Electronic spectra of ytterbium fluoride from relativistic electronic structure calculations-Reference-Cited by-同舟云学术

Electronic spectra of ytterbium fluoride from relativistic electronic structure calculations

Published:2021 Issue:39 Volume:23 Page:22330-22343
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Pototschnig Johann V.¹²^ORCID,Dyall Kenneth G.³^ORCID,Visscher Lucas²^ORCID,Gomes André Severo Pereira⁴^ORCID

Affiliation:

1. Institut für Experimentalphysik, Technische Universität Graz, Petersgasse 16, 8010 Graz, Austria

2. Department of Chemistry and Pharmaceutical Sciences, Faculty of Sciences, Vrije Universiteit Amsterdam, De Boelelaan 1083, NL-1081 HV Amsterdam, The Netherlands

3. Dirac Solutions, 10527 NW Lost Park Drive, Portland, OR 97229, USA

4. Université de Lille, CNRS, UMR 8523 - PhLAM - Physique des Lasers, Atomes et Molécules, F-59000 Lille, France

Abstract

Potential energy curves for the YbF obtained by relativistic electronic structure methods are presented. Due to the difficulties of describing this system separate computations for open and closed f-shells were necessary.

Funder

Agence Nationale de la Recherche

Austrian Science Fund

Deutsche Forschungsgemeinschaft

European Regional Development Fund

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP03701C

Reference81 articles.