Structural, electronic and catalytic properties of AgnSnn (n = 2–14) clusters by density functional theory-Reference-Cited by-同舟云学术

Structural, electronic and catalytic properties of Ag_nSn_n (n = 2–14) clusters by density functional theory

Published:2022 Issue:43 Volume:24 Page:26631-26641
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Yang Shu¹²^ORCID,Li Wei¹²³,Li YiFu¹²,Chen XiuMin¹²,Zhang Huan¹²,Xu Baoqaing¹²,Yang Bin¹²

Affiliation:

1. Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming, 650093, P. R. China

2. National Engineering Laboratory for Vacuum Metallurgy, Kunming University of Science and Technology, Kunming, 650093, P. R. China

3. Sino-Platinum Metals Co., Ltd., Kunming, 650101, P. R. China

Abstract

Density functional theory (DFT) calculations revealed that the catalytic performance of silver clusters for the oxidation of carbon monoxide can be improved by adding an equal amount of tin atoms to small-molecule silver clusters.

Funder

State Key Laboratory of Advanced Technologies for Comprehensive Utilization of Platinum Metals

Ten Thousand Talent Plans for Young Top-notch Talents of Yunnan Province

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2022/CP/D2CP01981G

Reference54 articles.

1. Clusters: A bridge between disciplines

2. Catalytic performance of Pt3Ni cluster toward ethane activation

3. Coordinatively unsaturated aluminum anchored Ru cluster for catalytic hydrogenation of benzene

4. Understanding the electronic metal-support interactions of the supported Ni cluster for the catalytic hydrogenation of ethylene

5. Boron nanocluster as a heavy metal adsorbent in aqueous environment: A DFT Study

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