Smoothed dynamics of highly oscillatory Hamiltonian systems

DOI10.1016/0167-2789(95)00212-XzbMath0884.34012OpenAlexW2049432895WikidataQ127754813 ScholiaQ127754813MaRDI QIDQ1903314

Sebastian Reich

Publication date: 28 November 1995

Published in: Physica D (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/0167-2789(95)00212-x

zbMATH Keywords

Hamiltonian systemsmolecular dynamics simulationshighly oscillatory Hamiltonian system

Mathematics Subject Classification ID

Numerical methods for initial value problems involving ordinary differential equations (65L05) Dynamical aspects of finite-dimensional Hamiltonian and Lagrangian systems (37J99) Holonomic systems related to the dynamics of a system of particles (70F20) Hamiltonian and Lagrangian mechanics (70H99) Numerical analysis in abstract spaces (65J99)

Related Items (11)

Large-scale simulation of graphene and structural superlubricity with improved smoothed molecular dynamics method ⋮ An improved smoothed molecular dynamics method by alternating with molecular dynamics ⋮ Increasing the Time Step and Efficiency of Molecular Dynamics Simulations: Optimal Solutions for Equilibrium Simulations or Structure Refinement of Large Biomolecules ⋮ Enhancing energy conserving methods ⋮ Homogenization of Hamiltonian systems with a strong constraining potential ⋮ Homogenization approach to smoothed molecular dynamics ⋮ Curvilinear all-atom multiscale (CAM) theory of macromolecular dynamics ⋮ On the formulation of high-frequency dissipative time-stepping algorithms for nonlinear dynamics. I: Low-order methods for two model problems and nonlinear elastodynamics ⋮ Balanced data assimilation for highly oscillatory mechanical systems ⋮ Smoothed Langevin dynamics of highly oscillatory systems ⋮ Multiple time scales in classical and quantum-classical molecular dynamics

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