Coupled-cluster method in Fock space. II. Brueckner-Hartree-Fock method

Leszek Z. Stolarczyk and Hendrik J. Monkhorst
Phys. Rev. A 32, 743 – Published 1 August 1985
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Abstract

The generalized coupled-cluster (CC) method of the preceding paper is cast into the form of the Brueckner-Hartree-Fock (BHF) method. In this approach the model vacuum Φ is optimized to become the maximum-overlap configuration for the reference eigenfunction Ψ. One of the approximation schemes of the preceding paper is applied to derive explicit algebraic equations which can be used for practical calculations of (approximate) energies of several states of a many-fermion system. These include the N-particle ground-state energy, energies of some (N-1)- and (N+1)-particle states, as well as energies of certain N-particle excited states. It is indicated that the numerical effort required in the present approach is comparable to that of the coupled-cluster singles and doubles (CCSD) method of Purvis and Bartlett [J. Chem. Phys. 76, 1910 (1982)].

  • Received 30 January 1985

DOI:https://doi.org/10.1103/PhysRevA.32.743

©1985 American Physical Society

Authors & Affiliations

Leszek Z. Stolarczyk and Hendrik J. Monkhorst

  • Quantum Theory Project, Department of Physics, University of Florida, Gainesville, Florida 32611

See Also

Coupled-cluster method in Fock space. I. General formalism

Leszek Z. Stolarczyk and Hendrik J. Monkhorst
Phys. Rev. A 32, 725 (1985)

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Vol. 32, Iss. 2 — August 1985

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