DC Field | Value | Language |
---|---|---|
dc.contributor.author | Lee, HM | - |
dc.contributor.author | Odde, S | - |
dc.contributor.author | Mhin, BJ | - |
dc.contributor.author | Suh, SB | - |
dc.contributor.author | Kim, KS | - |
dc.date.accessioned | 2016-04-01T01:29:06Z | - |
dc.date.available | 2016-04-01T01:29:06Z | - |
dc.date.created | 2009-03-20 | - |
dc.date.issued | 2007-01 | - |
dc.identifier.issn | 0026-8976 | - |
dc.identifier.other | 2008-OAK-0000007365 | - |
dc.identifier.uri | https://oasis.postech.ac.kr/handle/2014.oak/23033 | - |
dc.description.abstract | A hydroiodic acid molecule is dissociated by more than four water molecules. Here, the effect of an excess electron on the hexahydated hydroiodic acid where the dissociated structure [H3O+(H2O)(5)I-] is much more stable than the undissociated one [(H2O)(6)HI], is investigated. Upon binding an excess electron (e(-)), the cluster releases a hydrogen radical and forms the stable hexahydrated iodide [(H2O)(6)I-] when the initial kinetic energy is above similar to 200 K, due to the small transition barrier (similar to 0.5 eV). The system with the hydrogen radical released, [(H2O)(6)I- + H center dot], is much more stable than the systems with an excess electron, [(H3O)(+){e(-)(H2O)5}I-] or [e(-)(H2O)(2)(H3O)(+)(H2O)(3)I-]. | - |
dc.description.statementofresponsibility | X | - |
dc.language | English | - |
dc.publisher | TAYLOR & FRANCIS LTD | - |
dc.relation.isPartOf | MOLECULAR PHYSICS | - |
dc.subject | hydroiodic acid | - |
dc.subject | excess electron | - |
dc.subject | hydrogen radical | - |
dc.subject | cluster | - |
dc.subject | hydrogen detachment | - |
dc.subject | POTENTIAL-ENERGY SURFACES | - |
dc.subject | HYDRONIUM-WATER CLUSTERS | - |
dc.subject | AB-INITIO | - |
dc.subject | VIBRATIONAL-SPECTRA | - |
dc.subject | HYDRATED ELECTRONS | - |
dc.subject | EXCITED-STATE | - |
dc.subject | REAL-TIME | - |
dc.subject | DYNAMICS | - |
dc.subject | ANIONS | - |
dc.subject | MODEL | - |
dc.title | Hydrogen detachment of the hexahydrated hydroiodic acid upon attaching an excess electron | - |
dc.type | Article | - |
dc.contributor.college | 화학과 | - |
dc.identifier.doi | 10.1080/002689707015 | - |
dc.author.google | Lee, HM | - |
dc.author.google | Odde, S | - |
dc.author.google | Mhin, BJ | - |
dc.author.google | Suh, SB | - |
dc.author.google | Kim, KS | - |
dc.relation.volume | 105 | - |
dc.relation.issue | 19-22 | - |
dc.relation.startpage | 2577 | - |
dc.relation.lastpage | 2581 | - |
dc.contributor.id | 10051563 | - |
dc.relation.journal | MOLECULAR PHYSICS | - |
dc.relation.index | SCI급, SCOPUS 등재논문 | - |
dc.relation.sci | SCI | - |
dc.collections.name | Journal Papers | - |
dc.type.rims | ART | - |
dc.identifier.bibliographicCitation | MOLECULAR PHYSICS, v.105, no.19-22, pp.2577 - 2581 | - |
dc.identifier.wosid | 000251751200013 | - |
dc.date.tcdate | 2019-01-01 | - |
dc.citation.endPage | 2581 | - |
dc.citation.number | 19-22 | - |
dc.citation.startPage | 2577 | - |
dc.citation.title | MOLECULAR PHYSICS | - |
dc.citation.volume | 105 | - |
dc.contributor.affiliatedAuthor | Kim, KS | - |
dc.identifier.scopusid | 2-s2.0-38849117919 | - |
dc.description.journalClass | 1 | - |
dc.description.journalClass | 1 | - |
dc.description.wostc | 3 | - |
dc.type.docType | Article | - |
dc.subject.keywordPlus | POTENTIAL-ENERGY SURFACES | - |
dc.subject.keywordPlus | HYDRONIUM-WATER CLUSTERS | - |
dc.subject.keywordPlus | AB-INITIO | - |
dc.subject.keywordPlus | VIBRATIONAL-SPECTRA | - |
dc.subject.keywordPlus | HYDRATED ELECTRONS | - |
dc.subject.keywordPlus | EXCITED-STATE | - |
dc.subject.keywordPlus | REAL-TIME | - |
dc.subject.keywordPlus | DYNAMICS | - |
dc.subject.keywordPlus | ANIONS | - |
dc.subject.keywordPlus | MODEL | - |
dc.subject.keywordAuthor | hydroiodic acid | - |
dc.subject.keywordAuthor | excess electron | - |
dc.subject.keywordAuthor | hydrogen radical | - |
dc.subject.keywordAuthor | cluster | - |
dc.subject.keywordAuthor | hydrogen detachment | - |
dc.relation.journalWebOfScienceCategory | Chemistry, Physical | - |
dc.relation.journalWebOfScienceCategory | Physics, Atomic, Molecular & Chemical | - |
dc.description.journalRegisteredClass | scie | - |
dc.description.journalRegisteredClass | scopus | - |
dc.relation.journalResearchArea | Chemistry | - |
dc.relation.journalResearchArea | Physics | - |
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