Reaction Mechanisms

Based on theoretical and experimental investigations, we develop detailed chemical reaction mechanisms based on elementary steps for homogeneous and heterogeneous reactions, with a special focus on catalytic, multi-phase, and electrochemical systems. The models include kinetic and thermodynamic data and can be downloaded from the internet, where also the associated evaluation procedure, potential operating conditions, and citation reference are given. The mechanisms are given in DETCHEM format and in CHEMKIN format.

Reaction mechanisms