A Coverage Self-Consistent Microkinetic Model for Vapor-Phase Formic Acid Decomposition over Pd/C Catalysts

Keyphrases

• Density Functional Theory 100%
• Formic Acid Decomposition 100%
• Vapor Phase 100%
• PDCs 100%
• Microkinetic Model 100%
• Active Sites 80%
• Pd(111) 80%
• Pd(100) 60%
• Formic Acid 40%
• Dehydration 40%
• CO Coverage 40%
• Reaction Conditions 40%
• Carboxyl 20%
• Reaction Mechanism 20%
• Clean Surface 20%
• Kinetic Experiments 20%
• Mean Field 20%
• High Coverage 20%
• Reaction Kinetics 20%
• Experimental Dataset 20%
• Parametrized 20%
• Decomposition Pathway 20%
• Dehydrogenation 20%
• Rate Parameters 20%
• Adsorbed CO 20%
• MPW1PW91 20%
• (100) Facets 20%
• Catalytic Active Sites 20%
• Iterative Approach 20%
• Parameter Adjustment 20%

Chemical Engineering

• Formic Acid 100%
• Dehydrogenation 50%

Engineering

• Adjustment Parameter 20%