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Theoretical study of the 12A″ (X2II) State of N2 O+: implications for isotopic scrambling

✍ Scribed by A.R. Gregory; K.K. Sunil; K.D. Jordan

Publisher: Elsevier Science
Year: 1984
Tongue: English
Weight: 367 KB
Volume: 108
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(84)85175-1

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✦ Synopsis

Ab initio calculations suggest that the potential energy surface for the 1 2_~" state of N,O' has ;! secondary nljnimunl corresponding to a stron+ bent structure. This structure is computed to lie below the x'XT smtc cner~elically and therefore may be responsible for the isotopic scrnnrblin~ observed in this energy region.

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