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A new methodology is developed to integrate numerically the equations of motion for classical many-body systems in molecular dynamics simulations. Its distinguishable feature is the possibility to preserve, independently on the size of the…

Statistical Mechanics · Physics 2009-10-31 I. P. Omelyan , I. M. Mryglod , R. Folk

We reconsider the variational integration of optimal control problems for mechanical systems based on a direct discretization of the Lagrange-d'Alembert principle. This approach yields discrete dynamical constraints which by construction…

Optimization and Control · Mathematics 2012-04-30 C. M. Campos , O. Junge , S. Ober-Blöbaum

A proof of optimal-order error estimates is given for the full discretization of the Cahn--Hilliard equation with Cahn--Hilliard-type dynamic boundary conditions in a smooth domain. The numerical method combines a linear bulk--surface…

Numerical Analysis · Mathematics 2025-01-15 Nils Bullerjahn , Balázs Kovács

In this manuscript we present a novel and efficient numerical method for the compressible viscous and resistive MHD equations for all Mach number regimes. The time-integration strategy is a semi-implicit splitting, combined with a hybrid…

Numerical Analysis · Mathematics 2024-07-22 Francesco Fambri , Eric Sonnendrücker

Non-local systems of conservation laws play a crucial role in modeling flow mechanisms across various scenarios. The well-posedness of such problems is typically established by demonstrating the convergence of robust first-order schemes.…

Numerical Analysis · Mathematics 2025-01-07 Nikhil Manoj , G. D. Veerappa Gowda , Sudarshan Kumar K

In this paper, we analyze the discrete inf-sup condition and related error estimates for a modified Hilbert transformation as used in the space-time discretization of time-dependent partial differential equations. It turns out that the…

Numerical Analysis · Mathematics 2024-02-14 Richard Löscher , Olaf Steinbach , Marco Zank

This paper presents an asymptotic preserving (AP) all Mach number finite volume shock capturing method for the numerical solution of compressible Euler equations of gas dynamics. Both isentropic and full Euler equations are considered. The…

Numerical Analysis · Mathematics 2017-06-02 S. Boscarino , G. Russo , L. Scandurra

We construct high order symmetric volume-preserving methods for the relativistic dynamics of a charged particle by the splitting technique with processing. Via expanding the phase space to include time $t$, we give a more general…

Computational Physics · Physics 2016-10-12 Yang He , Yajuan Sun , Ruili Zhang , Yulei Wang , Jian Liu , Hong Qin

In this paper, a second order finite difference scheme is investigated for time-dependent one-side space fractional diffusion equations with variable coefficients. The existing schemes for the equation with variable coefficients have…

Numerical Analysis · Mathematics 2019-02-25 Xue-lei Lin , Pin Lyu , Michael K. Ng , Hai-Wei Sun , Seakweng Vong

Just like decent classical difference-difference systems define symplectic maps on suitable phase spaces, their counterparts with properly ordered noncommutative entries come as Heisenberg equations of motion for corresponding quantum…

High Energy Physics - Theory · Physics 2007-05-23 L. D. Faddeev , A. Yu. Volkov

Structure-preserving geometric algorithm for the Vlasov-Maxwell (VM) equations is currently an active research topic. We show that spatially-discretized Hamiltonian systems for the VM equations admit a local energy conservation law in…

Computational Physics · Physics 2017-08-02 Jianyuan Xiao , Hong Qin , Jian Liu , Ruili Zhang

We present high-order variational Lagrangian finite element methods for compressible fluids using a discrete energetic variational approach. Our spatial discretization is mass/momentum/energy conserving and entropy stable. Fully implicit…

Numerical Analysis · Mathematics 2023-08-16 Guosheng Fu , Chun Liu

We propose and analyze a space-time finite element method for Westervelt's quasilinear model of ultrasound waves in second-order formulation. The method combines conforming finite element spatial discretizations with a…

Numerical Analysis · Mathematics 2025-06-19 Sergio Gómez , Vanja Nikolić

We propose and analyse a novel surface finite element method that preserves the invariant regions of systems of semilinear parabolic equations on closed compact surfaces in $\mathbb{R}^3$ under discretisation. We also provide a…

Numerical Analysis · Mathematics 2020-01-20 Massimo Frittelli , Anotida Madzvamuse , Ivonne Sgura , Chandrasekhar Venkataraman

The Active Flux method can be seen as an extended finite volume method. The degrees of freedom of this method are cell averages, as in finite volume methods, and in addition shared point values at the cell interfaces, giving rise to a…

Numerical Analysis · Mathematics 2025-12-05 Wasilij Barsukow , Praveen Chandrashekar , Christian Klingenberg , Lisa Lechner

Explicit time integration for immersed finite element discretizations severely suffers from the influence of poorly cut elements. In this contribution, we propose a generalized eigenvalue stabilization (GEVS) strategy for the element mass…

Computational Engineering, Finance, and Science · Computer Science 2026-01-28 Tim Bürchner , Lars Radtke , Sascha Eisenträger , Alexander Düster , Ernst Rank , Stefan Kollmannsberger , Philipp Kopp

This is a study of certain finite element methods designed for convection-dominated, time-dependent partial differential equations. Specifically, we analyze high order space-time tensor product finite element discretizations, used in a…

Numerical Analysis · Mathematics 2013-10-30 Randolph E. Bank , Maximilian S. Metti

We develop a linear fully discrete structure-preserving finite element method for a diffuse-interface model of tumour growth. The system couples a Cahn--Hilliard type equation with a nonlinear reaction-diffusion equation for nutrient…

Numerical Analysis · Mathematics 2025-10-23 Agus L. Soenjaya , Ping Lin , Thanh Tran

We consider convection-diffusion problems in time-dependent domains and present a space-time finite element method based on quadrature in time which is simple to implement and avoids remeshing procedures as the domain is moving. The…

Numerical Analysis · Mathematics 2017-07-25 Sara Zahedi

We derive thermodynamically consistent models for diblock copolymer solutions coupled with the electric and magnetic field, respectively. These models satisfy the second law of thermodynamics and therefore are therefore thermodynamically…

Numerical Analysis · Mathematics 2021-03-30 Xiaowen Shen , Qi Wang