NBO–NEDA, NPA, and QTAIM studies on the interactions between aza-, diaza-, and triaza-12-crown-4 (An-12-crown-4, n=1, 2, 3) and Li+, Na+, and K+ ions

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Title
NBO–NEDA, NPA, and QTAIM studies on the interactions between aza-, diaza-, and triaza-12-crown-4 (An-12-crown-4, n=1, 2, 3) and Li+, Na+, and K+ ions
Authors
Keywords
NEDA, NBO, QTAIM, DFT, Aza-12-Crown-4
Journal
Computational and Theoretical Chemistry
Volume 1051, Issue -, Pages 62-71
Publisher
Elsevier BV
Online
2014-11-07
DOI
10.1016/j.comptc.2014.10.038

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