MATLAB model of multiscale model for CO2 electrolysis

DOI:10.4121/7fe30cea-7854-4b0f-9e62-fd9a012df8eb.v1
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DOI: 10.4121/7fe30cea-7854-4b0f-9e62-fd9a012df8eb

Datacite citation style

van Ommen, J.Ruud ; Van Steijn, V.; Cammann, Lucas; Pérez-Fortes, Mar; Bagemihl, Isabell (2024): MATLAB model of multiscale model for CO2 electrolysis. Version 1. 4TU.ResearchData. software. https://doi.org/10.4121/7fe30cea-7854-4b0f-9e62-fd9a012df8eb.v1
Other citation styles (APA, Harvard, MLA, Vancouver, Chicago, IEEE) available at Datacite

Software

This Matlab script is a multi-scale modelling framework (ranging from the single channel scale over the electrolyser scale to the process scale) embedded in a techno-economic analysis for a CO2 electrolyser as described in the manuscript "Techno-economic assessment of CO2 electrolysis: How interdependencies propagate across scales" and the Chapter 4 of the PhD dissertation of Bagemihl. This framework allows to optimise the electrolyser performance under economic considerations and is the first of its kind which does not consider the electrolyser as blackbox. Instead mass transfer effects along the channel length are taken into account via the multi-scale model. This code is for the exemplary case of CO2 to ethylene conversion with the only side product being hydrogene. The code can be adapted for other catalysts and reactants by changing the kinetics in the single channel scale model.

History

  • 2024-05-29 first online, published, posted

Publisher

4TU.ResearchData

Funding

  • Electron to Chemical Bonds consortium (grant code P17-08) [more info...] NWO

Organizations

TU Delft, Faculty of Applied Sciences, Department of Chemical Engineering

DATA

Files (33)