Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico

Detalhes bibliográficos
Autor(a) principal: Martínez-Núñez,Emilio
Data de Publicação: 2002
Outros Autores: Vázquez,Saulo A.
Tipo de documento: Artigo
Idioma: spa
Título da fonte: Química Nova (Online)
Texto Completo: http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422002000400013
Resumo: The present review summarizes the most relevant results of our research group obtained recently in the field of unimolecular reaction dynamics. The following processes are specifically analyzed: the isomerization, dissociation and elimination in methyl nitrite, the fragmentation reactions of the mercaptomethyl cation, the C-CO dissociation in the acetyl and propionyl radicals, and the decomposition of vinyl fluoride. In all the cases, only state- or energy-selected systems are considered. Special emphasis is paid to the possibility of systems exhibiting non-statistical behavior.
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spelling Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadísticoreaction dynamicsclassical trajectoriesRRKM calculationsThe present review summarizes the most relevant results of our research group obtained recently in the field of unimolecular reaction dynamics. The following processes are specifically analyzed: the isomerization, dissociation and elimination in methyl nitrite, the fragmentation reactions of the mercaptomethyl cation, the C-CO dissociation in the acetyl and propionyl radicals, and the decomposition of vinyl fluoride. In all the cases, only state- or energy-selected systems are considered. Special emphasis is paid to the possibility of systems exhibiting non-statistical behavior.Sociedade Brasileira de Química2002-07-01info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersiontext/htmlhttp://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422002000400013Química Nova v.25 n.4 2002reponame:Química Nova (Online)instname:Sociedade Brasileira de Química (SBQ)instacron:SBQ10.1590/S0100-40422002000400013info:eu-repo/semantics/openAccessMartínez-Núñez,EmilioVázquez,Saulo A.spa2002-08-26T00:00:00Zoai:scielo:S0100-40422002000400013Revistahttps://www.scielo.br/j/qn/ONGhttps://old.scielo.br/oai/scielo-oai.phpquimicanova@sbq.org.br1678-70640100-4042opendoar:2002-08-26T00:00Química Nova (Online) - Sociedade Brasileira de Química (SBQ)false
dc.title.none.fl_str_mv Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
title Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
spellingShingle Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
Martínez-Núñez,Emilio
reaction dynamics
classical trajectories
RRKM calculations
title_short Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
title_full Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
title_fullStr Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
title_full_unstemmed Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
title_sort Dinámica de reacciones unimoleculares en fase gas: Desviaciones del comportamiento estadístico
author Martínez-Núñez,Emilio
author_facet Martínez-Núñez,Emilio
Vázquez,Saulo A.
author_role author
author2 Vázquez,Saulo A.
author2_role author
dc.contributor.author.fl_str_mv Martínez-Núñez,Emilio
Vázquez,Saulo A.
dc.subject.por.fl_str_mv reaction dynamics
classical trajectories
RRKM calculations
topic reaction dynamics
classical trajectories
RRKM calculations
description The present review summarizes the most relevant results of our research group obtained recently in the field of unimolecular reaction dynamics. The following processes are specifically analyzed: the isomerization, dissociation and elimination in methyl nitrite, the fragmentation reactions of the mercaptomethyl cation, the C-CO dissociation in the acetyl and propionyl radicals, and the decomposition of vinyl fluoride. In all the cases, only state- or energy-selected systems are considered. Special emphasis is paid to the possibility of systems exhibiting non-statistical behavior.
publishDate 2002
dc.date.none.fl_str_mv 2002-07-01
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422002000400013
url http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422002000400013
dc.language.iso.fl_str_mv spa
language spa
dc.relation.none.fl_str_mv 10.1590/S0100-40422002000400013
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv text/html
dc.publisher.none.fl_str_mv Sociedade Brasileira de Química
publisher.none.fl_str_mv Sociedade Brasileira de Química
dc.source.none.fl_str_mv Química Nova v.25 n.4 2002
reponame:Química Nova (Online)
instname:Sociedade Brasileira de Química (SBQ)
instacron:SBQ
instname_str Sociedade Brasileira de Química (SBQ)
instacron_str SBQ
institution SBQ
reponame_str Química Nova (Online)
collection Química Nova (Online)
repository.name.fl_str_mv Química Nova (Online) - Sociedade Brasileira de Química (SBQ)
repository.mail.fl_str_mv quimicanova@sbq.org.br
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