Data underlying the research on CO2 electrocatalysis on Ag surfaces

dataset

posted on 2020-08-14, 06:43 authored by Evgeny PidkoEvgeny Pidko, Guanna Li, Divya BohraDivya 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

Funding

NWO VIDI (WAS)

NWO SURFsara grant (DB)

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Publisher

4TU.ResearchData

Organizations

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

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Keywords

CO2 reduction electrocatalysis GPAW package silver catalyst Density Function Theory Theoretical and Computational Chemistry Renewable Energy

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