PhD Theses

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(16) Renato Orenha ––– Computational Study of Ruthenium–Nitrosyl Compounds ––– Vrije Universiteit Amsterdam, planned for mid 2017 (double degree: University of São Paulo - Ribeirão Preto, SP, Brazil, 8 May 2017).    

(15) J. P. Martinez ––– Reactivity of Fullerenes, Endohedral Metallofullerenes, and Nanotubes, and their Possible Application in Solar Energy Conversion ––– Vrije Universiteit Amsterdam, 17 May 2017 (double degree: Universitat de Girona, 18 November 2016).

(14)  L. P. Wolters     
Chemical Bonding and Catalysis: Molecular Orbital Perspectives on Catalyst Design and Halogen Bonds.
Vrije Universiteit, Amsterdam, 22 March 2016.

(13) L. Guillaumes                                                                                                                                    Analysis of Cooperation and Electron Delocalization in Intermolecular Hydrogen Bonds.       Double Degree                                                                                                                              Universitat de Girona, 15 June 2015.                                                                                                    Vrije Universiteit Amsterdam, 22 June 2015.

(12) B. Zarcycki 
Element-Element Bindungsaktivierung an [Ni(iPr2Im)2] und [(η5-C5H5)Co(iPr2Im)].
Julius-Maximilians-Universität Würzburg, 21 March 2013.

(11) H. Kruse 
Supramolecular Quantum Chemistry: Application and Development of Methodologies for Large Systems.
Westfälische Wilhelms-Universität Münster, 24 August 2012.

(10) K. Seubert
Metallvermittelte Basenpaare mit künstlichen tridentaten und purinabgeleiteten Nukleobasen sowie chimäre metallvermittelte GNA/DNA Basenpaarung.
Westfälische Wilhelms-Universität Münster, 15 June 2012.

(9) W.-J. van Zeist 
Activating Bonds - Theoretical studies of chemical bonds and their catalytic activation by palladium.
Open-access version (without Chapters 4, 5, 7, 8)
- Supporting Information: Movies of reactions 
Vrije Universiteit, Amsterdam, 15 June 2011.

(8) D. A. Megger
Metal-mediated base pairs containing artificial purine-, phenanthroline-, and bis(pyridine)- derived nucleobases
Westfälische Wilhelms-Universität Münster, 26 August 2010.


(
7) T. van der Wijst
DFT Calculations on Metal-Nucleobase Complexes
Technische Universität Dortmund, 16 October 2009
.


(
6) M. A. van Bochove
Nucleophilic Substitution at Phosphorus Centers
Vrije Universiteit, Amsterdam, 9 December 2008.
(
ISBN: 978-90-9023704-6)


(
5) A. P. Bento
Nucleophilic Substitution Reactions - Theoretical Study on the Origin of Reaction Barriers
Vrije Universiteit, Amsterdam, 27 October 2008.


(
4) S. C. A. H. Pierrefixe
Hypervalence and Aromaticity
Vrije Universiteit, Amsterdam, 2 June 2008.
 
(ISBN: 978-90-8891-0432)


(3) G. Th. de Jong
Theoretical Studies on Catalytic Bond Activation
Vrije Universiteit, Amsterda
m, 24 April 2007. 
(ISBN: 978-90-8659-0872)


(2) A. Diefenbach 
Fragment-Oriented Design of Catalysts - A Theoretical Study on Bond Activation 
Philipps-Universität, Marburg, 20 December 2000.


(1) C. Fonseca Guerra 
Structure and Bonding of DNA - Development and Application of Parallel and Order-N DFT Methods 
Vrije Universiteit, Amsterdam, 22 February 2000.

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