The effects of intrinsic dynamical ghost modes in discrete-time Langevin simulations

DOI10.1016/j.cpc.2019.107011OpenAlexW2914726655WikidataQ126866765 ScholiaQ126866765MaRDI QIDQ2698843

Niels Grønbech-Jensen, Lucas Frese Grønbech Jensen

Publication date: 25 April 2023

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1902.02338

zbMATH Keywords

nonlinear dynamicsmolecular dynamicscomputational statistical mechanicsdiscrete-time statisticsLangevin simulationsnumerical thermostat

Mathematics Subject Classification ID

Dynamical systems and ergodic theory (37-XX) Mechanics of particles and systems (70-XX)

Related Items (1)

On the application of non-Gaussian noise in stochastic Langevin simulations

Cites Work

• Application of the G-JF discrete-time thermostat for fast and accurate molecular simulations
• Nonlinear resonance artifacts in molecular dynamics simulations
• Verlet-I/R-RESPA/Impulse is Limited by Nonlinear Instabilities
• Geometric numerical integration illustrated by the Störmer–Verlet method
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