Quantum wave packet study of S(1D)+HD reaction

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dc.contributor.authorGogtas, F
dc.contributor.authorBulut, N
dc.contributor.authorAkpinar, S
dc.date.accessioned2026-08-12T16:34:31Z
dc.date.issued2005
dc.departmentFırat Üniversitesi
dc.description.abstractThe time-dependent real wave packet method has been used to study S(D-1) + HD reaction. State-to-state and state-to-all reactive scattering probabilities for a broad range of energy are calculated at zero total angular momentum. The probabilities for J> 0 are estimated from accurately computed J=0 probabilities by using J-shifting approximation. The integral cross-sections are calculated for a large energy range. © 2005 Elsevier B.V. All rights reserved.
dc.identifier.doi10.1016/j.theochem.2005.03.006
dc.identifier.endpage194
dc.identifier.issn0166-1280
dc.identifier.issue1.Mar
dc.identifier.orcid0000-0003-2863-7700
dc.identifier.orcid0000-0003-2230-7575
dc.identifier.scopus2-s2.0-18244407287
dc.identifier.scopusqualityN/A
dc.identifier.startpage189
dc.identifier.urihttps://doi.org/10.1016/j.theochem.2005.03.006
dc.identifier.urihttps://hdl.handle.net/11508/44486
dc.identifier.volume723
dc.identifier.wosWOS:000229566200026
dc.identifier.wosqualityN/A
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherElsevier Science Bv
dc.relation.ispartofJournal of Molecular Structure-Theochem
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.snmzKA_WoS_20260511
dc.subjectreaction dynamics
dc.subjectwavepacket study
dc.subjectS plus HD
dc.titleQuantum wave packet study of S(1D)+HD reaction
dc.typeArticle

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