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Stability of C20fullerene chains

✍ Scribed by L. A. Openov; I. V. Davydov; A. I. Podlivaev

Book ID: 110168450
Publisher: SP MAIK Nauka/Interperiodica
Year: 2007
Tongue: English
Weight: 301 KB
Volume: 85
Category: Article
ISSN: 0021-3640
DOI: 10.1134/s0021364007070089

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The structure of 20-atom carbon clusters has been studied using correlated ab initio calculations with large basis sets. SCF calculations predict a monocyclic, poly-acetylene structure to be the most stable form. In contrast, a "fullerene"-type, cage struo ture is the ground state conformer at the c

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