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- W2380195527 abstract "Using quantum chemistry methods,we study the mechanisms and kinetics of CH4+NO2 reaction.The results show that the rate constants obtained with the canonical variational transition state theory with a small curvature tunnelling correction are in good agreement with the available experimental data.As for the title reaction,three reaction channels are found to form CH3+HNO2,CH3+trans-HONO and CH3+cis-HONO.Over the whole temperature region,the channel of O abstracts hydrogen to produce CH3+cis-HONO is the most feasible." @default.
- W2380195527 created "2016-06-24" @default.
- W2380195527 creator A5063505795 @default.
- W2380195527 date "2009-01-01" @default.
- W2380195527 modified "2023-09-26" @default.
- W2380195527 title "The theoretical investigation on the reaction of CH_4 with NO_2" @default.
- W2380195527 hasPublicationYear "2009" @default.
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