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.
1992
Istituto di informatica e telematica - IIT
Istituto di Scienza e Tecnologie dell'Informazione "Alessandro Faedo" - ISTI
quasiclassical reactive scattering
parallel approach
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/181429
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