Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems

As an emerging technology for CO2 utilization, electrochemical CO2 reduction reaction (ECO2RR) systems incorporating gas diffusion electrodes (GDE) have the potential to transform CO2 to valuable products efficiently and environment-friendly. In this work, a two-dimensional multiphase model capturin...

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Main Authors: Yang, Z, Li, D, Xing, L, Xiang, H, Xuan, J, Cheng, S, Yu, EH, Yang, A
Format: Journal article
Language:English
Published: American Chemical Society 2020
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author Yang, Z
Li, D
Xing, L
Xiang, H
Xuan, J
Cheng, S
Yu, EH
Yang, A
author_facet Yang, Z
Li, D
Xing, L
Xiang, H
Xuan, J
Cheng, S
Yu, EH
Yang, A
author_sort Yang, Z
collection OXFORD
description As an emerging technology for CO2 utilization, electrochemical CO2 reduction reaction (ECO2RR) systems incorporating gas diffusion electrodes (GDE) have the potential to transform CO2 to valuable products efficiently and environment-friendly. In this work, a two-dimensional multiphase model capturing the details of the catalyst layer in a GDE that produces formate with byproducts is established and quantitatively validated against experimental data. This model is capable of describing the mixture gas and aqueous species transportation, electron conduction processes, and a series of interrelated chemical and electrochemical reactions. Specific electrical energy consumption (SEEC) and product yield (PY) have been introduced and used to examine the GDE scalability and evaluate the system performance. The results predict the optimal values for applied cathode potential and catalyst loading and porosity. The effect of inlet gas composition and velocity is also evaluated. Moreover, this study predicts that the GDE is scalable as it retains a stable performance as its geometrical surface area varies. This model together with the simulation findings contributes to the improved understanding of GDE-based CO2 conversion as needed for the future development toward successful industrial applications.
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spelling oxford-uuid:dc5858b3-7c82-409d-90ba-10e01fb70f1c2022-03-27T09:17:17ZModeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systemsJournal articlehttp://purl.org/coar/resource_type/c_dcae04bcuuid:dc5858b3-7c82-409d-90ba-10e01fb70f1cEnglishSymplectic ElementsAmerican Chemical Society2020Yang, ZLi, DXing, LXiang, HXuan, JCheng, SYu, EHYang, AAs an emerging technology for CO2 utilization, electrochemical CO2 reduction reaction (ECO2RR) systems incorporating gas diffusion electrodes (GDE) have the potential to transform CO2 to valuable products efficiently and environment-friendly. In this work, a two-dimensional multiphase model capturing the details of the catalyst layer in a GDE that produces formate with byproducts is established and quantitatively validated against experimental data. This model is capable of describing the mixture gas and aqueous species transportation, electron conduction processes, and a series of interrelated chemical and electrochemical reactions. Specific electrical energy consumption (SEEC) and product yield (PY) have been introduced and used to examine the GDE scalability and evaluate the system performance. The results predict the optimal values for applied cathode potential and catalyst loading and porosity. The effect of inlet gas composition and velocity is also evaluated. Moreover, this study predicts that the GDE is scalable as it retains a stable performance as its geometrical surface area varies. This model together with the simulation findings contributes to the improved understanding of GDE-based CO2 conversion as needed for the future development toward successful industrial applications.
spellingShingle Yang, Z
Li, D
Xing, L
Xiang, H
Xuan, J
Cheng, S
Yu, EH
Yang, A
Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title_full Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title_fullStr Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title_full_unstemmed Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title_short Modeling and upscaling analysis of gas diffusion electrode-based electrochemical carbon dioxide reduction systems
title_sort modeling and upscaling analysis of gas diffusion electrode based electrochemical carbon dioxide reduction systems
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