The DIRAC code for relativistic molecular calculations

Author:

Saue Trond1ORCID,Bast Radovan2ORCID,Gomes André Severo Pereira3ORCID,Jensen Hans Jørgen Aa.4ORCID,Visscher Lucas5ORCID,Aucar Ignacio Agustín6ORCID,Di Remigio Roberto7ORCID,Dyall Kenneth G.8ORCID,Eliav Ephraim9ORCID,Fasshauer Elke10ORCID,Fleig Timo1ORCID,Halbert Loïc3ORCID,Hedegård Erik Donovan11ORCID,Helmich-Paris Benjamin12ORCID,Iliaš Miroslav13ORCID,Jacob Christoph R.14ORCID,Knecht Stefan15ORCID,Laerdahl Jon K.16ORCID,Vidal Marta L.17ORCID,Nayak Malaya K.18ORCID,Olejniczak Małgorzata19ORCID,Olsen Jógvan Magnus Haugaard7ORCID,Pernpointner Markus20ORCID,Senjean Bruno521ORCID,Shee Avijit22ORCID,Sunaga Ayaki23ORCID,van Stralen Joost N. P.5ORCID

Affiliation:

1. Laboratoire de Chimie et Physique Quantique, UMR 5626 CNRS—Université Toulouse III-Paul Sabatier, 118 Route de Narbonne, F-31062 Toulouse, France

2. Department of Information Technology, UiT The Arctic University of Norway, N-9037 Tromsø, Norway

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

4. Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, DK-5230 Odense M, Denmark

5. Department of Chemistry and Pharmaceutical Sciences, Vrije Universiteit Amsterdam, NL-1081HV Amsterdam, The Netherlands

6. Instituto de Modelado e Innovación Tecnológica, CONICET, and Departamento de Física—Facultad de Ciencias Exactas y Naturales, UNNE, Avda. Libertad 5460, W3404AAS Corrientes, Argentina

7. Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry, UiT The Arctic University of Norway, N-9037 Tromsø, Norway

8. Dirac Solutions, 10527 NW Lost Park Drive, Portland, Oregon 97229, USA

9. School of Chemistry, Tel Aviv University, Ramat Aviv, Tel Aviv 69978, Israel

10. Department of Physics and Astronomy, Aarhus University, Ny Munkegade 120, 8000 Aarhus, Denmark

11. Division of Theoretical Chemistry, Lund University, Chemical Centre, P.O. Box 124, SE-221 00 Lund, Sweden

12. Max-Planck-Institut für Kohlenforschung, Kaiser-Wilhelm-Platz 1, 45470 Mülheim an der Ruhr, Germany

13. Department of Chemistry, Faculty of Natural Sciences, Matej Bel University, Tajovského 40, 974 01 Banská Bystrica, Slovakia

14. Technische Universität Braunschweig, Institute of Physical and Theoretical Chemistry, Gaußstr. 17, 38106 Braunschweig, Germany

15. ETH Zürich, Laboratorium für Physikalische Chemie, Vladimir-Prelog-Weg 2, 8093 Zürich, Switzerland

16. Department of Microbiology, Oslo University Hospital, Oslo, Norway

17. Department of Chemistry, Technical University of Denmark, 2800 Kgs. Lyngby, Denmark

18. Theoretical Chemistry Section, Bhabha Atomic Research Centre, Trombay, Mumbai 400085, India

19. Centre of New Technologies, University of Warsaw, S. Banacha 2c, 02-097 Warsaw, Poland

20. Kybeidos GmbH, Heinrich-Fuchs-Str. 94, 69126 Heidelberg, Germany

21. Instituut-Lorentz, Universiteit Leiden, P.O. Box 9506, 2300 RA Leiden, The Netherlands

22. Department of Chemistry, University of Michigan, Ann Arbor, Michigan 48109, USA

23. Department of Chemistry, Tokyo Metropolitan University, 1-1 Minami-Osawa, Hachioji-city, Tokyo 192-0397, Japan

Funder

I-SITE ULNE

Region Hauts de France Council

Slovak Scientific Grant Agency

Research Council of Norway

Japan Society for the Promotion of Science

Nederlandse Organisatie voor Wetenschappelijk Onderzoek

Agence Nationale de la Recherche

Polish National Science Center

Villum Fonden

Fondo para la Investigación Científica y Tecnológica

Consejo Nacional de Investigaciones Científicas y Técnicas

Slovak Research and Development Agency

Horizon 2020 Framework Program

European Regional Development Fund

French Ministry of Higher Education and Research

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

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