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Article: Hard sphere mixtures near a hard wall

TitleHard sphere mixtures near a hard wall
Authors
Issue Date1998
PublisherTaylor & Francis Ltd. The Journal's web site is located at http://www.tandf.co.uk/journals/titles/00268976.asp
Citation
Molecular Physics, 1998, v. 95 n. 3, p. 415-424 How to Cite?
AbstractHard spheres with ratios of diameters of 3:5 and 1:3 and at various densitics are studied by means of grand canonical ensemble (GCE) simulations, first- and second-order Percus-Yevick theory, scaled particle theory (SPT) and density functional theory (DFT). Generally, but not always, the density profiles of the first-order Percus-Yevick (PY1) theory results are smaller at contact than the GCE simulation results. The second-order Percus-Yevick (PY2) and DFT results are in much better agreement with the simulations. PY2 theory seems to be more accurate than DFT but is much more demanding computationally.
Persistent Identifierhttp://hdl.handle.net/10722/69994
ISSN
2015 Impact Factor: 1.837
2015 SCImago Journal Rankings: 0.781
References

 

DC FieldValueLanguage
dc.contributor.authorNoworyta, JPen_HK
dc.contributor.authorHenderson, Den_HK
dc.contributor.authorSokoŁowski, Sen_HK
dc.contributor.authorChan, KYen_HK
dc.date.accessioned2010-09-06T06:18:43Z-
dc.date.available2010-09-06T06:18:43Z-
dc.date.issued1998en_HK
dc.identifier.citationMolecular Physics, 1998, v. 95 n. 3, p. 415-424en_HK
dc.identifier.issn0026-8976en_HK
dc.identifier.urihttp://hdl.handle.net/10722/69994-
dc.description.abstractHard spheres with ratios of diameters of 3:5 and 1:3 and at various densitics are studied by means of grand canonical ensemble (GCE) simulations, first- and second-order Percus-Yevick theory, scaled particle theory (SPT) and density functional theory (DFT). Generally, but not always, the density profiles of the first-order Percus-Yevick (PY1) theory results are smaller at contact than the GCE simulation results. The second-order Percus-Yevick (PY2) and DFT results are in much better agreement with the simulations. PY2 theory seems to be more accurate than DFT but is much more demanding computationally.en_HK
dc.languageengen_HK
dc.publisherTaylor & Francis Ltd. The Journal's web site is located at http://www.tandf.co.uk/journals/titles/00268976.aspen_HK
dc.relation.ispartofMolecular Physicsen_HK
dc.titleHard sphere mixtures near a hard wallen_HK
dc.typeArticleen_HK
dc.identifier.openurlhttp://library.hku.hk:4550/resserv?sid=HKU:IR&issn=0026-8976&volume=95&issue=3&spage=415&epage=424&date=1998&atitle=Hard+sphere+mixtures+near+a+hard+wallen_HK
dc.identifier.emailChan, KY:hrsccky@hku.hken_HK
dc.identifier.authorityChan, KY=rp00662en_HK
dc.description.naturelink_to_subscribed_fulltext-
dc.identifier.doi10.1080/00268979809483175-
dc.identifier.scopuseid_2-s2.0-0001737178en_HK
dc.identifier.hkuros39976en_HK
dc.relation.referenceshttp://www.scopus.com/mlt/select.url?eid=2-s2.0-0001737178&selection=ref&src=s&origin=recordpageen_HK
dc.identifier.volume95en_HK
dc.identifier.issue3en_HK
dc.identifier.spage415en_HK
dc.identifier.epage424en_HK
dc.publisher.placeUnited Kingdomen_HK
dc.identifier.scopusauthoridNoworyta, JP=6603945257en_HK
dc.identifier.scopusauthoridHenderson, D=7402988756en_HK
dc.identifier.scopusauthoridSokoŁowski, S=7005479100en_HK
dc.identifier.scopusauthoridChan, KY=7406034142en_HK

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