most citedTuning the workfunction of ZnO through surface doping with Mn from first-principles simulations

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cond-mat.mtrl-sci2022★ 13 cited

Tuning the workfunction of ZnO through surface doping with Mn from first-principles simulations

Andreas Douloumis, Nikolaos R. E. Vrithias, Nikos Katsarakis +2

Surface doping of ZnO allows for tailoring the surface chemistry of the material while preserving the superb electronic structure of the bulk. Apart from obvious changes in adsorpt…