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Browsing by Subject Density functional calculations

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Issue DateTitleAuthor(s)
2014Nickel(II) complexes of pentadentate N5 ligands as catalysts for alkane hydroxylation by using m-CPBA as oxidant: a combined experimental and computational studySankaralingam, M; Balamurugan, M; Palaniandavar, M; Vadivelu, P; Suresh, C H
2008Pyridine-catalyzed stereoselective addition of acyclic 1, 2-diones to acetylenic esters: Synthetic and theoretical studies of an unprecedented rearrangementAbhilash, N P; Suresh, C H; Vijay Nair, G
Showing results 1 to 2 of 2