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dc.contributor.author
Cobos, Carlos Jorge  
dc.contributor.author
Tellbach, Elsa  
dc.contributor.author
Sölter, Lars  
dc.contributor.author
Troe, Jürgen  
dc.date.available
2024-02-15T11:01:36Z  
dc.date.issued
2023-02  
dc.identifier.citation
Cobos, Carlos Jorge; Tellbach, Elsa; Sölter, Lars; Troe, Jürgen; Influence of Molecular Parameters on Rate Constants of Thermal Dissociation/Recombination Reactions: The Reaction System CF4 ⇄ CF3 + F; American Chemical Society; Journal of Physical Chemistry A; 127; 7; 2-2023; 1697-1701  
dc.identifier.issn
1089-5639  
dc.identifier.uri
http://hdl.handle.net/11336/226933  
dc.description.abstract
The possibilities to extract incompletely characterized molecular parameters from experimental thermal rate constants for dissociation and recombination reactions are explored. The reaction system CF4 (+M) ⇄ CF3 + F (+M) is chosen as a representative example. A set of falloff curves is constructed and compared with the available experimental database. Agreement is achieved by minor (unfortunately not separable) adjustments of reaction enthalpy and collisional energy transfer parameters.  
dc.format
application/pdf  
dc.language.iso
eng  
dc.publisher
American Chemical Society  
dc.rights
info:eu-repo/semantics/openAccess  
dc.rights.uri
https://creativecommons.org/licenses/by/2.5/ar/  
dc.subject
CF4 ⇄ CF3 + F  
dc.subject.classification
Físico-Química, Ciencia de los Polímeros, Electroquímica  
dc.subject.classification
Ciencias Químicas  
dc.subject.classification
CIENCIAS NATURALES Y EXACTAS  
dc.title
Influence of Molecular Parameters on Rate Constants of Thermal Dissociation/Recombination Reactions: The Reaction System CF4 ⇄ CF3 + F  
dc.type
info:eu-repo/semantics/article  
dc.type
info:ar-repo/semantics/artículo  
dc.type
info:eu-repo/semantics/publishedVersion  
dc.date.updated
2024-02-14T12:48:48Z  
dc.journal.volume
127  
dc.journal.number
7  
dc.journal.pagination
1697-1701  
dc.journal.pais
Estados Unidos  
dc.journal.ciudad
Washington  
dc.description.fil
Fil: Cobos, Carlos Jorge. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas; Argentina  
dc.description.fil
Fil: Tellbach, Elsa. Universität Göttingen; Alemania  
dc.description.fil
Fil: Sölter, Lars. Universität Göttingen; Alemania  
dc.description.fil
Fil: Troe, Jürgen. Universität Göttingen; Alemania  
dc.journal.title
Journal of Physical Chemistry A  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/url/https://pubs.acs.org/doi/10.1021/acs.jpca.3c00011  
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/10.1021/acs.jpca.3c00011  

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