Elucidation of temperature-programmed desorption of high-coverage hydrogen on Pt(211), Pt(221), Pt(533) and Pt(553) based on density functional theory calculations-Reference-Cited by-同舟云学术

Elucidation of temperature-programmed desorption of high-coverage hydrogen on Pt(211), Pt(221), Pt(533) and Pt(553) based on density functional theory calculations

Published:2019 Issue:31 Volume:21 Page:17142-17151
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Kolb Manuel J.¹²³⁴^ORCID,Garden Anna L.⁵⁶⁷⁸⁹^ORCID,Badan Cansin¹²³⁴,Garrido Torres José A.¹⁰¹¹¹²¹³¹⁴^ORCID,Skúlason Egill⁵⁶⁷⁸⁹^ORCID,Juurlink Ludo B. F.¹²³⁴^ORCID,Jónsson Hannes⁵⁶⁷⁸⁹^ORCID,Koper Marc T. M.¹²³⁴^ORCID

Affiliation:

1. Leiden Institute of Chemistry

2. Leiden University

3. 2300 RA Leiden

4. The Netherlands

5. Faculty of Industrial Engineering

6. Mechanical Engineering and Computer Science

7. University of Iceland

8. 107 Reykjavík

9. Iceland

10. Stanford University

11. Department of Chemical Engineering

12. Stanford

13. USA

14. SUNCAT Center for Interface Science and Catalysis

Abstract

In this work, we compute high-coverage hydrogen adsorption structures on the Pt(211) and Pt(533) surfaces which contain a (100) step and the Pt(221) and Pt(553) surfaces which contain a (111) step and link these to their respective TPD spectra.

Funder

Basic Energy Sciences

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP02330E

Reference35 articles.

1. Ethylene Hydrogenation on Pt(111) Monitored in Situ at High Pressures Using Sum Frequency Generation

2. Interfacial processes involving electrocatalytic evolution and oxidation of H2, and the role of chemisorbed H