On the coupling of molecular dynamics to continuum computational fluid dynamics
Molecular dynamics (MD) is a discrete modelling technique that is used to capture the nanoscale motion of molecules. MD can be used to accurately simulate a range of physical problems where the continuum assumption breaks down. Examples include surface interaction, complex molecules, local phase cha...
Main Author: | |
---|---|
Other Authors: | |
Published: |
Imperial College London
2014
|
Subjects: | |
Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.624094 |