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Project

Dynamic elementary reaction networks for the kinetics of the catalytic conversion of renewable resources.

A methodology will be developed to automatically construct elementary reaction networks and analyze the kinetics for the catalytic conversion of renewable resources. A priori and a posteriori control mechanisms will guarantee an adequate network size throughout the simulations. The required thermodynamic properties and kinetic parameters will be determined by additivity methods or regression against experimental data.

Date:1 Oct 2015 →  30 Sep 2019
Keywords:biomass, network generation, microkinetics, catalysis, kinetic modeling
Disciplines:Catalysis and reacting systems engineering, Chemical product design and formulation, Analytical chemistry, Other (bio)chemical engineering, Transport phenomena, General chemical and biochemical engineering, Separation and membrane technologies, Macromolecular and materials chemistry, Process engineering, Automotive engineering