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Molecular Simulation of Fluid Flow on a Cluster of Workstations

contributor IPVS, Simulation großer Systeme
Martin Bernreuther
creator Bernreuther, Martin
Bungartz, Hans-Joachim
date 2005-09
description Simulation of fluid properties and flow below a certain length scale, where the continuum assumption does not hold any more, has to be done on a molecular level. Molecular Dynamics (MD) is a proper tool for nanofluidics. The limits of the system sizes manageable today are pushed not only by advances and availability of new hardware. It's even more important to achieve enhancements in the development of fast efficient algorithms and hardware optimized implementations. High Performance Computing systems and especially Clusters of Workstations, which turn out to be very well suited for this task, are the primary target platform for the majority of MD codes today. After a classification of the flow type addressed here, implementation details and parallelization strategies will be discussed for MD simulations based on short-range potentials, suitable for a rich variety of components.
identifier  http://www.informatik.uni-stuttgart.de/cgi-bin/NCSTRL/NCSTRL_view.pl?id=INPROC-2005-42&engl=1
ISBN: ISBN 3-936150-41-9
language eng
publisher Erlangen: SCS Publishing House
relation Frontiers in Simulation; 15
ASIM
source In: Hülsemann, Frank (ed.); Kowarschik, Markus (ed.); Rüde, Ulrich (ed.): 18th Symposium Simulationstechnique ASIM 2005 Proceedings, pp. 117-123
subject Concurrent Programming (CR D.1.3)
Numerical Analysis General (CR G.1.0)
Mathematical Software (CR G.4)
Types of Simulation (CR I.6.8)
Physical Sciences and Engineering (CR J.2)
title Molecular Simulation of Fluid Flow on a Cluster of Workstations
type Text
Article in Proceedings