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Coupling Microkinetics with Continuum Transport Models to Understand Electrochemical <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline" overflow="scroll"> <mml:msub> <mml:mi>CO</mml:mi> <mml:mn>2</mml:mn> </mml:msub> </mml:math> Reduction in Flow Reactors

Nitish Govindarajan, Tiras Y. Lin, Thomas Roy, Christopher Hahn, Joel B. Varley

2023PRX Energy15 citationsDOIOpen Access PDF

Abstract

Using \textit{ab initio} microkinetic simulations coupled with a two-dimensional continuum transport model, this study models electrochemical CO${}_{2}$ reduction in a flow reactor with spatial resolution of key reaction parameters.

Topics & Concepts

Coupling (piping)PhysicsEngineeringMechanical engineeringCO2 Reduction Techniques and CatalystsIonic liquids properties and applicationsElectrocatalysts for Energy Conversion
Coupling Microkinetics with Continuum Transport Models to Understand Electrochemical <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline" overflow="scroll"> <mml:msub> <mml:mi>CO</mml:mi> <mml:mn>2</mml:mn> </mml:msub> </mml:math> Reduction in Flow Reactors | Litcius