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On the computation of correlation functions in molecular dynamics experiments

par Kestemont, Edouard ;Van Craen, Jean,
Référence Journal of computational physics, 22, 4, page (451-458)
Publication Publié, 1976

Article révisé par les pairs

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Résumé :

The method described by Futrelle and McGinty for the high speed computation of correlation functions, starting from the results of molecular dynamics experiments, is discussed and comparisons of computation times with the "direct" method are given. A further improvement of the method is described. © 1976.