DC Field | Value | Language |
---|---|---|
dc.contributor.author | Guin, M | - |
dc.contributor.author | Patwari, GN | - |
dc.contributor.author | Karthikeyan, S | - |
dc.contributor.author | Kim, KS | - |
dc.date.accessioned | 2015-06-25T02:55:32Z | - |
dc.date.available | 2015-06-25T02:55:32Z | - |
dc.date.created | 2010-04-28 | - |
dc.date.issued | 2009-01 | - |
dc.identifier.issn | 1463-9076 | - |
dc.identifier.other | 2015-OAK-0000020834 | en_US |
dc.identifier.uri | https://oasis.postech.ac.kr/handle/2014.oak/11890 | - |
dc.description.abstract | The IR-UV double resonance spectroscopy of a complex between phenylacetylene and 1,3,5-triazine reveals that the acetylene C-H group of phenylacetylene is minimally perturbed due to its interaction with 1,3,5-triazine. Further, the IR spectrum clearly indicates that 1,3,5-triazine primarily interacts with pi-electron density of the benzene ring in phenylacetylene. Geometries obtained at the DFT/MO6-2X and MP2/aug-cc-pVDZ levels, combined with highly accurate energy calculations at the complete basis set (CBS) limit of CCSD(T), establish formation of the displaced pi-stacked heterodimer between phenylacetylene and 1,3,5-triazine. | - |
dc.description.statementofresponsibility | open | en_US |
dc.language | English | - |
dc.publisher | ROYAL SOC CHEMISTRY | - |
dc.relation.isPartOf | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | - |
dc.rights | BY_NC_ND | en_US |
dc.rights.uri | http://creativecommons.org/licenses/by-nc-nd/2.0/kr | en_US |
dc.title | A pi-stacked phenylacetylene and 1,3,5-triazine heterodimer: a combined spectroscopic and ab initio investigation | - |
dc.type | Article | - |
dc.contributor.college | 화학과 | en_US |
dc.identifier.doi | 10.1039/B911640K | - |
dc.author.google | Guin, M | en_US |
dc.author.google | Patwari, GN | en_US |
dc.author.google | Kim, KS | en_US |
dc.author.google | Karthikeyan, S | en_US |
dc.relation.volume | 11 | en_US |
dc.relation.issue | 47 | en_US |
dc.relation.startpage | 11207 | en_US |
dc.relation.lastpage | 11212 | en_US |
dc.contributor.id | 10051563 | en_US |
dc.relation.journal | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | en_US |
dc.relation.index | SCI급, SCOPUS 등재논문 | en_US |
dc.collections.name | Journal Papers | en_US |
dc.type.rims | ART | - |
dc.identifier.bibliographicCitation | PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v.11, no.47, pp.11207 - 11212 | - |
dc.identifier.wosid | 000272193800016 | - |
dc.date.tcdate | 2019-01-01 | - |
dc.citation.endPage | 11212 | - |
dc.citation.number | 47 | - |
dc.citation.startPage | 11207 | - |
dc.citation.title | PHYSICAL CHEMISTRY CHEMICAL PHYSICS | - |
dc.citation.volume | 11 | - |
dc.contributor.affiliatedAuthor | Kim, KS | - |
dc.identifier.scopusid | 2-s2.0-73149105501 | - |
dc.description.journalClass | 1 | - |
dc.description.journalClass | 1 | - |
dc.description.wostc | 18 | - |
dc.description.scptc | 18 | * |
dc.date.scptcdate | 2018-10-274 | * |
dc.type.docType | Article | - |
dc.subject.keywordPlus | ULTRAVIOLET DOUBLE-RESONANCE | - |
dc.subject.keywordPlus | BENZENE DIMER | - |
dc.subject.keywordPlus | AROMATIC INTERACTIONS | - |
dc.subject.keywordPlus | MOLECULAR CLUSTERS | - |
dc.subject.keywordPlus | BINDING-ENERGIES | - |
dc.subject.keywordPlus | COMPLEXES | - |
dc.subject.keywordPlus | SYSTEMS | - |
dc.subject.keywordPlus | ORIGIN | - |
dc.subject.keywordPlus | PYRIDINE | - |
dc.subject.keywordPlus | WATER | - |
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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