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◆ ACS Catalysis2026-02-04· Antibonding molecular orbital

Interfacial Pt-Ov-In <sup>2+</sup> Lewis Pairs Enable Highly Selective Photocatalytic CO <sub>2</sub> Methanation

Sichun Yang, Haijiao Lu, Rijia Lin, Zhiliang Wang, Penghui Yan, Guangyu Zhao, Jiakang You, Julian A. Steele, Kai Wang, Y. Zhang, Yalong Zou, Mr Yonggang Jin, L. Wang

原始摘要(英文原文)· Original abstract
Photocatalytic CO 2 reduction requires catalysts to simultaneously coordinate two distinct half reactions: CO 2 activation and H 2 O dissociation. However, most current materials lack electronically asymmetric sites capable of simultaneously driving both reactions efficiently. Herein, platinum (Pt) is introduced onto oxygen-vacancy (Ov)-rich InOOH to construct a novel interfacial Pt-Ov-In 2+ Lewis pair via dynamic electron regulation, where Pt nanoparticles anchor oxygen vacancy and partially reduce adjacent In 3+ to In 2+, generating a charge-polarized region. Pt simultaneously modulates the Ov population via a reversible electronic interaction, maintaining an optimal balance of Pt 0 and the Ov-In 2+ sites. Mechanistically, Pt functions as a Lewis-acid H 2 O activation site, accelerating O–H splitting, while Ov-In 2+ serves as a Lewis-base center for CO 2 adsorption and bending, stabilizing *CO 2 – and *CHO intermediates through strengthened In 5s/CO 2 antibonding orbital interactions. As a result, Pt/InOOH-Ov delivers a CH 4 formation rate of 227.2 μmol g –1 h –1 with 99.0% selectivity, nearly 3 orders of magnitude higher than vacancy-rich InOOH. This work highlights Lewis-pair engineering across vacancy-rich oxide interfaces as a powerful strategy for multielectron CO 2 conversion.
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Interfacial Pt-Ov-In <sup>2+</sup> Lewis Pairs Enable Highly Selective Photocatalytic CO <sub>2</sub> Methanation — 科研速览 Science Skim