Coupled continuum hydrodynamics and molecular dynamics method for multiscale simulation
Borg, Matthew Karl and Lockerby, Duncan A. and Reese, Jason (2011) Coupled continuum hydrodynamics and molecular dynamics method for multiscale simulation. In: 3rd Micro and Nano Flows Conference, MNF11, 2011-08-22 - 2011-08-24.
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Abstract
We present a new hybrid methodology for carrying out multiscale simulations of flow problems lying between continuum hydrodynamics and molecular dynamics, where macro/micro lengthscale separation exists only in one direction. Our multiscale method consists of an iterative technique that couples mass and momentum flux between macro and micro domains, and is tested on a converging/diverging nanochannel case containing flow of a simple Lennard-Jones liquid. Comparisons agree well with a full MD simulation of the same test case.
ORCID iDs
Borg, Matthew Karl, Lockerby, Duncan A. and Reese, Jason ORCID: https://orcid.org/0000-0001-5188-1627;-
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Item type: Conference or Workshop Item(Paper) ID code: 36513 Dates: DateEvent22 August 2011PublishedSubjects: Technology > Mechanical engineering and machinery
Science > Physics > Solid state physics. NanoscienceDepartment: Faculty of Engineering > Mechanical and Aerospace Engineering
Technology and Innovation Centre > Advanced Engineering and ManufacturingDepositing user: Pure Administrator Date deposited: 20 Dec 2011 11:46 Last modified: 17 Oct 2024 00:39 Related URLs: URI: https://strathprints.strath.ac.uk/id/eprint/36513