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Ultrafast reaction dynamics of auramine O in a cyclodextrin nanocavity

✍ Scribed by Kondo, Minako; Heisler, Ismael A.; Meech, Stephen R.

Book ID: 119328710
Publisher: Elsevier Science
Year: 2012
Tongue: English
Weight: 422 KB
Volume: 176
Category: Article
ISSN: 0167-7322
DOI: 10.1016/j.molliq.2012.06.006

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## Abstract The ClO~3~ many‐body expansion potential energy surface of Farantos and Murrell (__Int J Quantum Chem__ 1978, 14, 659) has been modified along the minimum energy path for the reaction O + OClO → ClO + O~2~ such as to conform with the available kinetics data. The dynamics of the title re