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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

In this paper, we consider a nonlinear and nonlocal parabolic model for multi-species ionic fluids and introduce a semi-implicit finite volume scheme, which is second order accurate in space, first order in time and satisfies the following…

Numerical Analysis · Mathematics 2020-07-01 Yong Zhang , Yu Zhao , Zhennan Zhou

In this study, a novel semi-implicit second-order temporal scheme combined with the finite element method for space discretization is proposed to solve the coupled system of infiltration and solute transport in unsaturated porous media. The…

Numerical Analysis · Mathematics 2024-06-11 Nour-eddine Toutlini , Abdelaziz Beljadid , Azzeddine Soulaïmani

We propose a new explicit pseudo-energy and momentum conserving scheme for the time integration of Hamiltonian systems. The scheme, which is formally second-order accurate, is based on two key ideas: the integration during the time-steps of…

Numerical Analysis · Mathematics 2020-08-14 Frédéric Marazzato , Alexandre Ern , Christian Mariotti , Laurent Monasse

We present a new temporal discretization paradigm for developing energy-production-rate preserving numerical approximations to thermodynamically consistent partial differential equation systems, called the supplementary variable method. The…

Numerical Analysis · Mathematics 2020-06-09 Yuezheng Gong , Qi Hong , Qi Wang

We develop an effective field theory for dissipative fluids which governs the dynamics of long-lived gapless modes associated with conserved quantities. The resulting theory gives a path integral formulation of fluctuating hydrodynamics…

High Energy Physics - Theory · Physics 2017-01-30 Michael Crossley , Paolo Glorioso , Hong Liu

In this work, we propose a novel phase-field model for the simulation of two-phase flows that is accurate, conservative, bounded, and robust. The proposed model conserves the mass of each of the phases, and results in bounded transport of…

Computational Physics · Physics 2022-08-23 Suhas S. Jain

We discuss the efficient implementation of a high-performance second-order collocation-type finite-element scheme for solving the compressible Euler equations of gas dynamics on unstructured meshes. The solver is based on the convex…

Mathematical Software · Computer Science 2021-02-04 Matthias Maier , Martin Kronbichler

A time-fractional Allen-Cahn equation with volume constraint is first proposed by introducing a nonlocal time-dependent Lagrange multiplier. Adaptive linear second-order energy stable schemes are developed for the proposed model by…

Numerical Analysis · Mathematics 2020-12-23 Bingquan Ji , Hong-lin Liao , Yuezheng Gong , Luming Zhang

Two-fluid plasma flow equations describe the flow of ions and electrons with different densities, velocities, and pressures. We consider the ideal plasma flow i.e. we ignore viscous, resistive, and collision effects. The resulting system of…

Numerical Analysis · Mathematics 2024-09-25 Jaya Agnihotri , Deepak Bhoriya , Harish Kumar , Praveen Chandrashekhar , Dinshaw S. Balsara

In this paper, we consider the numerical approximations for a hydrodynamical model of smectic-A liquid crystals. The model, derived from the variational approach of the modified Oseen-Frank energy, is a highly nonlinear system that couples…

Numerical Analysis · Mathematics 2017-10-05 Rui Chen , Xiaofeng Yang , Hui Zhang

This paper presents a new resolution strategy for multi-scale streamer discharge simulations based on a second order time adaptive integration and space adaptive multiresolution. A classical fluid model is used to describe plasma…

Numerical Analysis · Mathematics 2012-04-10 Max Duarte , Zdenek Bonaventura , Marc Massot , Anne Bourdon , Stéphane Descombes , Thierry Dumont

This article focuses on the development of high-order energy stable schemes for the multi-length-scale incommensurate phase-field crystal model which is able to study the phase behavior of aperiodic structures. These high-order schemes…

Numerical Analysis · Mathematics 2020-08-31 Kai Jiang , Wei Si

This article focuses on the development of high-order energy stable schemes for the multi-length-scale incommensurate phase-field crystal model which is able to study the phase behavior of aperiodic structures. These high-order schemes…

Numerical Analysis · Mathematics 2020-05-26 Kai Jiang , Wei Si

A second order accurate numerical scheme is proposed and implemented for the Landau-Lifshitz-Gilbert equation, which models magnetization dynamics in ferromagnetic materials, with large damping parameters. The main advantages of this method…

Computational Physics · Physics 2022-01-26 Yongyong Cai , Jingrun Chen , Cheng Wang , Changjian Xie

In this paper, we design a novel class of arbitrarily high-order structure-preserving numerical schemes for the time-dependent Gross-Pitaevskii equation with angular momentum rotation in three dimensions. Based on the idea of the scalar…

Numerical Analysis · Mathematics 2021-02-03 Jin Cui , Yushun Wang , Chaolong Jiang

To address the magnetization dynamics in ferromagnetic materials described by the Landau-Lifshitz-Gilbert equation under large damping parameters, a third-order accurate numerical scheme is developed by building upon a second-order method…

Numerical Analysis · Mathematics 2025-10-31 Changjian Xie , Cheng Wang

We derive a second-order realizability-preserving scheme for moment models for linear kinetic equations. We apply this scheme to the first-order continuous and discontinuous models in slab and three-dimensional geometry derived in a…

Numerical Analysis · Mathematics 2021-07-13 Florian Schneider , Tobias Leibner

In this paper, we present a novel second-order generalised rotational discrete gradient scheme for numerically approximating the orthonormal frame gradient flow of biaxial nematic liquid crystals. This scheme relies on reformulating the…

Numerical Analysis · Mathematics 2023-10-17 Hanbin Wang , Jie Xu , Zhiguo Yang

In this paper, we present two multiple scalar auxiliary variable (MSAV)-based, finite element numerical schemes for the Abels-Garcke-Gr{\"u}n (AGG) model, which is a thermodynamically consistent phase field model of two-phase incompressible…

Numerical Analysis · Mathematics 2024-08-09 Jiancheng Wang , Maojun Li , Cheng Wang