Methods for the treatment of multiple states in non-adiabatic direct quantum dynamics simulations

Following the pioneering work of Zewail, the field of Femtochemistry was opened up to experimental studies. However, the interpretation of the results of these studies is often difficult and hence theoretical and computational methods for the modelling of these processes have been developed. In thes...

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Bibliographic Details
Main Author: Spinlove, Kaite Eryn
Published: University of Birmingham 2018
Subjects:
540
Online Access:https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.753096