Towards an accurate theoretical description of surface processes
Molecular modelling methods are indispensable for both helping to understand experimental results and to explore new materials. In this thesis we focus on theoretical methods that are used to study activated processes at surfaces as well as those which can account for van der Waals dispersion forces...
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University College London (University of London)
2011
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| Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.565324 |