Simulation of reactive flows using particle methods
Sebastian M\"uhlbauer, Severin Strobl, Thorsten P\"oschel
TL;DR
This paper introduces a new particle-based simulation method for reactive flows with open boundaries, demonstrating improved efficiency and accuracy in modeling chemical reactions like heterogeneous catalysis.
Contribution
The paper presents a novel, numerically stable particle method for simulating reactive open-boundary flows, validated against reference models with enhanced computational efficiency.
Findings
Validated against reference simulations for heterogeneous catalysis
Achieved significant computational efficiency improvements
Produced identical results to established methods
Abstract
We describe a new computational method for the numerically stable particle-based simulation of open-boundary flows, including volume conserving chemical reactions. The novel method is validated for the case of heterogeneous catalysis against a reliable reference simulation and is shown to deliver identical results while the computational efficiency is significantly increased.
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Taxonomy
TopicsLattice Boltzmann Simulation Studies · Fluid Dynamics Simulations and Interactions · Nanopore and Nanochannel Transport Studies