Transferability of the SRP32-vdW specific reaction parameter functional to CHD


Journal

The Journal of chemical physics
ISSN: 1089-7690
Titre abrégé: J Chem Phys
Pays: United States
ID NLM: 0375360

Informations de publication

Date de publication:
28 Mar 2019
Historique:
entrez: 1 4 2019
pubmed: 1 4 2019
medline: 1 4 2019
Statut: ppublish

Résumé

Stepped transition metal surfaces, including the reconstructed Pt(110)-(2 × 1) surface, can be used to model the effect of line defects on catalysts. We present a combined experimental and theoretical study of CHD

Identifiants

pubmed: 30927879
doi: 10.1063/1.5081005
doi:

Types de publication

Journal Article

Langues

eng

Pagination

124702

Auteurs

Helen Chadwick (H)

Leiden Institute of Chemistry, Gorlaeus Laboratories, Leiden University, P.O. Box 9502, 2300 RA Leiden, The Netherlands.

Ana Gutiérrez-González (A)

Laboratoire de Chimie Physique Moléculaire, Ecole Polytechnique Fédérale de Lausanne, CH-1015 Lausanne, Switzerland.

Rainer D Beck (RD)

Laboratoire de Chimie Physique Moléculaire, Ecole Polytechnique Fédérale de Lausanne, CH-1015 Lausanne, Switzerland.

Geert-Jan Kroes (GJ)

Leiden Institute of Chemistry, Gorlaeus Laboratories, Leiden University, P.O. Box 9502, 2300 RA Leiden, The Netherlands.

Classifications MeSH