most citedOn the Definition of Velocity in Discrete-Time, Stochastic Langevin Simulations

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physics.comp-ph2025

A Concurrent Multiscale Framework Coupling Direct Simulation Monte Carlo and Molecular Dynamics

Tim Linke, Dane Sterbentz, Niels Grønbech-Jensen +2

We present a new method to couple the Direct Simulation Monte Carlo (DSMC) algorithm with molecular dynamics (MD). The coupling approach generalizes prior coupling methods using a…

physics.comp-ph2025

Linear Analysis of Stochastic Verlet-Type Integrators for Langevin Equations

Niels Grønbech-Jensen

We provide an analytical framework for analyzing the quality of stochastic Verlet-type integrators for simulating the Langevin equation. Focusing only on basic objective measures,…