A DFT Study of CO Hydrogenation on Graphene Oxide: Effects of Adding Mn on Fischer–Tropsch Synthesis

Keyphrases

• Carbon Dioxide 100%
• Density Functional Theory 100%
• Fischer-Tropsch Synthesis 100%
• Carbon Monoxide Hydrogenation 100%
• Graphene Oxide 100%
• Methanol 60%
• Formaldehyde 60%
• Hydrocarbons 40%
• Adatoms 40%
• Manganese Doping 40%
• Reaction Energy Barrier 40%
• Doped Graphene Oxide 40%
• CH2+ 40%
• Air Pollution 20%
• Thermodynamics 20%
• CH4 Production 20%
• Hydrogenation 20%
• Mechanistic Aspects 20%
• Catalytic Conversion 20%
• Activation Energy 20%
• Catalytic Route 20%
• Energy Barrier 20%
• OH Groups 20%
• Catalyst Surface 20%
• Reaction Sequence 20%
• Thermodynamic Properties 20%
• Adsorption Geometry 20%
• Oxide Surfaces 20%
• Clean Environment 20%
• Strong Adsorption 20%
• Exothermic Reaction 20%
• Reaction Energy 20%
• Thermodynamic Reaction 20%
• Conversion Reaction 20%
• Endothermic Reaction 20%

Chemistry

• Hydrogenation 100%
• Density Functional Theory Study 100%
• Carbon Monoxide 100%
• Graphene Oxide 100%
• Methanol 42%
• Energy Barrier 42%
• Manganese 28%
• Methane 28%
• Adatoms 28%
• Density Functional Theory 14%
• Reaction Activation Energy 14%
• formation 14%
• Air Pollution 14%

Chemical Engineering

• Methanol 100%
• Hydrogenation 100%
• Graphene 100%
• Catalyst Surface 33%
• Endothermic Reaction 33%
• Reaction Conversion 33%