Sensitivity Analysis of One-Dimensional Multiphysics Simulation of CO2 Electrolysis Cell Article Swipe
Harry Dunne
,
Weiming Liu
,
Mohammad Reza Ghaani
,
Kim McKelvey
,
Stephen Dooley
·
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.1021/acs.jpcc.4c00690
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.1021/acs.jpcc.4c00690
Electrochemical (EC) carbon dioxide (CO2) reduction, where CO2 is converted to value-added products such as fuel precursors, plays a key role in helping the world's energy system reach net-zero carbon emissions. Simulations of EC cells provide valuable insight into their operation since detailed experimental results on short length and time scales are difficult to obtain. In this work, we construct a 1D simulation of a membrane-electrode-assembly EC cell for CO2 reduction, using a porous silver gas diffusion cathode. We run the simulation under different electrolyte conditions, showing how the cell performance is affected. We then perform a sensitivity analysis of all input parameters to the simulation, which has not been presented before in the literature. We show that the CO partial current density (i CO) is significantly affected by each input parameter of the simulation. i CO is most sensitive to EC kinetic parameters (i 0/α) of all EC reactions, with a 1% change in α resulting in up to 6% change in i CO. Since there is uncertainty associated with the value of each input parameter, this indicates that infidelity between experiment and simulation is likely, and thus, caution should be practiced when comparing experimental results to simulation results. Further, we show that the large range of conditions simulated in literature helps to explain the large variance in reported values of i 0 and α. The results of this paper demonstrate the potential of sensitivity analysis methods to quickly optimize aspects of cell performance (CO2 utilization, Faradaic efficiency, etc.).
Related Topics
Concepts
Multiphysics
Sensitivity (control systems)
Electrolyte
Diffusion
Electrolysis
Work (physics)
Faraday efficiency
Computer science
Range (aeronautics)
Cathode
Biological system
Modeling and simulation
Electrochemistry
Damköhler numbers
Process engineering
Materials science
Simulation
Mechanics
Electrode
Chemistry
Thermodynamics
Physics
Finite element method
Electronic engineering
Engineering
Biology
Physical chemistry
Composite material
Turbulence
Metadata
- Type
- article
- Language
- en
- Landing Page
- https://doi.org/10.1021/acs.jpcc.4c00690
- https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.4c00690
- OA Status
- hybrid
- Cited By
- 3
- References
- 41
- Related Works
- 10
- OpenAlex ID
- https://openalex.org/W4400068186
All OpenAlex metadata
Raw OpenAlex JSON
- OpenAlex ID
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https://openalex.org/W4400068186Canonical identifier for this work in OpenAlex
- DOI
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https://doi.org/10.1021/acs.jpcc.4c00690Digital Object Identifier
- Title
-
Sensitivity Analysis of One-Dimensional Multiphysics Simulation of CO2 Electrolysis CellWork title
- Type
-
articleOpenAlex work type
- Language
-
enPrimary language
- Publication year
-
2024Year of publication
- Publication date
-
2024-06-27Full publication date if available
- Authors
-
Harry Dunne, Weiming Liu, Mohammad Reza Ghaani, Kim McKelvey, Stephen DooleyList of authors in order
- Landing page
-
https://doi.org/10.1021/acs.jpcc.4c00690Publisher landing page
- PDF URL
-
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.4c00690Direct link to full text PDF
- Open access
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YesWhether a free full text is available
- OA status
-
hybridOpen access status per OpenAlex
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https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.4c00690Direct OA link when available
- Concepts
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Multiphysics, Sensitivity (control systems), Electrolyte, Diffusion, Electrolysis, Work (physics), Faraday efficiency, Computer science, Range (aeronautics), Cathode, Biological system, Modeling and simulation, Electrochemistry, Damköhler numbers, Process engineering, Materials science, Simulation, Mechanics, Electrode, Chemistry, Thermodynamics, Physics, Finite element method, Electronic engineering, Engineering, Biology, Physical chemistry, Composite material, TurbulenceTop concepts (fields/topics) attached by OpenAlex
- Cited by
-
3Total citation count in OpenAlex
- Citations by year (recent)
-
2025: 2, 2024: 1Per-year citation counts (last 5 years)
- References (count)
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41Number of works referenced by this work
- Related works (count)
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10Other works algorithmically related by OpenAlex
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