Error bar assesment for ab initio prediction of surface properties S. De Waele Master of Science in Engineering Physics2015Supervisors Prof. Dr. Stefaan Cottenier, Prof. Dr. ir. Veronique Van Speybroeck Read more about Error bar assesment for ab initio prediction of surface properties
Computationele trekproeven voor wolfraamlegeringen in kernfusiereactoren T. Beyen Master of Science in Physics and Astronomy2015Supervisors Prof. Dr. Stefaan Cottenier, Prof. Dr. ir. Veronique Van Speybroeck Read more about Computationele trekproeven voor wolfraamlegeringen in kernfusiereactoren
Ab initio Studie naar de invloed van water op de methanol conversie in H-SAPO-34 S. Bailleul Master of Science in Chemical Engineering2015Supervisors Prof. Dr. ir. Veronique Van Speybroeck, Dr. ir. Karen Hemelsoet Read more about Ab initio Studie naar de invloed van water op de methanol conversie in H-SAPO-34
Molecular-Level Understanding of Adsorption and Zeolite-Catalyzed Reactions in the Methanol-to-Olefins Process J. Van der Mynsbrugge Fri, 23/05/2014Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghenthttp://hdl.handle.net/1854/LU-4397992Supervisors Prof. Dr. ir. Veronique Van Speybroeck Read more about Molecular-Level Understanding of Adsorption and Zeolite-Catalyzed Reactions in the Methanol-to-Olefins Process
Ab Initio Screening of Suitable Tungsten Alloys as First-Wall Material in Nuclear Fusion Reactors K. Lejaeghere Wed, 21/05/2014Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghenthttp://hdl.handle.net/1854/LU-4390485Supervisors Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. Stefaan Cottenier Read more about Ab Initio Screening of Suitable Tungsten Alloys as First-Wall Material in Nuclear Fusion Reactors
Molecular-Level Understanding of Adsorption and Zeolite-Catalyzed Reactions in the Methanol-to-Olefins Process J. Van der Mynsbrugge Mon, 23/06/2014Supervisors Prof. Dr. ir. Veronique Van Speybroeck Read more about Molecular-Level Understanding of Adsorption and Zeolite-Catalyzed Reactions in the Methanol-to-Olefins Process
Molecular dynamics simulations as a tool for understanding zeolite nanogrowth and liquid structure M. Van Houteghem Mon, 16/12/2013Faculty of Engineering and Architecture, Jozef Plateaustraat, Ghenthttp://hdl.handle.net/1854/LU-4228273Supervisors Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. Michel Waroquier Read more about Molecular dynamics simulations as a tool for understanding zeolite nanogrowth and liquid structure
Thermodynamics of adsorption in flexible frameworks with the aid of Monte Carlo simulations R. Demuynck Master of Science in Engineering Physics2014Supervisors Dr. ir. An Ghysels, Prof. Dr. ir. Veronique Van Speybroeck Read more about Thermodynamics of adsorption in flexible frameworks with the aid of Monte Carlo simulations
Dynamic ab initio study towards new hydrocarbon pool cycles for the MTO-conversion in H-SAPO-5 T. Deconinck Master of Science in Chemical Engineering2014Supervisors Prof. Dr. ir. Veronique Van Speybroeck, Dr. ir. Karen Hemelsoet Read more about Dynamic ab initio study towards new hydrocarbon pool cycles for the MTO-conversion in H-SAPO-5
Derivation and implementation of equations of motion for isothermal and isobaric Molecular Dynamics simulations S.M.J. Rogge Master of Science in Engineering Physics2014Supervisors Prof. Dr. ir. Veronique Van Speybroeck, Prof. Dr. ir. Toon Verstraelen Read more about Derivation and implementation of equations of motion for isothermal and isobaric Molecular Dynamics simulations