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Updated: Apr 26, 2026

Tuning Oxide Properties by Oxygen Vacancy Control During Growth and Annealing
Published on: June 9, 2023
Chemical activity of oxygen vacancies on ceria: a combined experimental and theoretical study on CeO2(111)
Chengwu Yang1, Li-Li Yin, Fabian Bebensee
1Institut für Funktionelle Grenzflächen, Karlsruher Institut für Technologie, 76021 Karlsruhe, Germany. christof.woell@kit.edu.
Abstract:
The chemical activity of oxygen vacancies on well-defined, single-crystal CeO2(111)-surfaces is investigated using CO as a probe molecule. Since no previous measurements are available, the assignment of the CO ν1 stretch frequency as determined by IR-spectroscopy for the stoichiometric and defective surfaces are aided by ab initio electronic structure calculations using density functional theory (DFT).
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