Ab initioinvestigation of quantum size effects on the adsorption of CO2, CO, H2O, and H2on transition-metal particles-Reference-Cited by-同舟云学术

Ab initioinvestigation of quantum size effects on the adsorption of CO2, CO, H2O, and H2on transition-metal particles

Published:2020 Issue:16 Volume:22 Page:8998-9008
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Mendes Paulo C. D.¹²³⁴^ORCID,Ocampo-Restrepo Vivianne K.¹²³⁴^ORCID,Da Silva Juarez L. F.¹²³⁴^ORCID

Affiliation:

1. São Carlos Institute of Chemistry

2. University of São Paulo

3. São Paulo

4. Brazil

Abstract

Adsorption is a crucial preliminary step for the conversion of CO₂, then the atomistic understanding of how substrate particle size affects this step could be a key factor to control the catalytic transformations of CO₂into higher-value products.

Funder

Fundação de Amparo à Pesquisa do Estado de São Paulo

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP00880J

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