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dc.contributor.authorNeves, R. F. C.
dc.contributor.authorJones, D. B.
dc.contributor.authorLopes, M. C. A.
dc.contributor.authorNixon, Kate
dc.contributor.authorde Oliveira, E. M.
dc.contributor.authorda Costa, R. F.
dc.contributor.authorVarella, M. T. do N.
dc.contributor.authorBettega, M. H. F.
dc.contributor.authorLima, M. A. P.
dc.contributor.authorda Silva, G. B.
dc.contributor.authorBrunger, M. J.
dc.date.accessioned2018-04-17T11:26:38Z
dc.date.available2018-04-17T11:26:38Z
dc.date.issued2015-05-21
dc.identifier.citationIntermediate energy electron impact excitation of composite vibrational modes in phenol 2015, 142 (19):194302 The Journal of Chemical Physics
dc.identifier.issn0021-9606
dc.identifier.issn1089-7690
dc.identifier.doi10.1063/1.4921038
dc.identifier.urihttp://hdl.handle.net/2436/621244
dc.description.abstractWe report differential cross section results from an experimental investigation into the electron impact excitation of a number of the low-lying composite (unresolved) vibrational modes in phenol (C6H5OH). The measurements were carried out at incident electron energies in the range 15–40 eV and for scattered-electron angles in the range 10–90°. The energy resolution of those measurements was typically ∼80 meV. Calculations, using the GAMESS code, were also undertaken with a B3LYP/aug-cc-pVDZ level model chemistry, in order to enable us to assign vibrational modes to the features observed in our energy loss spectra. To the best of our knowledge, the present cross sections are the first to be reported for vibrational excitation of the C6H5OH molecule by electron impact.
dc.description.sponsorshipARC, CNPq, FAPESP and CAPES
dc.language.isoen
dc.publisherAmerican Institute of Physics
dc.relation.urlhttp://aip.scitation.org/doi/10.1063/1.4921038
dc.subjectphenol
dc.subjectvibrational
dc.subjectelectron impact
dc.titleIntermediate energy electron impact excitation of composite vibrational modes in phenol
dc.typeJournal article
dc.identifier.journalThe Journal of Chemical Physics
dc.contributor.institutionSchool of Chemical and Physical Sciences, Flinders University, G.P.O. Box 2100, Adelaide, SA 5001, Australia
dc.contributor.institutionSchool of Chemical and Physical Sciences, Flinders University, G.P.O. Box 2100, Adelaide, SA 5001, Australia
dc.contributor.institutionDepartamento de Física, Universidade Federal de Juiz de Fora, 36036-900, Juiz de Fora, Minas Gerais, Brazil
dc.contributor.institutionDepartamento de Física, Universidade Federal de Juiz de Fora, 36036-900, Juiz de Fora, Minas Gerais, Brazil
dc.contributor.institutionInstituto de Física ‘Gleb Wataghin,’ Universidade Estadual de Campinas, 13083-859 Campinas, São Paulo, Brazil
dc.contributor.institutionCentro de Ciências Naturais e Humanas, Universidade Federal do ABC, 09210-580 Santo André, São Paulo, Brazil
dc.contributor.institutionInstituto de Física, Universidade de São Paulo, C.P. 66318, 05315-970 São Paulo, Brazil
dc.contributor.institutionDepartamento de Física, Universidade Federal do Paraná, C.P. 19044, 81531-990 Curitiba, Paraná, Brazil
dc.contributor.institutionInstituto de Física ‘Gleb Wataghin,’ Universidade Estadual de Campinas, 13083-859 Campinas, São Paulo, Brazil
dc.contributor.institutionUniversidade Federal de Mato Grosso, Barra do Garças, Mato Grosso, Brazil
dc.contributor.institutionSchool of Chemical and Physical Sciences, Flinders University, G.P.O. Box 2100, Adelaide, SA 5001, Australia
refterms.dateFOA2018-08-21T15:22:57Z
html.description.abstractWe report differential cross section results from an experimental investigation into the electron impact excitation of a number of the low-lying composite (unresolved) vibrational modes in phenol (C6H5OH). The measurements were carried out at incident electron energies in the range 15–40 eV and for scattered-electron angles in the range 10–90°. The energy resolution of those measurements was typically ∼80 meV. Calculations, using the GAMESS code, were also undertaken with a B3LYP/aug-cc-pVDZ level model chemistry, in order to enable us to assign vibrational modes to the features observed in our energy loss spectra. To the best of our knowledge, the present cross sections are the first to be reported for vibrational excitation of the C6H5OH molecule by electron impact.


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