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Related papers: Dynamic Microscopic Theory of Fusion Using DC-TDHF

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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

A microscopic mean-field description of heavy ion collisions is performed in the framework of the time dependent Hartree-Fock theory using a Skyrme energy density functional. A good agreement with experiments is obtained on the position of…

Nuclear Theory · Physics 2009-04-20 Cédric Simenel , Benoît Avez , Cédric Golabek

We present a microscopic calculation of multi-nucleon transfer reactions employing the time-dependent Hartree-Fock (TDHF) theory. In our previous publication [Phys. Rev. C 88, 014614 (2013)], we reported our analysis for the multi-nucleon…

Nuclear Theory · Physics 2016-11-10 Kazuyuki Sekizawa , Kazuhiro Yabana

The fluctuation-dissipation mechanism underlying non-equilibrium transport in low-energy heavy-ion reactions remains unclear. Although the time-dependent Hartree-Fock (TDHF) method provides a reasonable description of average reaction…

Nuclear Theory · Physics 2025-07-02 Zepeng Gao , Kazuyuki Sekizawa , Long Zhu

A method of calculating giant resonance strength functions using Time-Dependent Hartree-Fock techniques is described. An application to isoscalar giant monopole resonances in spherical nuclei is made, thus allowing a comparison between…

Nuclear Theory · Physics 2009-11-10 P. D. Stevenson , M. R. Strayer , J. Rikovska Stone , W. G. Newton

Calculating highly accurate thermochemical properties of condensed matter via wave function-based approaches (such as e.g. Hartree-Fock or hybrid functionals) has recently attracted much interest. We here present two strategies providing…

The use of actinide collisions have been suggested as a way to produce neutron rich isotopes of high Z nuclei. The collision dynamics of these reactions can be studied using unrestricted time-dependent Hartree-Fock (TDHF) calculations.…

Nuclear Theory · Physics 2018-05-09 A. S. Umar , C. Simenel

It has been known that the time-dependent Hartree-Fock (TDHF) method, or the time-dependent density functional theory (TDDFT), fails to describe many-body quantum tunneling. We overcome this problem by superposing a few time-dependent…

Nuclear Theory · Physics 2020-06-15 N. Hasegawa , K. Hagino , Y. Tanimura

We propose a new method of calculating electronically excited states that combines a density functional theory (DFT) based ground state calculation with a linear response treatment that employs approximations used in the time-dependent…

Chemical Physics · Physics 2016-05-11 Robert Rüger , Erik van Lenthe , Thomas Heine , Lucas Visscher

The description of fission remains a challenge for nuclear microscopic theories. The time-dependent Hartree-Fock approach with BCS pairing is applied to study the last stage of the fission process. A good agreement is found for the one-body…

Nuclear Theory · Physics 2015-10-28 Guillaume Scamps , Cédric Simenel , Denis Lacroix

We revisit recent developments in the theoretical foundations of time-dependent density functional theory (TDDFT). TDDFT is then applied to the calculation of total cross sections for ionization processes in the antiproton-Helium collision…

Atomic Physics · Physics 2011-03-28 N. Henkel , M. Keim , H. J. Lüdde , T. Kirchner

This article concerns the time-dependent Hartree-Fock (TDHF) approximation of single-particle dynamics in systems of interacting fermions. We find that the TDHF approximation is accurate when there are sufficiently many particles and the…

Quantum Physics · Physics 2015-02-25 Claude Bardos , Francois Golse , Alex D. Gottlieb , Norbert J. Mauser

We study dissipation and relaxation processes within the time-dependent Hartree-Fock approach using the Wigner distribution function. On the technical side we present a geometrically unrestricted framework which allows us to calculate the…

Nuclear Theory · Physics 2012-08-30 N. Loebl , A. S. Umar , J. A. Maruhn , P. -G. Reinhard , P. D. Stevenson , V. E. Oberacker

Density functional theory (DFT), one of the most widely utilized methods available to computational chemistry, fails to describe systems with statically correlated electrons. To address this shortcoming, in previous work we transformed DFT…

Chemical Physics · Physics 2023-01-02 Daniel Gibney , Jan-Niklas Boyn , David A. Mazziotti

The question of how density functional theory (DFT) compares with Hartree-Fock (HF) for the computation of momentum-space properties is addressed in relation to systems for which (near) exact Kohn-Sham (KS) and HF one-electron matrices are…

Atomic Physics · Physics 2007-05-23 Sebastien Ragot

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 effect of the Pauli exclusion principle on the nucleus-nucleus bare potential is studied using a new density-constrained extension of the Frozen-Hartree-Fock (DCFHF) technique. The resulting potentials exhibit a repulsion at short…

Nuclear Theory · Physics 2017-12-06 C. Simenel , K. Godbey , A. S. Umar , K. Vo-Phuoc , M. Dasgupta , D. J. Hinde , E. C. Simpson

The time-dependent complete-active-space self-consistent-field (TD-CASSCF) method for the description of multielectron dynamics in intense laser fields is presented, and a comprehensive description of the method is given. It introduces the…

Atomic Physics · Physics 2015-06-15 Takeshi Sato , Kenichi L. Ishikawa

DFT calculations have become widespread in both chemistry and materials, because they usually provide useful accuracy at much lower computational cost than wavefunction-based methods. All practical DFT calculations require an approximation…

Chemical Physics · Physics 2022-03-15 Eunji Sim , Suhwan Song , Stefan Vuckovic , Kieron Burke

Hybrid density functional theory (DFT) remains intractable for large periodic systems due to the demanding computational cost of exact exchange. We apply the tensor hypercontraction (THC) (or interpolative separable density fitting)…

Computational Physics · Physics 2023-10-13 Adam Rettig , Joonho Lee , Martin Head-Gordon
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