DFT data for „Effect of Water on Diffusion Energy Barriers of S

10.57892/100-333Wendorff, FalkFalkWendorff0009-0009-8204-9900Buttenschön, SönkeSönkeButtenschön0009-0005-2751-5156Pehlke, EckhardEckhardPehlkeDFT data for „Effect of Water on Diffusion Energy Barriers of S_ad on Cu(100) and Ag(100) Surfaces“Kiel University2026530Kiel University2026-01-16enresearch_datahttps://opendata.uni-kiel.de/receive/fdr_mods_00000333fdr_mods_00000333https://opendata.uni-kiel.de/receive/fdr_mods_00000333?XSL.Transformer=modsODC-By 1.0 - Attribution LicenseThe archives contain density functional theory (DFT) data for the publication „Falk Wendorff, Chalong Yang, Sönke Buttenschön, Mitja Funk, Olaf M. Magnussen and Eckhard Pehlke, Effect of Water on Diffusion Energy Barriers of Sad on Cu(100) and Ag(100) Surfaces“ (DOI: https://doi.org/10.1021/acselectrochem.5c00414).