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A new formula is presented for the calculation of matrix elements between multi-quasiparticle Hartree-Fock-Bogoliubov (HFB) states. The formula is expressed in terms of the Pfaffian, and is derived by using the Fermion coherent states with…

Nuclear Theory · Physics 2015-06-04 Takahiro Mizusaki , Makito Oi

The method of choice for describing attractive quantum systems is Hartree-Fock-Bogoliubov (HFB) theory. This is a nonlinear model which allows for the description of pairing effects, the main explanation for the superconductivity of certain…

Numerical Analysis · Mathematics 2013-11-08 Mathieu Lewin , Séverine Paul

We present an overview of the Hartree-Fock-Bogoliubov (HFB) theory of nucleonic superfluidity for finite nuclei. After introducing basic concepts related to pairing correlations, we show how the correlated pairs are incorporated into the…

Nuclear Theory · Physics 2017-08-23 J. Dobaczewski , W. Nazarewicz

It is usually asserted that physical Hamiltonians for fermions must contain an even number of fermion operators. This is indeed true in electronic structure theory. However, when the Jordan-Wigner transformation is used to map physical spin…

Strongly Correlated Electrons · Physics 2024-01-10 Thomas M. Henderson , Shadan Ghassemi Tabrizi , Guo P. Chen , Gustavo E. Scuseria

Overlap between Hartree-Fock-Bogoliubov(HFB) vacua is very important in the beyond mean-field calculations. However, in the HFB transformation, the $U,V$ matrices are sometimes singular due to the exact emptiness ($v_i=0$) or full…

Nuclear Theory · Physics 2015-06-16 Zao-Chun Gao , Qing-Li Hu , Y. S. Chen

The Hartree-Fock-Bogoliubov approximation is very useful for treating both long- and short-range correlations in finite quantum fermion systems, but it must be extended in order to describe detailed spectroscopic properties. One problem is…

Nuclear Theory · Physics 2017-08-23 L. M. Robledo , G. F. Bertsch

We present the first set of results of solving the Hartree-Fock-Bogoliubov equations, which describe the self-consistent mean field theory with pairing interaction. Calculations for even-even nuclei are carried out on a two-dimensional…

Nuclear Theory · Physics 2007-05-23 E. Teran , V. E. Oberacker , A. S. Umar

We show that the lowest-energy solution of the Hartree-Fock-Bogoliubov (HFB) equation has the even particle-number parity as long as the time-reversal symmetry is conserved in the HFB Hamiltonian without null eigenvalues. Based on this…

Nuclear Theory · Physics 2021-05-11 Haruki Kasuya , Kenichi Yoshida

Nuclei far from stability are studied by solving the Hartree-Fock-Bogoliubov (HFB) equations, which describe the self-consistent mean field theory with pairing interaction. Calculations for even-even nuclei are carried out on…

Nuclear Theory · Physics 2009-11-07 E. Teran , V. E. Oberacker , A. S. Umar

In this letter we present a new expression for the overlaps of wavefunctions in Hartree-Fock-Bogoliubov based theories. Starting from the Pfaffian formula by Bertsch et al (Phys. Rev. Lett. 108,042505 (2012)), an exact and computationally…

Nuclear Theory · Physics 2021-05-05 B. G. Carlsson , J. Rotureau

We derive and implement symmetry-projected Hartree-Fock-Bogoliubov (HFB) equations and apply them to the molecular electronic structure problem. All symmetries (particle number, spin, spatial, and complex conjugation) are deliberately…

Strongly Correlated Electrons · Physics 2012-02-15 Gustavo E. Scuseria , Carlos A. Jimenez-Hoyos , Thomas M. Henderson , Kousik Samanta , Jason K. Ellis

A formula to calculate a norm overlap between Hartree-Fock-Bogoliubov (HFB) states with the odd number parity (one quasi-particle excited states) is derived with help of the Grassmann numbers and the Fermion coherent states. The final form…

Nuclear Theory · Physics 2012-01-05 Makito Oi , Takahiro Mizusaki

We derive a formalism, the separation method, for the efficient and accurate calculation of two-body matrix elements for a Gaussian potential in the cylindrical harmonic-oscillator basis. This formalism is of critical importance for…

Nuclear Theory · Physics 2010-11-02 W. Younes

We propose a new method to solve the Hartree-Fock-Bogoliubov equations for weakly bound nuclei, which works for both spherical and axially deformed cases. In this approach, the quasiparticle wave functions are expanded in a complete set of…

Nuclear Theory · Physics 2008-11-26 M. Stoitsov , N. Michel , K. Matsuyanagi

We develop a systematic method for computing a renormalized light-front field theory Hamiltonian that can lead to bound states that rapidly converge in an expansion in free-particle Fock-space sectors. To accomplish this without dropping…

High Energy Physics - Theory · Physics 2009-10-31 Brent H. Allen , Robert J. Perry

The current work plans to study the accuracy due to FD approximation to the 3D nuclear HFB problem. By (1) taking the wave functions solved in harmonic oscillator (HO) basis, (2) representing the HFB problem in coordinate space using FD…

Nuclear Theory · Physics 2018-08-08 Yue Shi

We introduce the Hamiltonian dynamics with the Hartree-Fock energy in new {\it wave-matrix} picture. Roughly speaking, the wave matrix is defined as the square root of the density matrix. The corresponding Hamiltonian equations are…

Mathematical Physics · Physics 2015-06-05 Alexander Komech

Matrix elements between nonorthogonal Slater determinants represent an essential component of many emerging electronic structure methods. However, evaluating nonorthogonal matrix elements is conceptually and computationally harder then…

Chemical Physics · Physics 2024-06-19 Hugh G. A. Burton

We present new formulae for the matrix elements of one-body and two-body physical operators in compact forms, which are applicable to arbitrary Hartree-Fock-Bogoliubov wave functions, including those for multi-quasiparticle excitations. The…

Nuclear Theory · Physics 2015-06-16 Qing-Li Hu , Zao-Chun Gao , Y. S. Chen

We describe the new version (v2.38j) of the code HFODD which solves the nuclear Skyrme-Hartree-Fock or Skyrme-Hartree-Fock-Bogolyubov problem by using the Cartesian deformed harmonic-oscillator basis. In the new version, we have…

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