Accuracy of Coupled Cluster Excited State Potential Energy Surfaces-Reference-Cited by-同舟云学术

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Accuracy of Coupled Cluster Excited State Potential Energy Surfaces

Published:2018-10-09 Issue:11 Volume:14 Page:5859-5869
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Tajti Attila¹^ORCID,Stanton John F.²^ORCID,Matthews Devin A.³,Szalay Péter G.¹^ORCID

Affiliation:

1. Institute of Chemistry, Eötvös Loránd University, H-1117, Budapest, Hungary

2. Quantum Theory Project, Department of Chemistry and Physics, University of Florida, Gainesville, Florida 32611, United States

3. Institute for Computational Engineering and Sciences, The University of Texas at Austin, Austin, Texas 78712, United States

Funder

Division of Chemistry

Magyar Tudom?nyos Akad?mia

Orsz?gos Tudom?nyos Kutat?si Alapprogramok

Arnold and Mabel Beckman Foundation

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.8b00681

Reference43 articles.

1. A linear response, coupled-cluster theory for excitation energy

2. The equation of motion coupled‐cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties

3. The equation-of-motion coupled-cluster method. Applications to open- and closed-shell reference states

4. Calculation of properties with the coupled-cluster method

5. Coupled cluster response functions

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