By Alexander Heinecke, Wolfgang Eckhardt, Martin Horsch, Hans-Joachim Bungartz
This paintings provides glossy implementations of proper molecular dynamics algorithms utilizing ls1 mardyn, a simulation application for engineering functions. The textual content focuses strictly on HPC-related elements, masking implementation on HPC architectures, taking Intel Xeon and Intel Xeon Phi clusters as representatives of present structures. The paintings describes allotted and shared-memory parallelization on those systems, together with load balancing, with a selected concentrate on the effective implementation of the compute kernels. The textual content additionally discusses the software-architecture of the ensuing code.
Read or Download Supercomputing for Molecular Dynamics Simulations: Handling Multi-Trillion Particles in Nanofluidics (SpringerBriefs in Computer Science) PDF
Best Dynamics books
A entire replace of "Dynamics of Stochastic Systems," this reference develops mathematical instruments of stochastic research and applies them to quite a lot of actual types of debris, fluids, and waves. contains difficulties for the reader to unravel.
Not like different books in this topic, which are inclined to pay attention to 2-D dynamics, this article specializes in the applying of Newton-Euler how you can advanced, real-life 3D dynamics difficulties. it's therefore excellent for non-compulsory classes in intermediate dynamics.
Detonation, because the authors indicate, differs from different kinds of combustion "in that each one the $64000 power move is by means of mass movement in powerful compression waves, with negligible contributions from different techniques like warmth conduction. " Experiments have proven that those waves have a posh transverse constitution, and feature questioned scientists by means of yielding a few effects which are at odds with the theoretical predictions.
The place to begin within the formula of any numerical challenge is to take an intuitive thought concerning the challenge in query and to translate it into distinct mathematical language. This e-book presents step by step descriptions of ways to formulate numerical difficulties which will be solved through current software program.
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