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Title: Communication: Projected Hartree Fock theory as a polynomial similarity transformation theory of single excitations

Journal Article · · The Journal of Chemical Physics
DOI:https://doi.org/10.1063/1.4963082· OSTI ID:1328461
ORCiD logo [1]; ORCiD logo [2];  [2]
  1. Department of Chemistry, Rice University, Houston, Texas 77005-1892, USA
  2. Department of Chemistry, Rice University, Houston, Texas 77005-1892, USA, Department of Physics and Astronomy, Rice University, Houston, Texas 77005-1892, USA
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Sponsoring Organization:
USDOE
Grant/Contract Number:
FG02-09ER16053
OSTI ID:
1328461
Journal Information:
The Journal of Chemical Physics, Journal Name: The Journal of Chemical Physics Vol. 145 Journal Issue: 11; ISSN 0021-9606
Publisher:
American Institute of PhysicsCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 27 works
Citation information provided by
Web of Science

References (19)

On the use of general symmetry-projected Hartree–Fock–Bogoliubov configurations in variational approaches to the nuclear many-body problem journal April 2004
Polynomial similarity transformation theory: A smooth interpolation between coupled cluster doubles and projected BCS applied to the reduced BCS Hamiltonian journal March 2016
Symmetry broken and restored coupled-cluster theory: I. Rotational symmetry and angular momentum journal December 2014
A comparison of different DODS methods when the number of electrons increases : DODS METHODS WITH INCREASING ELECTRON-NUMBER journal November 1976
The Usefulness of Exponential Wave Function Expansions Employing One- and Two-Body Cluster Operators in Electronic Structure Theory: The Extended and Generalized Coupled-Cluster Methods journal December 2006
Projected Hartree–Fock theory journal April 2012
Variational principles and linked-cluster exp S expansions for static and dynamic many-body problems journal December 1983
Symmetry-projected variational approach for ground and excited states of the two-dimensional Hubbard model journal June 2012
Quantum Theory of Many-Particle Systems. III. Extension of the Hartree-Fock Scheme to Include Degenerate Systems and Correlation Effects journal March 1955
Bound states of a many-particle system journal June 1958
The spin-unrestricted and the spin-projected HF methods: a comparison based on the stability properties of the closed-shell RHF solutions for large cyclic polyenes journal January 1986
Projected quasiparticle theory for molecular electronic structure journal September 2011
Electron correlations in narrow energy bands journal November 1963
Approximate account of connected quadruply excited clusters in single-reference coupled-cluster theory via cluster analysis of the projected unrestricted Hartree-Fock wave function journal August 1996
On the Correlation Problem in Atomic and Molecular Systems. Calculation of Wavefunction Components in Ursell‐Type Expansion Using Quantum‐Field Theoretical Methods journal December 1966
A Critical Assessment of Coupled Cluster Method in Quantum Chemistry book January 1999
Coupled-cluster theory in quantum chemistry journal February 2007
Coupled-cluster approaches with an approximate account of triexcitations and the optimized-inner-projection technique. II. Coupled-cluster results for cyclic-polyene model systems journal August 1990
The method of moments of coupled-cluster equations and the renormalized CCSD[T], CCSD(T), CCSD(TQ), and CCSDT(Q) approaches journal July 2000

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