Study of the interaction in clusters formed by phenol and CH3X (X=CN,F,Cl) molecules

The characteristics of the interaction between phenol and acetonitrile, methyl fluoride and methyl chloride were studied. The most stable structures for clusters containing one or two CH3X molecules and one phenol moiety were located by means of ab initio and density functional theory calculations....

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Bibliographic Details
Published in:The Journal of chemical physics, Vol. 128, No. 19 (2008), p. 194311
Main Author: Cabaleiro-Lago, Enrique M
Other Involved Persons: Peña-Gallego, Angeles ; Rodríguez-Otero, Jesús
Format: electronic Article
Item Description:Date Completed 28.07.2008
Date Revised 24.11.2016
published: Print
Citation Status MEDLINE
Copyright: From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine
Physical Description:Online-Ressource
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