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Please use this identifier to cite or link to this item: http://earchive.tpu.ru/handle/11683/18042
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dc.contributor.authorVusovich, O. V.en
dc.contributor.authorTchaikovskaya, O. N.en
dc.contributor.authorSokolova, I. V.en
dc.contributor.authorVasileva, N. Y.en
dc.date.accessioned2016-03-31T08:44:23Z-
dc.date.available2016-03-31T08:44:23Z-
dc.date.issued2015-
dc.identifier.citationQuantum-chemical study of electronically excited states ofprotolytic forms of vanillic acid / O. V. Vusovich [et al.] // Proceedings of SPIE. — 2015. — Vol. 9810 : Atomic and Molecular Pulsed Lasers XII : International Conference, 13–18 September 2015, Tomsk, Russian Federation : [proceedings]. — [98100F, 7 p.].en
dc.identifier.urihttp://earchive.tpu.ru/handle/11683/18042-
dc.description.abstractThe paper describes an analysis of possible ways of deactivation of electronically excited states of 4-hydroxy- 3-methoxy-benzoic acid (vanillic acid) and its protolytic forms with the use of quantum-chemical methods INDO/S (intermediate neglect of differential overlap with a spectroscopic parameterization) and MEP (molecular electrostatic potential). The ratio of radiative and non-radiative deactivation channels of the electronic excitation energy is established. The rate constants of photophysical processes (internal and intercombination conversions) occurring after the absorption of light in these forms are evaluated.en
dc.language.isoenen
dc.publisherSPIEen
dc.relation.ispartofProceedings of SPIE. Vol. 9810 : Atomic and Molecular Pulsed Lasers XII. — Bellingham, 2015.en
dc.rightsinfo:eu-repo/semantics/openAccessen
dc.subjectвинилиновая кислотаru
dc.subjectквантово-химические исследованияru
dc.subjectдезактивацияru
dc.subjectэлектронно-возбужденные состоянияru
dc.subjectпротеолитические формыru
dc.titleQuantum-chemical study of electronically excited states ofprotolytic forms of vanillic aciden
dc.typeConference Paperen
dc.typeinfo:eu-repo/semantics/publishedVersionen
dc.typeinfo:eu-repo/semantics/conferencePaperen
dcterms.audienceResearchesen
local.departmentНациональный исследовательский Томский политехнический университет (ТПУ)ru
local.description.firstpage981007-
local.filepathhttp://dx.doi.org/10.1117/12.2225721-
local.identifier.bibrecRU\TPU\network\12098-
local.identifier.colkeyRU\TPU\col\15902-
local.localtypeДокладru
local.volume9810-
local.conference.nameAtomic and Molecular Pulsed Lasers XII-
local.conference.date2015-
dc.identifier.doi10.1117/12.2225721-
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