A DFT study of vitamin B12 derivatives

A dissertation submitted to the Faculty of Science, University of the Witwatersrand, in fulfillment of the requirements for the degree of Doctor of Philosophy, April 2013. === Density functional theory (DFT) and time dependent-DFT (TD-DFT) was applied to investigate the geometric and electronic prop...

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Bibliographic Details
Main Author: Govender, Poomani Penny
Format: Others
Language:en
Published: 2013
Subjects:
Online Access:http://hdl.handle.net/10539/13006