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[표지논문] Mechanistic insights into the phase transition and metal ex-solution phenomena of Pr0.5Ba0.5Mn0.85Co0.15O3−δ from simple to layered perovskite under reducing conditions and enhanced catalytic a…

Title of paper
[표지논문] Mechanistic insights into the phase transition and metal ex-solution phenomena of Pr0.5Ba0.5Mn0.85Co0.15O3−δ from simple to layered perovskite under reducing conditions and enhanced catalytic activity
Author
[한정우교수 연구실] 상전이 동반 엑솔루션을 통핸 촉매활성 향상
Publication in journal
Energy & Environmental Science 14 (2021), p873-882.
Publication date
20210201

[Abstract]
We use density functional theory calculations and in situ X-ray diffraction spectroscopy experiments on Co-doped Pr0.5Ba0.5MnO3−δ (PBMCO) to understand how the phase transition from PBMCO to layered PBMCO occurred. The role of Co dopants for both the phase transition and the ex-solution is also elucidated. It turns out that the selective formation of oxygen vacancies at the Pr layer plays a key role in the phase transition to layered perovskite. The ex-solved Co nanoparticles showed higher catalytic activity than the doped one for CO oxidation. These results can guide the design of highly-active perovskite-based redox catalysts.

 

DOI: doi.org/10.1039/D0EE02875D

Link: https://pubs.rsc.org/en/content/articlelanding/2020/ee/d0ee02875d