Ga and Zn increase the oxygen affinity of Cu-based catalysts for the COx hydrogenation according to ab initio atomistic thermodynamics-Reference-Cited by-同舟云学术

Ga and Zn increase the oxygen affinity of Cu-based catalysts for the CO_x hydrogenation according to ab initio atomistic thermodynamics

Published:2022 Issue:45 Volume:13 Page:13442-13458
ISSN:2041-6520
Container-title:Chemical Science
language:en
Short-container-title:Chem. Sci.

Author:

Müller Andreas¹^ORCID,Comas-Vives Aleix²³^ORCID,Copéret Christophe¹^ORCID

Affiliation:

1. Department of Chemistry and Applied Biosciences, ETH Zürich, 8093 Zurich, Switzerland

2. Institute of Materials Chemistry, TU Wien, 1060 Vienna, Austria

3. Departament de Química, Universitat Autònoma de Barcelona, 08193 Cerdanyola del Vallès, Catalonia, Spain

Abstract

In this article, we show that the surface state of Cu-based COx-hydrogenation catalysts with reducible promoters depends on the composition of the active atmosphere, and the surface becomes highly dynamic only for CO2-containing feeds.

Funder

Ministerio de Ciencia, Innovación y Universidades

Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung

European Social Fund

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2022/SC/D2SC03107H

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