Data in catalysis comes from various sources, including experimental data, computational simulations, and literature. Experimental data is obtained from laboratory experiments where parameters such as temperature, pressure, and reactant flow rates are controlled and measured. Computational simulations, including Density Functional Theory (DFT) and molecular dynamics, provide insights into molecular interactions and reaction pathways. Literature data, comprising published research findings, offers valuable information on catalytic performance and mechanisms reported by other researchers.
