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Photoinduced Defect and Surface Chemistry of Niobium Tellurium Oxides ANbTeO6 (A = K, Rb, Cs) with Defect-Pyrochlore
Morten Weiss1, Benedikt Wirth1, Roland Marschall1
1Department of Chemistry, University of Bayreuth, Universitaetsstrasse 30, 95440 Bayreuth, Germany.
Inorganic Chemistry
|May 29, 2020
Summary
Niobium tellurium oxides with varying cations exhibit visible light absorption due to defects, not a low band gap. These defects and surface composition change during photocatalytic hydrogen generation.
Area of Science:
- Materials Science
- Solid State Chemistry
- Photocatalysis
Background:
- Niobium tellurium oxides (ANbTeO6) with a defect-pyrochlore structure are explored for their properties.
- The influence of varying A-site cations (K, Rb, Cs) on crystal structure and defects is investigated.
Purpose of the Study:
- To understand how A-site cation variation affects crystal structure deformation and defect chemistry in ANbTeO6.
- To elucidate the origin of visible light absorption in these materials.
- To examine changes in defects and surface composition during photocatalytic hydrogen evolution.
Main Methods:
- Synthesis of ANbTeO6 compounds with A = K, Rb, Cs.
- Characterization of crystal structure and defect chemistry.
- Investigation of light absorption properties.
- Evaluation of photocatalytic activity for hydrogen generation.
Main Results:
- Visible light absorption is attributed to defects, not an intrinsic low band gap.
- Significant changes in prevailing defects and surface composition occur during photocatalytic hydrogen evolution.
- The A-site cation influences crystal-structure deformation and defect chemistry.
Conclusions:
- Defect engineering is crucial for tuning the optoelectronic properties of ANbTeO6.
- The materials show promise for photocatalytic applications, with dynamic changes during operation.
- Understanding defect-structure-property relationships is key for optimizing photocatalytic performance.

