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- W4384207913 abstract "The performance of photocatalysts is affected not only by the surface structure but also by the atomic arrangement of the subsurface. Guided by first-principle simulation, Pt(Pd) single atoms are introduced into hexagonal ZnIn2S4 to substitute the middle In site, and dual S vacancies in the vicinity of the dopant are subsequently created. This unique subsurface dopant-vacancy pair brings a new defect level and higher hole concentration, resulting in enhanced charge separation efficiency and superior electronic conductivity. More importantly, it could also modulate the p-band center of neighboring surface S atoms, thus optimizing the balance between H adsorption and desorption. As a consequence, the subsurface-engineered ZnIn2S4 delivers an H2 evolution rate of 165.4 μmol h−1 under visible-light irradiation, and a great number of H2 bubbles are released under natural solar light. This work provides a new perspective on the development of solar-to-H2 conversion through artful subsurface engineering." @default.
- W4384207913 created "2023-07-14" @default.
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- W4384207913 date "2023-08-01" @default.
- W4384207913 modified "2023-10-14" @default.
- W4384207913 title "Activating surface sulfur atoms via subsurface engineering toward boosted photocatalytic water splitting" @default.
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- W4384207913 doi "https://doi.org/10.1016/j.checat.2023.100695" @default.
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