dynamical systems. The proposed method relies on the construction of time-dependent reduced spaces generated from evaluations of the solution…

Numerical Analysis · Mathematics 2019-09-11 Marie Billaud-Friess , Anthony Nouy

For finite element approximations of transport phenomena, it is often necessary to apply a form of limiting to ensure that the discrete solution remains well-behaved and satisfies physical constraints. However, these limiting procedures are…

Numerical Analysis · Mathematics 2024-04-12 Tarik Dzanic

In this paper we propose and analyze a Discontinuous Galerkin method for a linear parabolic problem with dynamic boundary conditions. We present the formulation and prove stability and optimal a priori error estimates for the fully discrete…

Numerical Analysis · Mathematics 2015-01-21 Paola F. Antonietti , Maurizio Grasselli , Simone Stangalino , Marco Verani

Switching dynamical systems provide a powerful, interpretable modeling framework for inference in time-series data in, e.g., the natural sciences or engineering applications. Since many areas, such as biology or discrete-event systems, are…

Machine Learning · Computer Science 2021-09-30 Lukas Köhs , Bastian Alt , Heinz Koeppl

We introduce a classical computational method for quantum dynamics that relies on a global-in-time variational principle. Unlike conventional time-stepping approaches, our scheme computes the entire state trajectory over a finite time…

Quantum Physics · Physics 2026-04-27 Alessandro Sinibaldi , Douglas Hendry , Filippo Vicentini , Giuseppe Carleo

We propose a new parallel Discontinuous Galerkin method for the approximation of hyperbolic systems of conservation laws. The method remains stable with large time steps, while keeping the complexity of an explicit scheme: it does not…

Numerical Analysis · Mathematics 2024-02-27 Pierre Gerhard , Philippe Helluy , Victor Michel-Dansac , Bruno Weber

These lecture notes introduce the statistical analysis of continuous-time generative models built from Markov dynamics. We begin with the stochastic-calculus foundations of score-based diffusion models, including time reversal, score…

Statistics Theory · Mathematics 2026-04-27 Eddie Aamari , Arthur Stéphanovitch

A variety of enhanced statistical and numerical methods are now routinely used to extract comprehensible and relevant thermodynamic information from the vast amount of complex, high-dimensional data obtained from intensive molecular…

Soft Condensed Matter · Physics 2020-10-14 Francois Sicard , Vladimir Koskin , Alessia Annibale , Edina Rosta

We investigate numerical behaviour of a convection diffusion equation with random coefficients by approximating statistical moments of the solution. Stochastic Galerkin approach, turning the original stochastic problem to a system of…

Numerical Analysis · Mathematics 2021-10-19 Pelin Çiloğlu , Hamdullah Yücel

The discontinuous Galerkin (DG) method is an established method for computing approximate solutions of partial differential equations in many applications. Unlike continuous finite elements, in DG methods, numerical fluxes are used to…

Numerical Analysis · Mathematics 2019-12-02 Kenneth Duru , Leonhard Rannabauer , Alice-Agnes Gabriel , Heiner Igel

Mathematical modeling at the level of the full cardiovascular system requires the numerical approximation of solutions to a one-dimensional nonlinear hyperbolic system describing flow in a single vessel. This model is often simulated by…

Computational Physics · Physics 2015-04-22 Sebastian Acosta , Charles Puelz , Beatrice Riviere , Daniel J. Penny , Craig G. Rusin

We develop a stochastic Galerkin method for a coupled Navier-Stokes-cloud system that models dynamics of warm clouds. Our goal is to explicitly describe the evolution of uncertainties that arise due to unknown input data, such as model…

Numerical Analysis · Mathematics 2022-04-20 A. Chertock , A. Kurganov , M. Lukáčová-Medviďová , P. Spichtinger , B. Wiebe

We propose and analyze discontinuous Galerkin (dG) approximations to 3D-1D coupled systems which model diffusion in a 3D domain containing a small inclusion reduced to its 1D centerline. Convergence to weak solutions of a steady state…

Numerical Analysis · Mathematics 2023-12-29 Rami Masri , Miroslav Kuchta , Beatrice Riviere
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