DocumentCode
3387583
Title
An alternative distribution model for the Molecular Dynamics study of liquid Propane on a grid platform
Author
Costantini, Alessandro ; Laganà, Antonio ; Pacifici, Leonardo ; Gervasi, Osvaldo
Author_Institution
Univ. of Perugia, Perugia
fYear
2007
fDate
26-29 Aug. 2007
Firstpage
433
Lastpage
440
Abstract
The density of liquid propane has been estimated using molecular dynamics calculations performed on the EGEE-Grid distributed platform and adopting an OPLS/AMBER force field. The difficulty of determining the pressure of the system using the same sample and the same distribution model has motivated us to develop an alternative approach.
Keywords
carbon compounds; grid computing; molecular dynamics method; physics computing; EGEE-grid distributed platform; OPLS/AMBER force field; liquid propane density estimation; molecular dynamics calculation; Bonding forces; Chemistry; Computer applications; Computer science; Distributed computing; Force measurement; Grid computing; Mathematics; Power system modeling; Refrigerants;
fLanguage
English
Publisher
ieee
Conference_Titel
Computational Science and its Applications, 2007. ICCSA 2007. International Conference on
Conference_Location
Kuala Lampur
Print_ISBN
978-0-7695-2945-5
Type
conf
DOI
10.1109/ICCSA.2007.38
Filename
4301178
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