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A new approach is developed to integrate numerically the equations of motion for systems of interacting rigid polyatomic molecules. With the aid of a leapfrog framework, we directly involve principal angular velocities into the integration,…

Computational Physics · Physics 2007-05-23 Igor P. Omelyan

The leapfrog integrator is widely used because of its excellent stability in molecular dynamics simulation. This is recognized as being due to the existence of a discrete variational structure of the equations. We introduce a modified…

Computational Physics · Physics 2015-06-12 A. C. Maggs

A class of explicit numerical schemes is developed to solve for the relativistic dynamics and spin of particles in electromagnetic fields, using the Lorentz-BMT equation formulated in the Clifford algebra representation of Baylis. It is…

Computational Physics · Physics 2021-05-05 R. Cabrera , A. G. Campos , D. I. Bondar , S. MacLean , F. Fillion-Gourdeau

Time-centered, hence second-order, methods for integrating the relativistic momentum of charged particles in an electromagnetic field are derived. A new method is found by averaging the momentum before use in the magnetic rotation term, and…

Plasma Physics · Physics 2017-05-24 Adam V. Higuera , John R. Cary

Conventional explicit electromagnetic particle-in-cell (PIC) algorithms do not conserve discrete energy exactly. Time-centered fully implicit PIC algorithms can conserve discrete energy exactly, but may introduce large dispersion errors in…

Computational Physics · Physics 2020-02-19 Guangye Chen , Luis Chacón , Lin Yin , Brian J. Albright , David J. Stark , Robert F. Bird

A new algorithm for numerical integration of the rigid-body equations of motion is proposed. The algorithm uses the leapfrog scheme and the quantities involved are angular velocities and orientational variables which can be expressed in…

Computational Physics · Physics 2016-09-08 Igor P. Omelyan

In this work, we consider the error estimates and the long-time conservation or near-conservation of geometric structures, including energy, mass shell and phase-space volume, for four two-step symmetric methods applied to relativistic…

Numerical Analysis · Mathematics 2025-09-05 Ting Li , Bin Wang , Ruili Zhang

In this paper, energy-preserving methods are formulated and studied for solving charged-particle dynamics. We first formulate the scheme of energy-preserving methods and analyze its basic properties including algebraic order and symmetry.…

Numerical Analysis · Mathematics 2018-12-31 Ting Li , Bin Wang

The Boris algorithm, a closely related variational integrator and a newly proposed filtered variational integrator are studied when they are used to numerically integrate the equations of motion of a charged particle in a non-uniform strong…

Numerical Analysis · Mathematics 2021-01-27 Ernst Hairer , Christian Lubich , Yanyan Shi

A new algorithm is introduced to integrate the equations of rotational motion. The algorithm is derived within a leapfrog framework and the quantities involved into the integration are mid-step angular momenta and on-step orientational…

Computational Physics · Physics 2007-05-23 Igor P. Omelyan

By introducing an integration factor to the differential one-form of contact dynamics, equations of motion are derived variationally, and contact Poisson bracket and contact Lagrangian are formulated. Discrete symplectic integrator, named…

Mathematical Physics · Physics 2022-07-15 Kiyoshi Sogo , Shuhei Ohnishi

The 3-level leapfrog time integration algorithm is an attractive choice for numerical relativity simulations since it is time-symmetric and avoids non-physical damping. In Newtonian problems without velocity dependent forces, this method…

General Relativity and Quantum Cosmology · Physics 2009-10-31 Kimberly C. B. New , Keith Watt , Charles W. Misner , Joan M. Centrella

The state of art of charge-conserving electromagnetic finite element particle-in-cell has grown by leaps and bounds in the past few years. These advances have primarily been achieved for leap-frog time stepping schemes for Maxwell solvers,…

Numerical Analysis · Mathematics 2023-05-10 Omkar H. Ramachandran , Leo C. Kempel , John Luginsland , B. Shanker

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

Classical relativistic system of point particles coupled with an electromagnetic field is considered in the three-dimensional representation. The gauge freedom connected with the chronometrical invariance of the four-dimensional description…

High Energy Physics - Theory · Physics 2007-05-23 V. Tretyak , A. Nazarenko

The Boris algorithm for integrating charged particle trajectories in electric and magnetic fields is popular due to its simple implementation, rapid iteration, and observed long-term numerical fidelity. The underlying cause of this…

Computational Physics · Physics 2015-09-10 C. L. Ellison , J. W. Burby , H. Qin

Variational integrators for Lagrangian dynamical systems provide a systematic way to derive geometric numerical methods. These methods preserve a discrete multisymplectic form as well as momenta associated to symmetries of the Lagrangian…

Numerical Analysis · Mathematics 2017-10-05 Michael Kraus , Omar Maj

Hill's equations are an approximation that is useful in a number of areas of astrophysics including planetary rings and planetesimal disks. We derive a symplectic method for integrating Hill's equations based on a generalized leapfrog. This…

Earth and Planetary Astrophysics · Physics 2015-05-13 T. Quinn , R. P. Perrine , D. C. Richardson , R. Barnes

We develop the equations of motion for full body models that describe the dynamics of rigid bodies, acting under their mutual gravity. The equations are derived using a variational approach where variations are defined on the Lie group of…

Numerical Analysis · Mathematics 2009-09-29 Taeyoung Lee , Melvin Leok , N. Harris McClamroch

This paper investigates the equations of motion for a relativistic charged particle in a general magnetic field. By reformulating the dynamics in four-dimensional spacetime and separating the linear and nonlinear parts, we construct an…

Numerical Analysis · Mathematics 2026-03-24 Zhirui Shen , Bin Wang
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