Ultrafast scalable parallel algorithm for the radial distribution function histogramming using MPI maps

In the present paper, an ultrafast and scalable parallel program for the Radial Pair Function (RPF) is presented via pure Message Passing Interface (MPI) paradigm. The parallel code computes the radial distribution function for the single-component as well as multi-component systems. The single-comp...

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Bibliographic Details
Published in:The Journal of supercomputing Vol. 73; no. 4; pp. 1629 - 1653
Main Authors: Kouetcha, Daniella Nguemalieu, Ramézani, Hamidréza, Cohaut, Nathalie
Format: Journal Article
Language:English
Published: New York Springer US 01.04.2017
Springer Nature B.V
Springer Verlag
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ISSN:0920-8542, 1573-0484
Online Access:Get full text
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