Understanding the Structure and Reaction of Single Molecules on Metal surfaces from First Principles

The study of surface adsorption and reaction is not only interesting from a scientific point of view, but also important in many application fields such as energy, environment, catalysis, corrosion, electronic device, and sensor. Theoretical calculations are essential in these studies. In this thesi...

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Bibliographic Details
Main Author: Fu, Qiang
Format: Doctoral Thesis
Language:English
Published: KTH, Teoretisk kemi och biologi 2011
Subjects:
Online Access:http://urn.kb.se/resolve?urn=urn:nbn:se:kth:diva-33565
http://nbn-resolving.de/urn:isbn:978-91-7415-978-3