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dc.contributor.authorConstantin, Lucian A
dc.contributor.authorPitarke, JM
dc.contributor.authorDobson, JF
dc.contributor.authorGarcia-Lekue, A
dc.contributor.authorPerdew, John P
dc.contributor.editorGeorge Basbas, Jack Sandweiss, Reinhardt B. Schuhmann, Stanley G. Brown
dc.date.accessioned2017-05-03T11:12:49Z
dc.date.available2017-05-03T11:12:49Z
dc.date.issued2008
dc.date.modified2009-03-12T06:34:49Z
dc.identifier.issn0031-9007
dc.identifier.doi10.1103/PhysRevLett.100.036401
dc.identifier.urihttp://hdl.handle.net/10072/21678
dc.description.abstractWe resolve the long-standing controversy over the metal surface energy: Density-functional methods that require uniform-electron-gas input agree with each other, but not with high-level correlated calculations such as Fermi hypernetted chain and diffusion Monte Carlo calculations that predict the uniform-gas correlation energy. Here we apply the inhomogeneous Singwi-Tosi-Land-Sjo謡nder method, and find that the density functionals are indeed reliable (because the surface energy is bulklike). Our work also vindicates the use of uniform-gas-based nonlocal kernels in time-dependent density-functional theory.
dc.description.peerreviewedYes
dc.description.publicationstatusYes
dc.format.extent118285 bytes
dc.format.mimetypeapplication/pdf
dc.languageEnglish
dc.language.isoen_AU
dc.publisherAmerican Physical Society
dc.publisher.placeUnited States
dc.publisher.urihttp://prl.aps.org/
dc.relation.ispartofstudentpublicationN
dc.relation.ispartofpagefrom036401-1
dc.relation.ispartofpageto036401-4
dc.relation.ispartofjournalPhysical Review Letters
dc.relation.ispartofvolume100
dc.rights.retentionY
dc.subject.fieldofresearchPhysical Sciences
dc.subject.fieldofresearchcode02
dc.titleHigh-level correlated approach to the jellium surface energy, without uniform-gas input
dc.typeJournal article
dc.type.descriptionC1 - Articles
dc.type.codeC - Journal Articles
gro.rights.copyright© 2008 American Physical Society. This is the author-manuscript version of this paper. Reproduced in accordance with the copyright policy of the publisher. Please refer to the journal link for access to the definitive, published version
gro.date.issued2008
gro.hasfulltextFull Text
gro.griffith.authorDobson, John F.


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