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Benchmarking a self-consistent field theory for small amphiphilic molecules

dc.contributor.authorThompson, Russell B.
dc.contributor.authorJebb, T.
dc.contributor.authorWen, Y.
dc.date.accessioned2016-03-08T18:39:03Z
dc.date.available2016-03-08T18:39:03Z
dc.date.issued2012-08-14
dc.descriptionDOI: 10.1039/C2SM26352A (Paper) Soft Matter, 2012, 8, 9877-9885 This journal is © The Royal Society of Chemistry 2012en
dc.description.abstractA minimalist self-consistent field theory for small amphiphilic molecules is presented. The equations for this model are less involved than those for block copolymers and are easily implemented computationally. A new convergence technique based on a variant of Anderson mixing is also presented which allows the equations to be solved more rapidly than block copolymer self-consistent field theory. The computational speed up and simplicity of equations result from a lack of configurational degrees of freedom in the amphiphilic molecular model. The omission of polymeric flexibility leads to qualitatively different predictions compared to known diblock copolymer behaviour.en
dc.description.sponsorshipUniversity of Waterloo International Work Study Programen
dc.identifier.urihttp://pubs.rsc.org/en/Content/ArticleLanding/2012/SM/c2sm26352a#!divAbstract
dc.identifier.urihttp://hdl.handle.net/10012/10308
dc.language.isoenen
dc.publisherRSC publishingen
dc.relation.ispartofseriesSoft matter;38en
dc.subjectself-consistent field theoryen
dc.subjectamphiphilic moleculesen
dc.subjectblock copolymersen
dc.titleBenchmarking a self-consistent field theory for small amphiphilic moleculesen
dc.typeArticleen
dcterms.bibliographicCitationThompson Russell B., Jebb T., Wen Y., (2012). "Benchmarking a self-consistent field theory for small amphiphilic molecules", Soft Matter, 8, 9877-9885. DOI: 10.1039/c2sm26352aen
uws.contributor.affiliation1Faculty of Scienceen
uws.contributor.affiliation2Physics and Astronomyen
uws.peerReviewStatusRevieweden
uws.scholarLevelFacultyen
uws.typeOfResourceTexten

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