Adsorption kinetics of small molecules on FePt metallic electrode by molecular dynamics simulation

Key Points

• This research aims to understand the adsorption kinetics of small molecules on FePt electrodes to enhance reaction efficiency.
• Conducted molecular dynamics simulations of small molecule adsorption on FePt surfaces.
• Analyzed the time reactants remain on the surfaces (adsorption time).
• Examined the dynamics of interfacial reactions in multistep processes.
• Identified key factors that influence adsorption times on FePt electrodes.
• Demonstrated variations in reaction efficiency linked to adsorption dynamics.