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An approach is proposed to improve the efficiency of fourth-order algorithms for numerical integration of the equations of motion in molecular dynamics simulations. The approach is based on an extension of the decomposition scheme by…

Statistical Mechanics · Physics 2009-11-07 Igor Omelyan , Ihor Mryglod , Reinhard Folk

This contribution presents an integration method based on the Simpson quadrature. The integrator is designed for finite-dimensional nonlinear mechanical systems that derive from variational principles. The action is discretized using…

Numerical Analysis · Mathematics 2025-12-04 Juan Antonio Rojas-Quintero , François Dubois , Frédéric Jourdan

This paper presents a case study of application of the preconditioned method of conjugate gradients (CG) on a problem with operator resembling the structure of sum of Kronecker products. In particular, we are solving the Poisson's equation…

Numerical Analysis · Mathematics 2025-01-08 Věnceslav Chumchal , Pavel Marton , Martin Plešinger , Martina Šimůnková

We propose a second order exponential scheme suitable for two-component coupled systems of stiff evolutionary advection--diffusion--reaction equations in two and three space dimensions. It is based on a directional splitting of the involved…

Numerical Analysis · Mathematics 2023-11-27 Marco Caliari , Fabio Cassini

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

This work proposes and analyzes a generalized acceleration technique for decreasing the computational complexity of using stochastic collocation (SC) methods to solve partial differential equations (PDEs) with random input data. The SC…

Numerical Analysis · Mathematics 2015-05-05 Diego Galindo , Peter Jantsch , Clayton G. Webster , Guannan Zhang

Two-beam coupling within the field of nonlinear optics, which transfers energy from one light beam to the other under certain conditions, has received considerable attention in inertial confinement fusion (ICF) and plasma optics. To…

Computational Physics · Physics 2022-08-30 Xiaobao Jia , Qing Jia , Jianyuan Xiao , Jian Zheng

We present IAS15, a 15th-order integrator to simulate gravitational dynamics. The integrator is based on a Gau\ss-Radau quadrature and can handle conservative as well as non-conservative forces. We develop a step-size control that can…

Earth and Planetary Astrophysics · Physics 2015-06-22 Hanno Rein , David S. Spiegel

An explicit second-order numerical method to integrate the isokinetic equations of motion is derived by fitting circular arcs through every three consecutive points of the discretized trajectory, so that the tangent and the curvature…

Chemical Physics · Physics 2018-11-01 Dimitri Laikov

The equations describing the motion of finite-size particles (inertial particles) contain in their full form the history force. This force is represented by an integral whose accurate numerical evaluation is rather difficult. Here, a…

Computational Physics · Physics 2013-08-27 Anton Daitche

Simulation of high-order nonlinear system requires extensive computational resources, especially in modern VLSI backend design where bifurcation-induced instability and chaos-like transient behaviors pose challenges. We present S-Crescendo…

Signal Processing · Electrical Eng. & Systems 2025-05-20 Junlang Huang , Hao Chen , Li Luo , Yong Cai , Lexin Zhang , Tianhao Ma , Yitian Zhang , Zhong Guan

The numerical simulation of three-dimensional charged-particle dynamics (CPD) under strong magnetic field is a basic and challenging algorithmic task in plasma physics. In this paper, we introduce a new methodology to design two-scale…

Numerical Analysis · Mathematics 2024-09-20 Bin Wang , Zhen Miao , Yaolin Jiang

A high-order Flux reconstruction implementation of the hyperbolic formulation for the incompressible Navier-Stokes equation is presented. The governing equations employ Chorin's classical artificial compressibility (AC) formulation cast in…

Computational Physics · Physics 2021-06-04 Mohamed M. Kamra , Jabir Al-Salami , Changhong Hu

The venerable 2D point-vortex model plays an important role as a simplified version of many disparate physical systems, including superfluids, Bose-Einstein condensates, certain plasma configurations, and inviscid turbulence. This system is…

Chaotic Dynamics · Physics 2013-05-29 Spencer A. Smith , Bruce M. Boghosian

The numerical simulation of incompressible flows is challenging due to the tight coupling of velocity and pressure. Projection methods offer an effective solution by decoupling these variables, making them suitable for large-scale…

Numerical Analysis · Mathematics 2025-12-12 Mejdi Azaïez , Yayu Guo , Carlos Núñez Fernández , Samuele Rubino , Chuanju Xu

Thermodynamics of spin dimer system BaCuSi_2O_6 is studied using a quantum Monte Carlo calculation (QMC) and a bond-operator mean field theory. We propose that a new type of boson, which, rather than being hard-core, allows up to two…

Other Condensed Matter · Physics 2009-11-11 Kwai-Kong Ng , Ting-Kuo Lee

We present a high-order shifted Gegenbauer pseudospectral method (SGPM) to solve numerically the second-order one-dimensional hyperbolic telegraph equation provided with some initial and Dirichlet boundary conditions. The framework of the…

Numerical Analysis · Mathematics 2023-03-06 Kareem T. Elgindy

This study presents an efficient, accurate, effective and unconditionally stable time stepping scheme for the Darcy-Brinkman equations in double-diffusive convection. The stabilization within the proposed method uses the idea of stabilizing…

Numerical Analysis · Mathematics 2018-04-10 Aytekin Çıbık , Medine Demir , Songul Kaya

Discrete variational methods show excellent performance in numerical simulations of mechanical systems. In this paper, we adapt discrete variational integrators for the case of mechanical systems with double-bracket dissipation. In…

Numerical Analysis · Mathematics 2026-04-30 Anthony Bloch , Sebastián J. Ferraro , David Martín de Diego , Shreyas Bharadwaj