Due to rapid advances in kinetic modeling, elementary surface reactions are key to understand the complex chemistry of catalytic partial oxidations. There is a limited experimental knowledge of surface species and a large number of unknown thermochemical and rate parameters. The challenge lies in identifying important reaction intermediates and estimating parameters to build a detailed surface reaction mechanism. This book addresses these challenges by presenting computationally efficient methods for thermodynamically consistent temperature and coverage-dependent enthalpies of surface species...
Due to rapid advances in kinetic modeling, elementary surface reactions are key to understand the complex chemistry of catalytic partial oxidations. T...