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Article: Density functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2

TitleDensity functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2
Authors
Issue Date2000
PublisherElsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cplett
Citation
Chemical Physics Letters, 2000, v. 316 n. 5-6, p. 524-530 How to Cite?
AbstractWe report density functional theory calculation results that examine the ultraviolet electronic transitions of CF 2I 2 and CH 2I 2. We make preliminary assignments of several transitions to the ultraviolet absorption spectra of CF 2I 2 and CH 2I 2. We compare our present results to previous experimental and computational work. We also examine the molecular orbitals involved in the electronic transitions assigned to the absorption spectra.
Persistent Identifierhttp://hdl.handle.net/10722/167357
ISSN
2015 Impact Factor: 1.86
2015 SCImago Journal Rankings: 0.757
ISI Accession Number ID
References

 

DC FieldValueLanguage
dc.contributor.authorZheng, Xen_US
dc.contributor.authorPhillips, DLen_US
dc.date.accessioned2012-10-08T03:06:00Z-
dc.date.available2012-10-08T03:06:00Z-
dc.date.issued2000en_US
dc.identifier.citationChemical Physics Letters, 2000, v. 316 n. 5-6, p. 524-530en_US
dc.identifier.issn0009-2614en_US
dc.identifier.urihttp://hdl.handle.net/10722/167357-
dc.description.abstractWe report density functional theory calculation results that examine the ultraviolet electronic transitions of CF 2I 2 and CH 2I 2. We make preliminary assignments of several transitions to the ultraviolet absorption spectra of CF 2I 2 and CH 2I 2. We compare our present results to previous experimental and computational work. We also examine the molecular orbitals involved in the electronic transitions assigned to the absorption spectra.en_US
dc.languageengen_US
dc.publisherElsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cpletten_US
dc.relation.ispartofChemical Physics Lettersen_US
dc.titleDensity functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2en_US
dc.typeArticleen_US
dc.identifier.emailPhillips, DL:phillips@hku.hken_US
dc.identifier.authorityPhillips, DL=rp00770en_US
dc.description.naturelink_to_subscribed_fulltexten_US
dc.identifier.doi10.1016/S0009-2614(99)01353-6-
dc.identifier.scopuseid_2-s2.0-0001631326en_US
dc.identifier.hkuros51199-
dc.relation.referenceshttp://www.scopus.com/mlt/select.url?eid=2-s2.0-0001631326&selection=ref&src=s&origin=recordpageen_US
dc.identifier.volume316en_US
dc.identifier.issue5-6en_US
dc.identifier.spage524en_US
dc.identifier.epage530en_US
dc.identifier.isiWOS:000084960000030-
dc.publisher.placeNetherlandsen_US
dc.identifier.scopusauthoridZheng, X=7404090253en_US
dc.identifier.scopusauthoridPhillips, DL=7404519365en_US

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