Microkinetic Modeling to Decode Catalytic Reactions and Empower Catalytic Design
Shekhar R. Kulkarni,
Gontzal Lezcano,
Vijay Kumar Velisoju
et al.
Abstract:Kinetic model development is integral for designing, redesigning, monitoring, and optimizing chemical processes. Of the various approaches used within this field, microkinetic modeling is a crucial tool that focuses on surface events to analyze overall and preferential reaction pathways. This work covers noticeable features of microkinetic modeling for three critical case studies: (i) ammonia to hydrogen, (ii) oxidative coupling of methane to chemicals, and (iii) carbon dioxide hydrogenation for methanol synth… Show more
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