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Thermochemistry and Kinetics for the Oxidative Degradation of Dibenzofuran and Precursors

dc.contributor.authorSebbar, Nadia*
dc.date.accessioned2021-02-12T05:52:13Z
dc.date.available2021-02-12T05:52:13Z
dc.date.issued2006*
dc.date.submitted2019-07-30 20:01:57*
dc.identifier34333*
dc.identifier.urihttps://directory.doabooks.org/handle/20.500.12854/60875
dc.description.abstractThe emission of dibenzofurans and dioxins from industrial processes is a major environmental concern. Focussing on dibenzofuran, this study tend to improve our understanding of the general oxidation chemistry and to provide a mechanism suitable for future modelling studies.Based on quantum chemical methods, energies, chemical structures and reactions are calculated numerically. Not only stable molecules and radicals, but also transition states are reported in this work.*
dc.languageEnglish*
dc.subjectQD1-999*
dc.subject.classificationthema EDItEUR::P Mathematics and Science::PN Chemistryen_US
dc.subject.otherab initio*
dc.subject.otherTransition state theory*
dc.subject.otherThermochemistry*
dc.subject.otherDFT*
dc.subject.otherDioxin*
dc.subject.otherDibenzofuran*
dc.subject.otherGroupe additivity*
dc.subject.otherKinetics*
dc.subject.otherQRRK*
dc.subject.otherIsodesmic reactions*
dc.titleThermochemistry and Kinetics for the Oxidative Degradation of Dibenzofuran and Precursors*
dc.typebook
oapen.identifier.doi10.5445/KSP/1000005428*
oapen.relation.isPublishedBy68fffc18-8f7b-44fa-ac7e-0b7d7d979bd2*
oapen.relation.isbn9783866440852*
oapen.pagesVIII, 219 p.*
peerreview.review.typeFull text
peerreview.anonymityAll identities known
peerreview.reviewer.typeInternal editor
peerreview.reviewer.typeExternal peer reviewer
peerreview.review.stagePre-publication
peerreview.open.reviewNo
peerreview.publish.responsibilityScientific or Editorial Board
peerreview.id8ad5c235-9810-49eb-b358-27c8675324d9
peerreview.titleDissertations (Dissertationen)


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