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Related papers: Linear response calculation using the canonical-ba…

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We consider the electrons of a molecule in the adiabatic time-dependent density functional theory approximation. We establish the well-posedness of the time evolution and its linear response close to a non-degenerate ground state, and prove…

Analysis of PDEs · Mathematics 2024-09-19 Mi-Song Dupuy , Eloïse Letournel , Antoine Levitt

We solve the Hartree-Fock-Bogoliubov (HFB) equations for deformed, axially symmetric even-even nuclei in coordinate space on a 2-D lattice utilizing the Basis-Spline expansion method. Results are presented for the neutron-rich zirconium…

Nuclear Theory · Physics 2009-11-11 A. Blazkiewicz , V. E. Oberacker , A. S. Umar , M. Stoitsov

We have calculated the frequency-dependent exact exchange (EXX) kernel of time-dependent (TD) density functional theory employing our recently proposed computational method based on cubic splines. With this kernel we have calculated the…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Maria Hellgren , Ulf von Barth

Linear response calculations based on the time-dependent density-functional theory are presented. Especially, we report results of the finite amplitude method which we have recently proposed as an alternative and feasible approach to the…

Numerical simulation on nuclear collisions are performed using the canonical-basis time-dependent Hartree-Fock-Bogoliubov theory (Cb-TDHFB) in the three-dimensional coordinate space. Comparing results of the Cb-TDHFB and the conventional…

Nuclear Theory · Physics 2014-08-12 Shuichiro Ebata , Takashi Nakatsukasa

In this manuscript we provide an outline of the numerical methods used in implementing the density constrained time-dependent Hartree-Fock (DC-TDHF) method and provide a few examples of its application to nuclear fusion. In this approach,…

Nuclear Theory · Physics 2015-02-16 V. E. Oberacker , A. S. Umar

We formulate a continuum linear response theory on the basis of the Hartree-Fock-Bogoliubov formalism in the coordinate space representation in order to describe low-lying and high-lying collective excitations which couple to one-particle…

Nuclear Theory · Physics 2009-11-07 M. Matsuo

While superfluidity is accurately grasped with a state that explicitly breaks the particle number symmetry, a precise description of phenomena like the particle transfer during heavy-ion reactions can only be achieved by considering systems…

Nuclear Theory · Physics 2019-06-26 D. Regnier , D. Lacroix

The density-constrained time-dependent Hartree-Fock (DC-TDHF) theory is a fully microscopic approach for calculating heavy-ion interaction potentials and fusion cross sections below and above the fusion barrier. We discuss recent…

Nuclear Theory · Physics 2017-08-23 A. S. Umar , V. E. Oberacker , J. A. Maruhn , R. Keser

A new method of calculating pairing correlations in coordinate space with finite range interactions is presented. In the Hartree-Fock-Bogoliubov (HFB) approach the mean field part is derived from a Skyrme-type force whereas the pairing…

Nuclear Theory · Physics 2009-11-07 M. Grasso , N. Van Giai , N. Sandulescu

Background: The time-dependent Hartree-Fock (TDHF) theory has been successful in describing low-energy heavy ion collisions. Recently, we have shown that multinucleon transfer processes can be reasonably described in the TDHF theory…

Nuclear Theory · Physics 2014-12-24 Kazuyuki Sekizawa , Kazuhiro Yabana

Classical mechanics and Time Dependent Hartree-Fock (TDHF) calculations of heavy ions collisions are performed to study the rotation of a deformed nucleus in the Coulomb field of its partner. This reorientation is shown to be independent on…

Nuclear Theory · Physics 2009-11-10 Cedric Simenel , Philippe Chomaz , Gilles De France

We propose a framework to learn the time-dependent Hartree-Fock (TDHF) inter-electronic potential of a molecule from its electron density dynamics. Though the entire TDHF Hamiltonian, including the inter-electronic potential, can be…

Chemical Physics · Physics 2024-12-05 Harish S. Bhat , Prachi Gupta , Christine M. Isborn

An improved prescription for choosing a transformed harmonic oscillator (THO) basis for use in configuration-space Hartree-Fock-Bogoliubov (HFB) calculations is presented. The new HFB+THO framework that follows accurately reproduces the…

Nuclear Theory · Physics 2011-05-12 M. V. Stoitsov , J. Dobaczewski , W. Nazarewicz , S. Pittel , D. J. Dean

The transfer reaction between two nuclei in the superfluid phase is studied with the Time-dependent Hartree-Fock-Bogoliubov (TDHFB) theory. In order to restore the symmetry of the relative gauge angle a set of independent TDHFB evolutions…

Nuclear Theory · Physics 2017-10-25 Guillaume Scamps , Yukio Hashimoto

Ground-state properties of spherical even-even nuclei $14\leq Z \leq 28$ and $N=18,20,22$ are described in the framework of Relativistic Hartree Bogoliubov (RHB) theory. The model uses the NL3 effective interaction in the mean-field…

Nuclear Theory · Physics 2008-11-26 D. Vretenar , G. A. Lalazissis , P. Ring

We simulate a heavy-ion collision using the canonical-basis time-dependent Hartree-Fock-Bogoliubov theory (Cb-TDHFB) treating pairing correlation in the three-dimensional coordinate space. We apply the Cb-TDHFB to 22O+22O collision with a…

Nuclear Theory · Physics 2013-10-01 Shuichiro Ebata , Takashi Nakatsukasa

The two-basis method to solve the HFB for deformed nuclei in coordinate space is examined concerning the precision of the density tail. Small cutoff energies are shown to give rise to ripples in the tail, whose wave length corresponds to…

Nuclear Theory · Physics 2007-05-23 Naoki Tajima

We investigate the performance of the range-separated hybrid (RSH) scheme, which combines long-range Hartree-Fock (HF) and a short-range density-functional approximation (DFA), for calculating photoexcitation/photoionization spectra of the…

Chemical Physics · Physics 2019-07-24 Felipe Zapata , Eleonora Luppi , Julien Toulouse

We introduce a natural and simple to implement renormalization scheme of the Hartree-Fock-Bogoliubov (HFB) equations for the case of zero range pairing interaction. This renormalization scheme proves to be equivalent to a simple energy…

Nuclear Theory · Physics 2007-05-23 Aurel Bulgac , Yongle Yu