A combined event-driven/time-driven molecular dynamics algorithm for the simulation of shock waves in rarefied gases

DOI10.1016/J.JCP.2009.08.026MaRDI QIDQ1038042zbMATH OpenOpenAlexFDO

Authors Paolo Valentini, Thomas E. Schwartzentruber

Publication date 17 November 2009

Published in Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.jcp.2009.08.026

zbMATH Keywords

event-driven MDmolecular dynamicsnon-continuum effectsshock waves

Mathematics Subject Classification ID

Shock waves and blast waves in fluid mechanics (76L05) Rarefied gas flows, Boltzmann equation in fluid mechanics (76P05)

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Cites work

• -DSMC: a fast simulation method for rarefied flow
• A complexity O(1) priority queue for event driven molecular dynamics simulations
• Direct simulation of gas flows at the molecular level
• Dynamic molecular collision (DMC) model for rarefied gas flow simulations by the DSMC method
• Event-driven molecular dynamics in parallel.
• Higher moments of the velocity distribution function in dense-gas shocks
• scientific article; zbMATH DE number 3160927 (Why is no real title available?)
• scientific article; zbMATH DE number 46777 (Why is no real title available?)
• scientific article; zbMATH DE number 3091796 (Why is no real title available?)
• Large-scale molecular dynamics simulations of normal shock waves in dilute argon
• Neighbor list collision-driven molecular dynamics simulation for nonspherical hard particles. I: Algorithmic details
• Nonequilibrium gas flows. I: A detailed validation of Monte Carlo direct simulation for monatomic gases
• Numerical solutions of the Boltzmann equation: Comparison of different algorithms
• Scalar and parallel optimized implementation of the direct simulation Monte Carlo method
• The Solution of the Boltzmann Equation for a Shock Wave
• The structure of an infinitely strong shock wave

Cited in

(7)

• Slow dynamics by molecular dynamics
• A hybrid MD-DSMC coupling method to investigate flow characteristics of micro-devices
• Stochastic event-driven molecular dynamics
• GPU-accelerated Classical Trajectory Calculation Direct Simulation Monte Carlo applied to shock waves
• Three-dimensional simulation of a high-velocity body motion in a tube with rarefied gas
• Online optimisation of machine learning collision models to accelerate direct molecular simulation of rarefied gas flows
• Application of event-driven molecular dynamics approach to rarefied gas dynamics problems

Describes a project that uses

Uses Software

• MONACO

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