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Theoretical investigations of the interaction of but-2-ene with a sodium ion

✍ Scribed by R. Lochmann; W. Meiler; Th. Weller


Publisher
Elsevier Science
Year
1983
Tongue
English
Weight
294 KB
Volume
94
Category
Article
ISSN
0022-2860

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Theoretical study of the interaction bet
✍ Francesco Ferrante; Gianfranco La Manna πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 323 KB πŸ‘ 2 views

## Abstract DFT calculations have been carried out to describe the pathway of a sodium ion along the stacking direction of a tubular structure set up by five cyclopeptidic units, which can be considered a suitable model of a hollow tubular structure of indefinite length. A lattice of points inside