What Future Trends are Expected in Computational Catalysis?
Looking forward, several trends are likely to shape the future of computational catalysis:
Integration with Experimental Data: Combining computational models with experimental results to create more accurate and comprehensive models. AI and Machine Learning: The increasing use of artificial intelligence and machine learning to analyze large datasets and predict catalytic behaviors. Quantum Computing: The potential for quantum computing to revolutionize the field by solving complex problems that are currently intractable for classical computers.
