Reaction Dynamics Through Kinetic Transition States

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dc.authorscopusid23481439700
dc.authorscopusid57203397243
dc.contributor.authorÇiftçi, Ünver
dc.contributor.authorWaalkens, Holger
dc.date.accessioned2022-05-11T14:31:13Z
dc.date.available2022-05-11T14:31:13Z
dc.date.issued2013
dc.departmentFakülteler, Fen Edebiyat Fakültesi, Matematik Bölümü
dc.description.abstractThe transformation of a system from one state to another is often mediated by a bottleneck in the system's phase space. In chemistry, these bottlenecks are known as transition states through which the system has to pass in order to evolve from reactants to products. The chemical reactions are usually associated with configurational changes where the reactants and products states correspond, e. g., to two different isomers or the undissociated and dissociated state of a molecule or cluster. In this Letter, we report on a new type of bottleneck which mediates kinetic rather than configurational changes. The phase space structures associated with such kinetic transition states and their dynamical implications are discussed for the rotational vibrational motion of a triatomic molecule. An outline of more general related phase space structures with important dynamical implications is given.
dc.identifier.doi10.1103/PhysRevLett.110.233201
dc.identifier.issn0031-9007
dc.identifier.issue23en_US
dc.identifier.pmid25167488
dc.identifier.scopus2-s2.0-84878854354
dc.identifier.scopusqualityQ1
dc.identifier.urihttps://doi.org/10.1103/PhysRevLett.110.233201
dc.identifier.urihttps://hdl.handle.net/20.500.11776/7369
dc.identifier.volume110
dc.identifier.wosWOS:000320163600004
dc.identifier.wosqualityQ1
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.indekslendigikaynakPubMed
dc.institutionauthorÇiftçi, Ünver
dc.language.isoen
dc.publisherAmer Physical Soc
dc.relation.ispartofPhysical Review Letters
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccess
dc.subjectPhase-Space
dc.subjectGeometry
dc.subjectSystems
dc.titleReaction Dynamics Through Kinetic Transition States
dc.typeArticle

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