Grid computing in time-dependent quantum reactive dynamics
Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics), ISSN: 1611-3349, Vol: 5072 LNCS, Issue: PART 1, Page: 1065-1080
2008
- 6Citations
- 2Captures
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Conference Paper Description
A study of the dependence of the cross section on the rotational energy for the N + N reaction is presented. Cross sections have been calculated using a time-dependent quantum method and applying the centrifugal sudden approximation. This approximation decouples the projections of the total angular momentum and therefore breaks the calculations into several thousand runs suitable for distribution on a computing Grid. In order to handle this computational burden a procedure managing the submission of jobs and the subsequent retrieval of results has been designed. The procedure has been implemented on the EGEE production Grid and the related performance has been measured. © 2008 Springer-Verlag Berlin Heidelberg.
Bibliographic Details
http://www.scopus.com/inward/record.url?partnerID=HzOxMe3b&scp=54349100214&origin=inward; http://dx.doi.org/10.1007/978-3-540-69839-5_81; http://link.springer.com/10.1007/978-3-540-69839-5_81; http://link.springer.com/content/pdf/10.1007/978-3-540-69839-5_81.pdf; https://dx.doi.org/10.1007/978-3-540-69839-5_81; https://link.springer.com/chapter/10.1007/978-3-540-69839-5_81; http://www.springerlink.com/index/10.1007/978-3-540-69839-5_81; http://www.springerlink.com/index/pdf/10.1007/978-3-540-69839-5_81
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