Ab Initio and DFT Investigations of the Mechanistic Pathway of Singlet Bromocarbenes Insertion into C-H Bonds of Methane and Ethane - researchr publication authors

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M. Ramalingam, K. Ramasami, P. Venuvanalingam, J. Swaminathan. Ab Initio and DFT Investigations of the Mechanistic Pathway of Singlet Bromocarbenes Insertion into C-H Bonds of Methane and Ethane. In Yong Shi, G. Dick van Albada, Jack Dongarra, Peter M. A. Sloot, editors, Computational Science - ICCS 2007, 7th International Conference, Beijing, China, May 27 - 30, 2007, Proceedings, Part II. Volume 4488 of Lecture Notes in Computer Science, pages 288-295, Springer, 2007. [doi]

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