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20062022
most citedSIESTA: recent developments and applications

544 citations · 1.1k across the 15 of their papers we have counts for

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Showing 2009 · cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2009★ 61 cited

Tuning surface metallicity and ferromagnetism by hydrogen adsorption at the polar ZnO(0001) surface

N. Sanchez, S. Gallego, J. Cerdá +1

The adsorption of hydrogen on the polar Zn-ended ZnO(0001) surface has been investigated by density functional {\it ab-initio} calculations. An on top H(1x1) ordered overlayer with…