Impact of d-Band Occupancy and Lattice Contraction on Selective Hydrogen Production from Formic Acid in the Bimetallic Pd₃M (M = Early Transition 3d Metals) Catalysts

Engineering & Materials Science

• Formic acid 100%
• Hydrogen production 74%
• Catalysts 56%
• Metals 42%
• Atoms 34%
• Electronic structure 33%
• Energy barriers 17%
• Density functional theory 16%
• Transition metals 16%
• Charge transfer 14%
• Hydrogen storage 14%
• Alloying 12%
• Activation energy 11%
• Adsorption 10%
• Decomposition 8%

Chemical Compounds

• Formic Acid 59%
• Surface 21%
• Electronic State 16%
• Catalyst 13%
• Modification 12%
• Alloying 11%
• Energy Barrier 10%
• Catalyst Property 9%
• Transition Element 8%
• Strain 7%
• Charge Transfer 7%
• Reaction Activation Energy 7%
• Decomposition 7%
• Density Functional Theory 6%
• Hydrogen 5%
• Adsorption 5%