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Conformations and electronic properties of alkyl peroxides, alkylperoxy radicals and alkoxy radicals

✍ Scribed by K. Ohkubo; T. Fujita; H. Sato


Publisher
Elsevier Science
Year
1977
Tongue
English
Weight
673 KB
Volume
36
Category
Article
ISSN
0022-2860

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✍ W.G. Alcock; B. Mile πŸ“‚ Article πŸ“… 1977 πŸ› Elsevier Science 🌐 English βš– 800 KB

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## Abstract The recombination reactions of prototypical alkyl radicals (R) with O~2~, R + O~2~ β†’ RO~2~, have been investigated theoretically by using the variational transition state theory and Rice–Ramsperger–Kassel–Marcus theory/master equation calculations based on the CASPT2(7,5)/aug‐cc‐pVDZ//B