A comparative study of hydrogen evolution reaction on pseudo-monolayer WS2 and PtS2: insights based on the density functional theory-Reference-Cited by-同舟云学术

A comparative study of hydrogen evolution reaction on pseudo-monolayer WS2 and PtS2: insights based on the density functional theory

Published:2017 Issue:3 Volume:7 Page:687-692
ISSN:2044-4753
Container-title:Catalysis Science & Technology
language:en
Short-container-title:Catal. Sci. Technol.

Author:

Mir Showkat H.¹²³⁴,Chakraborty Sudip⁵⁶⁷⁸,Wärnå John⁵⁶⁷⁸,Narayan Som⁹¹⁰¹¹¹²⁴,Jha Prakash C.¹³²³⁴^ORCID,Jha Prafulla K.⁹¹⁰¹¹¹²⁴,Ahuja Rajeev⁵⁶⁷⁸¹⁴

Affiliation:

1. School of Nano Sciences

2. Central University of Gujarat

3. Gandhinagar-382030

4. India

5. Department of Physics and Astronomy

6. Uppsala University

7. Uppsala 75120

8. Sweden

9. Department of Physics

10. Faculty of Science

11. The Maharaja Sayajirao University of Baroda

12. Vadodara-390 002

13. Centre for Applied Chemistry

14. Applied Materials Physics

Abstract

In this study, we investigated the catalytic activity of ultrathin PtS₂ and WS₂ nanostructures for the hydrogen evolution reaction by electronic structure calculations based on the spin-polarised density functional theory.

Publisher

Royal Society of Chemistry (RSC)

Subject

Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CY/C6CY02426B

Reference52 articles.

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4. Rationalizing the Hydrogen and Oxygen Evolution Reaction Activity of Two-Dimensional Hydrogenated Silicene and Germanene

5. Assessing capability of semiconductors to split water using ionization potentials and electron affinities only

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