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arxiv: physics/0401093 · v1 · submitted 2004-01-20 · ⚛️ physics.comp-ph · physics.flu-dyn

Hybrid molecular-continuum fluid dynamics

classification ⚛️ physics.comp-ph physics.flu-dyn
keywords describeddynamicshybridaccuracyatomisticcontinuumdensedescribe
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We describe recent developments in the hybrid atomistic/continuum modelling of dense fluids. We discuss the general implementation of mass, momentum and energy transfers between a region described by molecular dynamics and the neighbouring domain described by the Navier-Stokes equations for unsteady flow. The effect of fluctuations from the particle system in the scheme accuracy is also studied.

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