A Theoretical Approach to Aromatic-Radical Interaction
This thesis describes work conducted towards the design and implementation of suitable models to describe accurately aromatic radical systems and the stabilising non covalent interaction with the radical. The DFT methodologies, B3LYP, BH&HLYP and B3PW9l have been implemented throughout this work...
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Bangor University
2006
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| Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.485125 |