Benchmark coupled-cluster g-tensor calculations with full inclusion of the two-particle spin-orbit contributions-Reference-Cited by-同舟云学术

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Benchmark coupled-cluster g-tensor calculations with full inclusion of the two-particle spin-orbit contributions

Published:2017-04-28 Issue:16 Volume:146 Page:164104
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Perera Ajith¹²,Gauss Jürgen³^ORCID,Verma Prakash¹^ORCID,Morales Jorge A.¹

Affiliation:

1. Department of Chemistry and Biochemistry, Texas Tech University, P.O. Box 41061, Lubbock, Texas 79409-1061, USA

2. Department of Chemistry, Quantum Theory Project, University of Florida, Gainesville, Florida 32611, USA

3. Institut für Physikalische Chemie, Universität Mainz, D-55099 Mainz, Germany

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4979680

Reference106 articles.

1. On the Origin of Spin‐Hamiltonian Parameters

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