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Related papers: The reduced Hartree-Fock model for short-range qua…

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In this article, we study the speed of convergence of the supercell reduced Hartree-Fock~(rHF) model towards the whole space rHF model in the case where the crystal contains a local defect. We prove that, when the defect is charged, the…

Mathematical Physics · Physics 2017-01-04 David Gontier , Salma Lahbabi

Background: Idealised systems are commonly used in nuclear physics and condensed matter. For instance, the construction of nuclear energy density functionals involves properties of infinite matter, while neutron drops are used to test…

Nuclear Theory · Physics 2021-01-08 A. W. Bray , C. Simenel

Starting with a bare nucleon-nucleon interaction, for the first time the full relativistic Brueckner-Hartree-Fock equations are solved for finite nuclei in a Dirac-Woods-Saxon basis. No free parameters are introduced to calculate the…

Nuclear Theory · Physics 2016-10-05 Shihang Shen , Jinniu Hu , Haozhao Liang , Jie Meng , Peter Ring , Shuangquan Zhang

Adjustment of the behavior of the potential energy of nuclear deformation, defined as the sum of the energies of lowest-lying occupied single-particle levels in a deformed finite potential with a pairing correction, is considered by taking…

Nuclear Theory · Physics 2021-07-20 G. I. Bykhalo , V. N. Orlin , K. A. Stopani

Coupled cluster theory is the method of choice for weakly correlated systems. But in the strongly correlated regime, it faces a symmetry dilemma, where it either completely fails to describe the system, or has to artificially break certain…

Chemical Physics · Physics 2020-05-14 Yiheng Qiu , Thomas M. Henderson , Jinmo Zhao , Gustavo E. Scuseria

A Hartree--Fock analysis of the ground-state electronic structure of the finite spherical jellium model is carried out for systems containing up to $520$ electrons in a positive background field with densities ranging from $10^{-3}$ to $1$.…

Materials Science · Physics 2025-12-09 Michael Píro , Jaroslav Hamrle

The Hartree-Fock exchange potential is fundamental for capturing quantum mechanical exchange effects but faces critical challenges in large-scale applications due to its nonlocal and computationally intensive nature. This study introduces a…

Chemical Physics · Physics 2025-09-03 Fei Xu

For a system of spinless fermions in a disordered mesoscopic ring, interactions can give rise to an enhancement of the persistent current by orders of magnitude. The increase in the current is associated with a charge reorganization of the…

Strongly Correlated Electrons · Physics 2009-10-31 A. Kambili , C. J. Lambert , J. H. Jefferson

We employ correlated realistic nucleon-nucleon interactions for the description of nuclear ground states throughout the nuclear chart within the Hartree-Fock approximation. The crucial short-range central and tensor correlations, which are…

Nuclear Theory · Physics 2007-05-23 R. Roth , P. Papakonstantinou , N. Paar , H. Hergert , T. Neff , H. Feldmeier

We study the Hartree model for two electrons with spin, living in the two-dimensional or three-dimensional space with Coulomb interactions and submitted to the potential induced by two nuclei of charge +1. In the limit where the nuclei move…

Mathematical Physics · Physics 2022-06-22 Jean Cazalis

When using Hartree-Fock (HF) trial wave functions in quantum Monte Carlo calculations, one faces, in case of HF instabilities, the HF symmetry dilemma in choosing between the symmetry-adapted solution of higher HF energy and symmetry-broken…

Chemical Physics · Physics 2011-07-19 Peter Reinhardt , Julien Toulouse , Roland Assaraf , C. J. Umrigar , Philip E. Hoggan

Noncollinear magnetic states in clusters are studied by using the single-band Hubbard Hamiltonian. The unrestricted Hartree-Fock (UHF) approximation is considered without imposing any symmetry constraints neither to the size or orientation…

Strongly Correlated Electrons · Physics 2009-10-31 Miguel A. Ojeda , J. Dorantes-Davila , G. M. Pastor

Using the fractional moment method it is shown that, within the Hartree-Fock approximation for the Disordered Hubbard Hamiltonian, weakly interacting Fermions at positive temperature exhibit localization, suitably defined as exponential…

Mathematical Physics · Physics 2021-06-14 Rodrigo Matos , Jeffrey Schenker

The quasi-particle energy spectrum of the Hartree-Fock-Bogoliubov (HFB) equations contains discrete bound states, resonances, and non-resonant continuum states. We study the structure of the unbound quasi-particle spectrum of weakly bound…

Nuclear Theory · Physics 2015-05-28 J. C. Pei , A. T. Kruppa , W. Nazarewicz

We apply Projected Hartree-Fock theory (PHF) for approximating ground states of Heisenberg spin clusters. Spin-rotational, point-group and complex-conjugation symmetry are variationally restored from a broken-symmetry mean-field reference,…

Strongly Correlated Electrons · Physics 2022-02-09 Shadan Ghassemi Tabrizi , Carlos A. Jiménez-Hoyos

In this work a periodic crystal with point defects is described in the framework of linear response theory for broken symmetry states using correlation functions and Zwanzig-Mori equations. The main results are microscopic expressions for…

Soft Condensed Matter · Physics 2015-05-18 Christof Walz , Matthias Fuchs

Wigner molecules formed at high magnetic fields in circular and elliptic quantum dots are studied by exact diagonalization (ED) and unrestricted Hartree-Fock (UHF) methods with multicenter basis of displaced lowest Landau level wave…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 B. Szafran , F. M. Peeters , S. Bednarek , J. Adamowski

We present a new approach for calculating the nuclear equation of state and compressibility for finite nuclei using the density-constrained Hartree-Fock method.

Nuclear Theory · Physics 2008-11-26 A. S. Umar , V. E. Oberacker

We formulate a new Hartree-Fock-Bogoliubov method applicable to weakly bound deformed nuclei using the coordinate-space Green's function technique. An emphasis is put on treatment of quasiparticle states in the continuum, on which we impose…

Nuclear Theory · Physics 2009-12-17 Hiroshi Oba , Masayuki Matsuo

We benchmark angular-momentum projected{-after-variation} Hartree-Fock calculations as an approximation to full configuration-interaction results in a shell model basis. For such a simple approximation we find reasonably good agreement…

Nuclear Theory · Physics 2021-11-12 Stephanie M. Lauber , Hayden C. Frye , Calvin W. Johnson