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Related papers: Time-dependent HF approach to SHE dynamics

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Performing electronic structure calculations for large systems, such as nanoparticles or metal clusters, via orbital based Hartree-Fock or Kohn-Sham theories is computationaly demanding. To study such systems, therefore, we have taken…

Condensed Matter · Physics 2007-05-23 Arup Banerjee , Manoj K. Harbola

The crucial step in density-corrected Hartree-Fock density functional theory (DC(HF)-DFT) is to decide whether the density produced by the density functional for a specific calculation is erroneous and hence should be replaced by, in this…

Chemical Physics · Physics 2023-09-20 Daniel Graf , Alex J. W. Thom

The time-dependent restricted-active-space self-consistent-field (TD-RASSCF) method is formulated based on the TD variational principle. In analogy with the configuration-interaction singles (CIS), singles-and-doubles (CISD),…

Quantum Physics · Physics 2014-06-26 Haruhide Miyagi , Lars Bojer Madsen

We employ a microscopic approach that examines the impact of isospin dynamics on the process of low energy nuclear fusion along an isotope chain and dependence on deformation. Our method utilizes the density constrained time-dependent…

Nuclear Theory · Physics 2023-10-13 Richard Gumbel , Christian Ross , A. S. Umar

Theoretical description of nuclear fission remains one of the major challenges of quantum many-body dynamics. The slow, mostly adiabatic motion through the fission barrier is followed by a fast, non-adiabatic descent of the potential…

Nuclear Theory · Physics 2015-01-16 Guillaume Scamps , Cédric Simenel , Denis Lacroix

A set of relativistic mean field models is constructed including the Hartree and Hartree-Fock approximation accounting for the exchange of isoscalar and isovector mesons as well as the pion. Density dependent coupling functions are…

Nuclear Theory · Physics 2011-09-02 E. N. E. van Dalen , H. Müther

The role of tensor force on the collision dynamics of $^{16}$O+$^{16}$O is investigated in the framework of a fully three-dimensional time-dependent Hartree-Fock theory. The calculations are performed with modern Skyrme energy functional…

Nuclear Theory · Physics 2014-10-22 Gao-Feng Dai , Lu Guo , En-Guang Zhao , Shan-Gui Zhou

Following a previous paper [Y. Shi, Phys. Rev. C 98, 014329(2018)], we present an extension of the density-functional theory to allow for dynamic calculations based on the obtained static Hartree-Fock results. We perform extensive benchmark…

Nuclear Theory · Physics 2020-11-04 Yue Shi , Nobuo Hinohara , Bastian Schuetrumpf

The multiconfigurational time-dependent Hartree-Fock equations are discussed and solved for a one-dimensional model of the Helium atom. Results for the ground state energy and two-particle density as well as the absorption spectrum are…

Quantum Physics · Physics 2015-03-13 D. Hochstuhl , S. Bauch , M. Bonitz

The nuclear time-dependent density functional theory (TDDFT) is a tool of choice for describing various dynamical phenomena in atomic nuclei. In a recent study, we reported an extension of the framework - the multiconfigurational TDDFT…

Nuclear Theory · Physics 2024-01-24 Petar Marević , David Regnier , Denis Lacroix

The $\lambda \phi^4$ model in a finite volume is studied within a non-gaussian Hartree-Fock approximation (tdHF) both at equilibrium and out of equilibrium, with particular attention to the structure of the ground state and of certain…

High Energy Physics - Phenomenology · Physics 2009-10-31 C. Destri , E. Manfredini

By minimizing the difference between the left- and the right-hand sides of the many-body time-dependent Schr\"{o}dinger equation with the Slater-determinant wave-function, we derive a non-adiabatic and self-interaction free time-dependent…

Quantum Physics · Physics 2013-04-26 V. U. Nazarov

Background: The tensor interaction is known to play an important role in the nuclear structure studies of exotic nuclei. However, most microscopic studies of low-energy nuclear reactions neglect the tensor force, resulting in a lack of…

Nuclear Theory · Physics 2018-12-19 Lu Guo , K. Godbey , A. S. Umar

We present simple equations for a canonical-basis formulation of the time-dependent Hartree-Fock-Bogoliubov (TDHFB) theory. The equations are obtained from the TDHFB theory with an approximation that the pair potential is assumed to be…

We present the basic concepts and recent developments in the time-dependent density functional theory (TDDFT) for describing nuclear dynamics at low energy. The symmetry breaking is inherent in nuclear energy density functionals (EDFs),…

Nuclear Theory · Physics 2016-12-21 Takashi Nakatsukasa , Kenichi Matsuyanagi , Masayuki Matsuo , Kazuhiro Yabana

An iterative adiabatic time-dependent Hartree-Fock-Bogoliubov (ATDHFB) method is developed within the framework of Skyrme density functional theory. The ATDHFB equation is solved iteratively to avoid explicitly calculating the stability…

Although the overall time-scale for nuclear fission is long, suggesting a slow process, rapid shape evolution occurs in its later stages near scission. Theoretical prediction of the fission fragments and their characteristics are often…

Nuclear Theory · Physics 2014-06-03 C. Simenel , A. S. Umar

The exactly solvable quantum many-particle model with harmonic one- and two-particle interaction terms is extended to include time-dependency. We show that when the external trap potential and finite-range interparticle interaction have a…

Density functional theory (DFT) can run into serious difficulties with localized states in elements such as transition metals with occupied-d states and oxygen. In contrast, Hartree-Fock (HF) method can be a better approach for such…

Materials Science · Physics 2018-08-01 Hengxin Tan , Yuanchang Li , S. B. Zhang , Wenhui Duan

A microscopic finite-temperature model based on time-dependent nuclear density functional theory (TDDFT), is employed to study the induced-fission process of $^{226}$Th. The saddle-to-scission dynamics of this process is explored, starting…

Nuclear Theory · Physics 2024-09-11 B. Li , D. Vretenar , T. Nikšić , P. W. Zhao , J. Meng