What are the Advantages of Using KMC in Catalysis?
KMC offers several advantages for studying catalytic processes:
- Atomic-Scale Resolution - Provides a detailed understanding of the atomic-level mechanisms driving catalytic reactions. - Temporal Evolution - Captures the dynamic behavior and temporal evolution of catalytic systems. - Non-Equilibrium Conditions - Handles non-equilibrium conditions effectively, which are common in real-world catalytic processes. - Complexity Management - Manages the complexity of multiple interacting events, offering insights into rate-determining steps and overall reaction kinetics.
