✦ LIBER ✦

The present state of computational knowledge of thermodynamics of formation of the C5(g) cluster

✍ Scribed by Zdeněk Slanina

Publisher: Elsevier Science
Year: 1990
Tongue: English
Weight: 355 KB
Volume: 166
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(90)80036-d

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✦ Synopsis

The equilibrium has been studied between graphite and the C5 linear cluster, characterized by means of the most sophisticated available quantum-chemical data. For some combinations of theoretical parameters the agreement with the observed value of equilibrium constant is better than one order of magnitude.

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