Supercomputing for Molecular-Dynamics Simulations
Handling Multi-Trillion Particles in Nanofluidics
This work presents modern implementations of relevant molecular dynamics algorithms using ls1 mardyn, a simulation program for engineering applications. The text focuses strictly on HPC-related aspects, covering implementation on HPC architectures, taking Intel Xeon and Intel Xeon Phi clusters as representatives of current platforms. The work describes distributed and shared-memory parallelization on these platforms, including load balancing, with a particular focus on the efficient implementation of the compute kernels. The text also discusses the software-architecture of the resulting code.
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Produktdetails
Weitere Autoren: Eckhardt, Wolfgang / Horsch, Martin / Bungartz, Hans-Joachim
- ISBN: 978-3-319-17147-0
- EAN: 9783319171470
- Produktnummer: 17646508
- Verlag: Springer-Verlag GmbH
- Sprache: Englisch
- Erscheinungsjahr: 2015
- Seitenangabe: 74 S.
- Masse: H23.5 cm x B15.5 cm x D0.5 cm 149 g
- Abbildungen: Book; 22 schwarz-weiße und 13 farbige Abbildungen, 2 schwarz-weiße Tabellen, Bibliographie
- Gewicht: 149
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Supercomputing for Molecular Dynamics Simulations
Handling Multi-Trillion Particles in Nanofluidics
Handling Multi-Trillion Particles in Nanofluidics
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