Second-Order Description of Conical Intersections
This thesis concerns the theoretical development and implementation of a second-oider description of conical intersections. Several novel methodologies are presented and new aspects of the field are discussed. The conditions leading to a Born-Oppenheimer failure are outlined and a general formulatio...
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Imperial College London
2007
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| Online Access: | http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.487525 |