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A DFT+U description of oxygen vacancies at the TiO2 rutile (110) surface

Surface Science · 2007 · Vol. 601(21) · pp. 5034–5041
Benjamin J. MorganGraeme W. Watson
Catalytic Processes in Materials ScienceElectronic and Structural Properties of OxidesZnO doping and propertiesDensity functional theoryRutileCharge densityElectronic structureVacancy defectElectronChemistryCharge (physics)Materials scienceAtomic physics

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  • Science Foundation Ireland
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Reduced and n-Type Doped TiO<sub>2</sub>: Nature of Ti<sup>3+</sup> Species
The Journal of Physical Chemistry C · 2009 · 705 citations
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