scispace - formally typeset
Open AccessBook

Numerical Hamiltonian Problems

Reads0
Chats0
TLDR
Examples of Hamiltonian Systems, symplectic integration, and Numerical Methods: Checking preservation of area: Jacobians, and Necessity of the symplecticness conditions.
Abstract
Hamiltonian Systems. Examples of Hamiltonian Systems. Symplecticness. The solution operator. Preservation of area. Checking preservation of area: Jacobians. Checking preservation of area: differential forms. Symplectic transformations. Conservation of volume. Numerical Methods. Numerical integrators. Stiff problems. Runge-Kutta methods. Partitioned Runge-Kutta methods. Runge-Kutta-Nystrom methods. Composition of methods - adjoints. Order conditions. Order conditions for Runge-Kutta methods. The local error in Runge-Kutta methods. Order conditions for PRK methods. The local error in Partitioned Runge-Kutta methods. Order conditions for Runge-Kutta-Nystrom methods. The local error in Runge-Kutta-Nystrom mehthods. Implementation. Variable step sizes. Embedded pairs. Numerical experience with variable step sizes. Implementing implicit methods. Fourth-order Gauss method. Symplectic integration. Symplectic methods. Symplectic Runge-Kutta methods. Symplectic partitioned Runge-Kutta methods. Symplectic Runge-Kutta-Nystrom methods. Necessity of the symplecticness conditions. Symplectic order conditions. Prelimiaries. Order conditions for symplectic RK methods. Order conditions for symplectic PRK methods. Order conditions for symplectic RKN methods. Homogenous form of the order conditions. Available symplectic methods. Symplecticness of the Gauss methods. Diagonally implicity Runge-Kutta methods. Other symplectic Runge-Kutta methods. Explicit partitioned Runge-Kutta methods. Available symplectic Runge-Kutta-Nystrom methods. Numerical experiments. A comparison of symplectic integrators. Variable step sizes for symplectic methods. Conclusions and recommendations. Properties of symplectic integrators. Backward error interpretation. An alternative approach. Conservation of energy. KAM theory. Generating functions. The concept of generating function. Hamilton-Jacobi equations. Integrators based on generating functions. Generating functions for RK methods. Canonical order theory. Lie formalism. The Poisson bracket. Lie operators and Lie series. The Baker-Campbell-Hausdorff formula. Application to fractional-step methods. Extension to the non-Hamilton case. High-order methods. High-order Lie methods. High-order Runge-Kutta-Nystrom methods. A comparison of order 8 symplectic integrators. Extensions. Partitioned Runge-Kutta methods for nonseparable Hamiltonian systems. Canonical B-series. Conjugate symplectic methods. Trapezoidal rule. Constrained systems. General Poisson structures. Multistep methods. Partial differential equations. Reversable systems. Volume preserving flows.

read more

Citations
More filters
Journal ArticleDOI

Discrete mechanics and variational integrators

TL;DR: In this paper, a review of integration algorithms for finite dimensional mechanical systems that are based on discrete variational principles is presented, including the Verlet, SHAKE, RATTLE, Newmark, and the symplectic partitioned Runge-Kutta schemes.
Book

Geometric numerical integration

TL;DR: This work considers the semi-Lagrangian discontinuous Galerkin method for the Vlasov-Poisson system and discusses the performance of this method and compares it to cubic spline interpolation, where appropriate.
Journal ArticleDOI

Fourth-Order Time-Stepping for Stiff PDEs

TL;DR: A modification of the exponential time-differencing fourth-order Runge--Kutta method for solving stiff nonlinear PDEs is presented that solves the problem of numerical instability in the scheme as proposed by Cox and Matthews and generalizes the method to nondiagonal operators.
Journal ArticleDOI

Langevin stabilization of molecular dynamics

TL;DR: Stable and accurate integrations are obtained for damping coefficients that are only a few percent of the natural decay rate of processes of interest, such as the velocity autocorrelation function.
Journal ArticleDOI

Lie-group methods

TL;DR: A survey of numerical integrators that respect Lie-group structure is given in this paper, highlighting theory, algorithmic issues, and a number of applications in the field of Lie group discretization.