The regulatory function of the d-orbital structure in TM@g-t-C<sub>4</sub>N<sub>3</sub> for bifunctional catalysis of the oxygen evolution/reduction reaction-Reference-Cited by-同舟云学术

The regulatory function of the d-orbital structure in TM@g-t-C₄N₃ for bifunctional catalysis of the oxygen evolution/reduction reaction

Published:2024 Issue:1 Volume:26 Page:558-568
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Wang Zhenduo¹,Wu Meichen¹,Huang Yuhong¹^ORCID,Zhang Jianmin¹,Wei Xiumei¹^ORCID

Affiliation:

1. School of Physics and Information Technology, Shaanxi Normal University, Xi’an, 710119, China

Abstract

A series of bifunctional OER/ORR SACs supported on g-t-C4N3 is proposed. It is found from DFT calculations that the d-orbital structure can regulate the catalytic activity of g-t-C4N3-based SACs.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D3CP04249A

Reference64 articles.

1. Photocatalytic water splitting: advantages and challenges

2. Highly Efficient Photo-/Electrocatalytic Reduction of Nitrogen into Ammonia by Dual-Metal Sites

3. Role of heteroatom-doping in enhancing catalytic activities and the stability of single-atom catalysts for oxygen reduction and oxygen evolution reactions

4. Photocatalytic Reduction of Carbon Dioxide to Methane at the Pd-Supported TiO₂ Interface: Mechanistic Insights from Theoretical Studies

5. Enabling multifunctional electrocatalysts by modifying the basal plane of unifunctional 1T′-MoS2 with anchored transition metal single atoms

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