Article ID Journal Published Year Pages File Type
1326191 Journal of Organometallic Chemistry 2008 5 Pages PDF
Abstract
In this work we have considered a series of 10 chalcanthrenes-fullerene complexes that were studied by the BLYP density functional theory (DFT) approach. A complete series of chalcanthrenes (C12H8XY, in which X, Y = O, S, Se, Te) were studied for energetic, structural and vibrational changes.
Related Topics
Physical Sciences and Engineering Chemistry Inorganic Chemistry
Authors
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