Structure and dynamical properties of Au-N, N=12-14 clusters: Molecular dynamics simulation

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dc.contributor.authorYıldırım, Erdem Kamil
dc.contributor.authorAtis, Murat
dc.contributor.authorGüvenç, Ziya B.
dc.date.accessioned2020-06-25T17:40:52Z
dc.date.available2020-06-25T17:40:52Z
dc.date.issued2005
dc.departmentKırıkkale Üniversitesi
dc.descriptionATIS, Murat/0000-0003-4429-6897
dc.description.abstractUsing molecular dynamics and thermal quenching methods on the basis of Voter-Chen version of the embedded-atom method, we have studied the melting behavior of Au-N (N = 12, 13, 14) clusters. This behavior is described in terms of overall and atom resolved root-mean-square bond-length fluctuations, specific-heat, short- and long-time average coordination numbers of each atom and short-time average temperatures of the clusters. The isomer sampling probabilities are obtained from the thermal quenching of the molten clusters, and their energy-spectrum widths are investigated. Phase change of a cluster takes place with the collective and simultaneous motion of all the atoms.en_US
dc.identifier.citationclosedAccessen_US
dc.identifier.doi10.1142/S0129183105006966
dc.identifier.endpage116en_US
dc.identifier.issn0129-1831
dc.identifier.issue1en_US
dc.identifier.scopus2-s2.0-21344437048
dc.identifier.scopusqualityQ2
dc.identifier.startpage99en_US
dc.identifier.urihttps://doi.org/10.1142/S0129183105006966
dc.identifier.urihttps://hdl.handle.net/20.500.12587/3571
dc.identifier.volume16en_US
dc.identifier.wosWOS:000229549400007
dc.identifier.wosqualityQ2
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherWorld Scientific Publ Co Pte Ltden_US
dc.relation.ispartofInternational Journal Of Modern Physics C
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectclusteren_US
dc.subjectgolden_US
dc.subjectAuen_US
dc.subjectmolecular dynamicsen_US
dc.subjectembedded-atom methodsen_US
dc.subjectmeltingen_US
dc.titleStructure and dynamical properties of Au-N, N=12-14 clusters: Molecular dynamics simulationen_US
dc.typeArticle

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