How accurate are EOM-CC4 vertical excitation energies?-Reference-Cited by-同舟云学术

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How accurate are EOM-CC4 vertical excitation energies?

Published:2021-06-14 Issue:22 Volume:154 Page:221103
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Loos Pierre-François¹^ORCID,Matthews Devin A.²^ORCID,Lipparini Filippo³^ORCID,Jacquemin Denis⁴^ORCID

Affiliation:

1. Laboratoire de Chimie et Physique Quantiques (UMR 5626), Université de Toulouse, CNRS, UPS, Toulouse, France

2. Department of Chemistry, Southern Methodist University, Dallas, Texas 75275, USA

3. Dipartimento di Chimica e Chimica Industriale, University of Pisa, Via Moruzzi 3, 56124 Pisa, Italy

4. Université de Nantes, CNRS, CEISAM UMR 6230, F-44000 Nantes, France

Funder

H2020 European Research Council

National Science Foundation

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

https://aip.scitation.org/doi/am-pdf/10.1063/5.0055994

Reference84 articles.

1. On the Correlation Problem in Atomic and Molecular Systems. Calculation of Wavefunction Components in Ursell‐Type Expansion Using Quantum‐Field Theoretical Methods

2. Correlation Problems in Atomic and Molecular Systems. IV. Extended Coupled-Pair Many-Electron Theory and Its Application to the BH3Molecule

3. T. D. Crawford and H. F. Schaefer, Reviews in Computational Chemistry (John Wiley & Sons, Ltd., 2000), pp. 33–136.

4. Coupled-cluster theory in quantum chemistry

5. Many – Body Methods in Chemistry and Physics

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