Rb+/Cs+ selectivity of benzo and tribenz
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Jérôme Golebiowski; Véronique Lamare; Manuel F. Ruiz–López
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Article
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2002
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John Wiley and Sons
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English
⚖ 202 KB
## Abstract A density functional study has been performed on Rb^+^ and Cs^+^ complexes of mono and tribenzo derivatives of the 21Crown7 crown ether. Calculations have been carried out using the B3LYP functional together with a split valence basis set with additional polarization and diffuse functio