The suitability of massively parallel architectures for carrying out efficient calculations of quasiclassical rate constants for atom-diatom reactive processes has been investigated. Problems related to the parallel structuring of the computational procedure, fixed and scaled speed-ups, efficiency factors and their dependence upon the size of the problem, and the number of processors are discussed.
A Massively Parallel Approach to the Quasiclassical Reactive Scattering
Baraglia R;Ferrini R;Laforenza D;Perego R;
1992
Abstract
The suitability of massively parallel architectures for carrying out efficient calculations of quasiclassical rate constants for atom-diatom reactive processes has been investigated. Problems related to the parallel structuring of the computational procedure, fixed and scaled speed-ups, efficiency factors and their dependence upon the size of the problem, and the number of processors are discussed.File in questo prodotto:
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Descrizione: A Massively Parallel Approach to the Quasiclassical Reactive Scattering
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