What Challenges Exist in Predicting Catalytic Behavior?
Despite advancements, predicting catalytic behavior remains challenging due to the complexity of catalytic systems. One of the main challenges is the multiscale nature of catalysis, where phenomena at different scales (atomic, molecular, macroscopic) interact. Additionally, the presence of numerous variables and possible reaction pathways adds to the complexity. Overcoming these challenges requires continuous advancements in both experimental and computational techniques.