The doi above is for this specific version of this dataset, which is currently the latest. Newer versions may be published in the future. For a link that will always point to the latest version, please use
doi: 10.4121/12789893

Pidko, Evgeny; Guanna Li; Divya Bohra; Wilson Smith (2020): Data underlying the research on CO2 electrocatalysis on Ag surfaces. Version 1. 4TU.ResearchData. dataset. https://doi.org/10.4121/12789893.v1

Dataset

• Theoretical and Computational Chemistry
• Renewable Energy

CO2 reduction, Density Function Theory, electrocatalysis, GPAW package, silver catalyst

CC BY-NC 4.0

RefWorks, BibTeX, Reference Manager, Endnote, DataCite, NLM, DC, CFF

by Evgeny Pidko , Guanna Li , Divya Bohra , Wilson Smith

The data set has been generated using the open source GPAW package to study the energetics of CO2 reduction on Ag single crystal surfaces.

The results have been published in the open access article: https://onlinelibrary.wiley.com/doi/full/10.1002/anie.201811667

• 2020-08-14 first online, published, posted

4TU.ResearchData

• https://doi.org/10.1002/anie.201811667

• NWO VIDI (WAS)
• NWO SURFsara grant (DB)

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