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dc.contributor.authorMESLI, Fouzia-
dc.contributor.authorMAHBOUB, Radia-
dc.contributor.authorMAHBOUB, Mourad-
dc.date.accessioned2013-04-30T09:07:25Z-
dc.date.available2013-04-30T09:07:25Z-
dc.date.issued2011-04-
dc.identifier.issn1878-5352-
dc.identifier.urihttp://dspace.univ-tlemcen.dz/handle/112/1858-
dc.descriptionArabian Journal of Chemistry, ISSN : 1878-5352, DOI : 10.1016/j.arabjc.2010.06.039, Issue : 2, Volume : 4, pp. 211-222, April 2011.en_US
dc.description.abstractThis work concerns the site–site interaction study of 256 particles using the Buckingham potential model. We have calculated the new parameters of the Buckingham potential using an iterative algorithm with a mean square method. This adapted model allows determining the characteristics for each state point. We have applied this model to study the liquefied natural gas LNG properties for methane-nitrogen and methane–nitrogen–ethane mixtures by molecular dynamics. We have calculated the thermodynamic, dynamic and structural properties for both the microcanonical NVT and the isothermal-isobaric NPT ensembles of binary and ternary systems from the SP1 to SP9 points. Then, we have compared the results between binary and ternary systems. We have obtained a good prediction on transport properties. From the calculated values of self-diffusion coefficient and viscosity, we have confirmed the liquid state of the liquefied natural gas LNG system.en_US
dc.language.isoenen_US
dc.subjectMolecular dynamicsen_US
dc.subjectBuckingham potentialen_US
dc.subjectBinary and ternary mixturesen_US
dc.subjectStructural functionen_US
dc.subjectThermodynamic propertiesen_US
dc.subjectTransport characteristicsen_US
dc.titleMolecular dynamics comparative study of methane–nitrogen and methane–nitrogen–ethane systemsen_US
dc.typeArticleen_US
Collection(s) :Articles internationaux

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