Vibrational analysis of methyl cation-Rare gas atom complexes: CH 3 + -Rg (Rg = He, Ne, Ar, Kr)

The vibrational spectra of simple CH -Rg (Rg = He, Ne, Ar, Kr) complexes have been studied by vibrational configuration interaction theory relying on multidimensional potential energy surfaces (PESs) obtained from explicitly correlated coupled cluster calculations, CCSD(T)-F12a. In agreement with ex...

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Bibliographic Details

Published in:	The Journal of chemical physics Vol. 150; no. 8; p. 084306
Main Authors:	Meisner, Jan, Hallmen, Philipp P, Kästner, Johannes, Rauhut, Guntram
Format:	Journal Article
Language:	English
Published:	United States 28.02.2019
ISSN:	1089-7690
Online Access:	Get more information
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