Is the doped MoS<sub>2</sub> basal plane an efficient hydrogen evolution catalyst? Calculations of voltage-dependent activation energy-Reference-Cited by-同舟云学术

Is the doped MoS₂ basal plane an efficient hydrogen evolution catalyst? Calculations of voltage-dependent activation energy

Published:2023 Issue:22 Volume:25 Page:15162-15172
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Hanslin Sander Ø.¹²^ORCID,Jónsson Hannes²³^ORCID,Akola Jaakko¹⁴^ORCID

Affiliation:

1. Department of Physics, Norwegian University of Science and Technology, NO-7491 Trondheim, Norway

2. Faculty of Physical Sciences and Science Institute, University of Iceland, IS-107 Reykjavk, Iceland

3. Applied Physics Department, Aalto University, FI-00076 Aalto, Finland

4. Computational Physics Laboratory, Tampere University, FI-33101 Tampere, Finland

Abstract

The thermodynamics of the MoS2 basal plane can be tuned to be favorable for HER by transition metal doping. However, the calculated activation energy is too high and the experimentally measured activity is unlikely to originate from the basal plane.

Funder

Academy of Finland

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP00516J

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