Assessment of Reactivity Descriptors for the Study of Chemical Reactions
Tue, 20/03/2007
Prof. Dr. Michel Waroquier
Theoretical insights into the propagation techniques and defect formation of free radical polymerization
Thu, 31/05/2007
Development and Implementation of Theoretical Methods for the Calculation of EPR Parameters in Periodic Simulations
Development of an Accurate and Efficient Method for Normal Mode Analysis in Extended Molecular Systems: the Mobile Block Hessian method
Tue, 19/05/2009
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Supervisors
Prof. Dr. Michel WaroquierA combined EMR and DFT study of radiation-induced effects in surcose and glucose 1-phosphate
Wed, 27/05/2009
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Supervisors
Prof. Dr. Freddy Callens, Prof. Dr. Michel WaroquierMolecular Modeling of the Synthesis of Zeolites and Related Nanoporous Materials
Thu, 28/05/2009
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Solvent Effects in Chemical, Biochemical and Polymerization Reactions, Studied with Static and Dynamic Molecular Modeling
Mon, 25/10/2010
Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghent
Microscopische studie van de kinetiek van vrije radicalaire propagatiereacties
Theoretische studie van reactiviteitsindices binnen het DFT formalisme
Moleculaire modellering van elementaire processen in de cokesvorming
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