Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction

Abstract Developing stable and efficient electrocatalysts is vital for boosting oxygen evolution reaction (OER) rates in sustainable hydrogen production. High-entropy oxides (HEOs) consist of five or more metal cations, providing opportunities to tune their catalytic properties toward high OER effic...
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Autor*in:	Jihyun Baek [verfasserIn] Md Delowar Hossain [verfasserIn] Pinaki Mukherjee [verfasserIn] Junghwa Lee [verfasserIn] Kirsten T. Winther [verfasserIn] Juyoung Leem [verfasserIn] Yue Jiang [verfasserIn] William C. Chueh [verfasserIn] Michal Bajdich [verfasserIn] Xiaolin Zheng [verfasserIn]

Format:	E-Artikel
Sprache:	Englisch

Erschienen:	2023

Übergeordnetes Werk:	In: Nature Communications - Nature Portfolio, 2016, 14(2023), 1, Seite 11
Übergeordnetes Werk:	volume:14 ; year:2023 ; number:1 ; pages:11

Links:	Link aufrufen Link aufrufen Link aufrufen Journal toc

DOI / URN:	10.1038/s41467-023-41359-7

Katalog-ID:	DOAJ091754658

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author	Jihyun Baek
spellingShingle	Jihyun Baek misc Science misc Q Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
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title	Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
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title_full	Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
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title_sort	synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
title_auth	Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
abstract	Abstract Developing stable and efficient electrocatalysts is vital for boosting oxygen evolution reaction (OER) rates in sustainable hydrogen production. High-entropy oxides (HEOs) consist of five or more metal cations, providing opportunities to tune their catalytic properties toward high OER efficiency. This work combines theoretical and experimental studies to scrutinize the OER activity and stability for spinel-type HEOs. Density functional theory confirms that randomly mixed metal sites show thermodynamic stability, with intermediate adsorption energies displaying wider distributions due to mixing-induced equatorial strain in active metal-oxygen bonds. The rapid sol-flame method is employed to synthesize HEO, comprising five 3d-transition metal cations, which exhibits superior OER activity and durability under alkaline conditions, outperforming lower-entropy oxides, even with partial surface oxidations. The study highlights that the enhanced activity of HEO is primarily attributed to the mixing of multiple elements, leading to strain effects near the active site, as well as surface composition and coverage.
abstractGer	Abstract Developing stable and efficient electrocatalysts is vital for boosting oxygen evolution reaction (OER) rates in sustainable hydrogen production. High-entropy oxides (HEOs) consist of five or more metal cations, providing opportunities to tune their catalytic properties toward high OER efficiency. This work combines theoretical and experimental studies to scrutinize the OER activity and stability for spinel-type HEOs. Density functional theory confirms that randomly mixed metal sites show thermodynamic stability, with intermediate adsorption energies displaying wider distributions due to mixing-induced equatorial strain in active metal-oxygen bonds. The rapid sol-flame method is employed to synthesize HEO, comprising five 3d-transition metal cations, which exhibits superior OER activity and durability under alkaline conditions, outperforming lower-entropy oxides, even with partial surface oxidations. The study highlights that the enhanced activity of HEO is primarily attributed to the mixing of multiple elements, leading to strain effects near the active site, as well as surface composition and coverage.
abstract_unstemmed	Abstract Developing stable and efficient electrocatalysts is vital for boosting oxygen evolution reaction (OER) rates in sustainable hydrogen production. High-entropy oxides (HEOs) consist of five or more metal cations, providing opportunities to tune their catalytic properties toward high OER efficiency. This work combines theoretical and experimental studies to scrutinize the OER activity and stability for spinel-type HEOs. Density functional theory confirms that randomly mixed metal sites show thermodynamic stability, with intermediate adsorption energies displaying wider distributions due to mixing-induced equatorial strain in active metal-oxygen bonds. The rapid sol-flame method is employed to synthesize HEO, comprising five 3d-transition metal cations, which exhibits superior OER activity and durability under alkaline conditions, outperforming lower-entropy oxides, even with partial surface oxidations. The study highlights that the enhanced activity of HEO is primarily attributed to the mixing of multiple elements, leading to strain effects near the active site, as well as surface composition and coverage.
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title_short	Synergistic effects of mixing and strain in high entropy spinel oxides for oxygen evolution reaction
url	https://doi.org/10.1038/s41467-023-41359-7 https://doaj.org/article/35aed22dfe824249a0966e3040b8a610 https://doaj.org/toc/2041-1723
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