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We compare two different approaches to investigations of many-electron systems. The first is the Hartree-Fock (HF) method and the second is the Density Functional Theory (DFT). Overview of the main features and peculiar properties of the HF…

材料科学 · 物理学 2009-11-07 M. Ya. Amusia , A. Z. Msezane , V. R. Shaginyan

The formalism of density functional theory (DFT) can be easily extended to the time dependent case (TDDFT). However, while in the static case the theory is well established and is expected to be, at least in principle, an exact approach for…

凝聚态物理 · 物理学 2007-05-23 Sandro Stringari

The self-energy of the Dirac Brueckner-Hartree-Fock calculation in nuclear matter is parametrized by introducing density-dependent coupling constants of isoscalar mesons in the relativistic Hartree-Fock (RHF) approach where isoscalar meson…

核理论 · 物理学 2009-10-28 Hua-lin Shi , Bao-qiu Chen , Zhong-yu Ma

We analyze the effect of pairing on particle transport in time-dependent theories based on the Hartree-Fock-Bogoliubov (HFB) or BCS approximations. The equations of motion for the HFB density matrices are unique and the theory respects the…

核理论 · 物理学 2015-06-04 G. Scamps , D. Lacroix , G. F. Bertsch , K. Washiyama

We find the general solution to the time-dependent Hartree-Fock problem for scattering solutions of the Gross-Neveu models, with both discrete (GN_2) and continuous (NJL_2) chiral symmetry. We find new multi-breather solutions both for the…

高能物理 - 理论 · 物理学 2014-01-22 Gerald V. Dunne , Michael Thies

Time-dependent density functional theory (TDDFT) is rapidly emerging as a premier method for solving dynamical many-body problems in physics and chemistry. The mathematical foundations of TDDFT are established through the formal existence…

量子物理 · 物理学 2014-08-22 J. D. Whitfield , M. -H. Yung , D. G. Tempel , S. Boixo , A. Aspuru-Guzik

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…

核理论 · 物理学 2014-02-07 A. S. Umar , V. E. Oberacker , R. Keser , J. A. Maruh , P. -G. Reinhard

Time-Dependent Density Functional Theory (TDDFT) has been currently established as a computationally cheaper, yet effective, alternative to the Many-Body Perturbation Theory (MBPT) for calculating the optical properties of solids. Within…

材料科学 · 物理学 2026-04-13 M. Arruabarrena , A. Leonardo , A. Ayuela

We present a time-dependent localized Hartree-Fock density-functional linear response approach for the treatment of photoionization of atomic systems. This approach employs a spin-dependent localized Hartree-Fock (SLHF) exchange potential…

量子物理 · 物理学 2015-05-13 Zhongyuan Zhou , Shih-I Chu

We study a class of two-dimensional non-linear Schr\"odinger equations with point-like singular perturbation and Hartree non-linearity. The point-like singular perturbation of the free Laplacian induces appropriate perturbed Sobolev spaces…

偏微分方程分析 · 数学 2022-04-12 Vladimir Georgiev , Alessandro Michelangeli , Raffaele Scandone

The logical structure and the basic theorems of time-dependent current density functional theory (TDCDFT) are analyzed and reconsidered from the point of view of recently proposed time-dependent deformation functional theory (TDDefFT). It…

强关联电子 · 物理学 2019-03-27 I. V. Tokatly

The density matrix expansion is used to derive a local energy density functional for finite range interactions with a realistic meson exchange structure. Exchange contributions are treated in a local momentum approximation. A generalized…

核理论 · 物理学 2008-11-26 F. Hofmann , H. Lenske

With the relativistic representation of the nuclear tensor force that is included automatically by the Fock diagrams, we explored the self-consistent tensor effects on the properties of nuclear matter system. The analysis were performed…

核理论 · 物理学 2015-01-20 Li Juan Jiang , Shen Yang , Jian Min Dong , Wen Hui Long

A many-body wave function is approximated by a product of two functions: the wave function $\phi$ depending on the particle coordinates and the function $\chi$ depending only on the value of interparticle interaction potential. For the…

量子物理 · 物理学 2008-09-10 V. M. Tapilin

A comprehensive theoretical understanding of electron-photon correlation is essential for describing the reshaping of molecular orbitals in quantum electrodynamics (QED) environments. The strong coupling QED Hartree-Fock (SC-QED-HF) theory…

化学物理 · 物理学 2024-09-04 Yassir El Moutaoukal , Rosario R. Riso , Matteo Castagnola , Henrik Koch

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…

原子物理 · 物理学 2007-05-23 Sebastien Ragot

Understanding the real-time evolution of many-electron quantum systems is essential for studying dynamical properties in condensed matter, quantum chemistry, and complex materials, yet it poses a significant theoretical and computational…

强关联电子 · 物理学 2024-11-07 Jannes Nys , Gabriel Pescia , Alessandro Sinibaldi , Giuseppe Carleo

One of the few exact results for the description of the time-evolution of an inhomogeneous, interacting many-particle system is given by the Harmonic Potential Theorem (HPT). The relevance of this theorem is that it sets a tight constraint…

核理论 · 物理学 2019-09-18 S. Zanoli , X. Roca-Maza , G. Colò , S. Shen

We study the quantum dynamics of a large number of interacting fermionic particles in a constant magnetic field. In a coupled mean-field and semiclassical scaling limit, we show that solutions of the many-body Schr\"odinger equation…

数学物理 · 物理学 2025-03-24 Niels Benedikter , Chiara Boccato , Domenico Monaco , Ngoc Nhi Nguyen

A simple and commonly employed approximate technique with which one can examine spatially disordered systems when strong electronic correlations are present is based on the use of real-space unrestricted self-consistent Hartree-Fock wave…

强关联电子 · 物理学 2009-11-13 X. Chen , A. Farhoodfar , T. McIntosh , R. J. Gooding , P. W. Leung