Hybrid molecular-continuum fluid dynamics

R. Delgado-Buscalioni; P. V. Coveney

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arXiv · physics/0401093

Hybrid molecular-continuum fluid dynamics

R. Delgado-Buscalioni·P. V. Coveney

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Abstract

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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R. Delgado-Buscalioni, P. V. Coveney. 2004-01-20. Hybrid molecular-continuum fluid dynamics. https://arxiv.org/abs/physics/0401093

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