Seniority-based coupled cluster theory

Henderson, Thomas M.; Bulik, Ireneusz W.; Stein, Tamar; Scuseria, Gustavo E.

doi:10.1063/1.4904384

Title: Seniority-based coupled cluster theory

Journal Article · Sun Dec 28 00:00:00 EST 2014 · Journal of Chemical Physics

DOI:https://doi.org/10.1063/1.4904384· OSTI ID:1387351

Henderson, Thomas M.; Bulik, Ireneusz W.; Stein, Tamar; Scuseria, Gustavo E.

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Research Organization:: Energy Frontier Research Centers (EFRC) (United States). Center for the Computational Design of Functional Layered Materials (CCDM)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

DOE Contract Number:: SC0012575

OSTI ID:: 1387351

Journal Information:: Journal of Chemical Physics, Vol. 141, Issue 24; Related Information: CCDM partners with Temple University (lead); Brookhaven National Laboratory; Drexel University; Duke University; North Carolina State University; Northeastern University; Princeton University; Rice University; University of Pennsylvania; ISSN 0021-9606

Publisher:: American Institute of Physics (AIP)

Country of Publication:: United States

Language:: English

References (30)

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The optimization of molecular orbitals for coupled cluster wavefunctions Scuseria, Gustavo E.; Schaefer, Henry F. Chemical Physics Letters, Vol. 142, Issue 5 https://doi.org/10.1016/0009-2614(87)85122-9	journal	December 1987
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Seniority zero pair coupled cluster doubles theory Stein, Tamar; Henderson, Thomas M.; Scuseria, Gustavo E. The Journal of Chemical Physics, Vol. 140, Issue 21 https://doi.org/10.1063/1.4880819	journal	June 2014
The closed‐shell coupled cluster single and double excitation (CCSD) model for the description of electron correlation. A comparison with configuration interaction (CISD) results Scuseria, Gustavo E.; Scheiner, Andrew C.; Lee, Timothy J. The Journal of Chemical Physics, Vol. 86, Issue 5 https://doi.org/10.1063/1.452039	journal	March 1987
Particle-particle and quasiparticle random phase approximations: Connections to coupled cluster theory Scuseria, Gustavo E.; Henderson, Thomas M.; Bulik, Ireneusz W. The Journal of Chemical Physics, Vol. 139, Issue 10 https://doi.org/10.1063/1.4820557	journal	September 2013
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