Computer modelling of ligand exchange pathways and transition states

In this thesis the use of LFMM and the application of it to problems not typical tractable within a classical framework are detailed. The parameterisation of LFMM through the AOM is shown for a number of different metal ligand complexes. The developed parameters are then used to investigate numerous...

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Bibliographic Details
Main Author: Randell, Kris
Published: University of Warwick 2009
Subjects:
Online Access:http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.524359