CO, NO, and SO adsorption on Ni nanoclusters: a DFT investigation-Reference-Cited by-同舟云学术

CO, NO, and SO adsorption on Ni nanoclusters: a DFT investigation

Published:2020 Issue:19 Volume:49 Page:6407-6417
ISSN:1477-9226
Container-title:Dalton Transactions
language:en
Short-container-title:Dalton Trans.

Author:

de Amorim Rairisson V.¹²³⁴⁵,Batista Krys E. A.¹²³⁴⁵,Nagurniak Glaucio R.⁶⁷⁸⁵^ORCID,Orenha Renato P.⁹¹⁰¹¹⁵^ORCID,Parreira Renato L. T.⁹¹⁰¹¹⁵^ORCID,Piotrowski Maurício J.¹²³⁴⁵^ORCID

Affiliation:

1. Department of Physics

2. Federal University of Pelotas

3. PO Box 354

4. Pelotas

5. Brazil

6. Department of Exact Sciences and Education

7. Federal University of Santa Catarina

8. Blumenau

9. Núcleo de Pesquisas em Ciências Exatas e Tecnológicas

10. Universidade de Franca

11. Franca

Abstract

From our ab initio investigation, we have improved the understanding of the interaction between Nickel nanoclusters and diatomic molecules, such as CO, NO, and SO, to provide insights into real subnano catalysts.

Funder

Fundação de Amparo à Pesquisa do Estado do Rio Grande do Sul

Fundação de Amparo à Pesquisa do Estado de São Paulo

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2020/DT/D0DT00288G

Reference79 articles.