Reinvestigating oxygen adsorption on Ag(111) by using strongly constrained and appropriately normed semi-local density functional with the revised Vydrov van Voorhis van der Waals force correction-Reference-Cited by-同舟云学术

Reinvestigating oxygen adsorption on Ag(111) by using strongly constrained and appropriately normed semi-local density functional with the revised Vydrov van Voorhis van der Waals force correction

Published:2021-12-21 Issue:23 Volume:155 Page:234704
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Hinsch Jack J.¹^ORCID,Liu Junxian¹^ORCID,Wang Yun¹^ORCID

Affiliation:

1. School of Environment and Science, Centre for Catalysis and Clean Energy, Griffith University, Gold Coast QLD 4222, Australia

Funder

National Computational Infrastructure

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

https://aip.scitation.org/doi/pdf/10.1063/5.0073407

Reference71 articles.

1. Computational predictions of energy materials using density functional theory

2. Combining theory and experiment in electrocatalysis: Insights into materials design

3. Towards the computational design of solid catalysts

4. Iron Vacancies Induced Bifunctionality in Ultrathin Feroxyhyte Nanosheets for Overall Water Splitting

5. Preparation of 1T′-Phase ReS2xSe2(1-x) (x = 0–1) Nanodots for Highly Efficient Electrocatalytic Hydrogen Evolution Reaction

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