Unraveling the effects of Fe and Mn promoters on the tungstated zirconia catalyst: A DFT study

Engineering & Materials Science

• Zirconia 100%
• Discrete Fourier transforms 92%
• Catalysts 71%
• Deprotonation 56%
• Metals 54%
• Electronic properties 43%
• Acidity 38%
• Oxidation-Reduction 36%
• Monomers 33%
• Doping (additives) 31%
• Atoms 29%
• Adsorption 27%

Physics & Astronomy

• zirconium oxides 86%
• catalysts 78%
• acidity 58%
• initiators 53%
• trimers 50%
• metals 43%
• monomers 38%
• adsorption 32%
• life (durability) 28%
• electronics 21%
• atoms 21%
• energy 12%

Chemistry

• Density Functional Theory 52%
• Metal 37%
• Catalyst 35%
• Trimer 27%
• Deprotonation 26%
• Doping Material 24%
• Catalyst Property 24%
• Electron Spin 23%
• Electronic Property 23%
• Molecular Cluster 18%
• Monomer 16%
• Adsorption 13%
• Energy 13%
• Reduction 12%