The analysis of the PES for the reaction between HOCO and NO2 shows that two intermediates are present, namely HOC(O)ONO and HOC(O)NO2, from which respectively products HONO + CO2 and HNO2 + CO2 are expected, while the other envisageable products HONO2 + CO seems extremely disfavoured.
Titolo: | An ab-initio study of the reaction of HOCO radicals with NO2: Addition/Elimination mechanism |
Autore/i: | POGGI, GABRIELLA; Joseph S. Francisco |
Autore/i Unibo: | |
Anno: | 2009 |
Rivista: | |
Digital Object Identifier (DOI): | http://dx.doi.org/10.1063/1.3095757 |
Abstract: | The analysis of the PES for the reaction between HOCO and NO2 shows that two intermediates are present, namely HOC(O)ONO and HOC(O)NO2, from which respectively products HONO + CO2 and HNO2 + CO2 are expected, while the other envisageable products HONO2 + CO seems extremely disfavoured. |
Data prodotto definitivo in UGOV: | 2010-02-04 11:13:48 |
Appare nelle tipologie: | 1.01 Articolo in rivista |
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