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We analyse a path to construct density functionals for the dispersion interaction energy from an expression in terms of the ground state densities and exchange-correlation holes of the isolated fragments. The expression is based on a…

Chemical Physics · Physics 2021-01-27 Derk P. Kooi , Paola Gori-Giorgi

We study the system of trapped two-component Fermi gases with zero-range interaction in two dimensions (2D) or one dimension (1D). We calculate the one-particle density matrices of these systems at small displacements, from which we show…

Quantum Gases · Physics 2024-02-08 Jiansen Zhang , Shina Tan

Density functional theory, when applied to systems with $T\neq 0$, is based on the grand canonical extension of the Hohenberg-Kohn-Sham theorem due to Mermin (HKSM theorem). While a straightforward canonical ensemble generalization fails,…

Statistical Mechanics · Physics 2009-10-31 J. A. Hernando , L. Blum

The momentum and density dependence of mean fields in symmetric and asymmetric nuclear matter are analysed using the simple density dependent finite range effective interaction containing a single Gaussian term alongwith the zero-range…

Nuclear Theory · Physics 2015-06-11 T. R. Routray , X. Vinas , S. K. Tripathy , M. Bhuyan , S. K. Patra , B. Behera

Nuclear Density Functional Theory (DFT) plays a prominent role in the understanding of nuclear structure, being the approach with the widest range of applications. Hohenberg and Kohn theorems warrant the existence of a nuclear Energy…

Nuclear Theory · Physics 2020-03-03 G. Accorto , P. Brandolini , F. Marino , A. Porro , A. Scalesi , G. Colò , X. Roca-Maza , E. Vigezzi

We provide a general framework for self-interacting warm dark matter (WDM) in cosmological perturbations, by deriving from first principles a Boltzmann hierarchy which retains certain independence from a particular interaction Lagrangian.…

Cosmology and Nongalactic Astrophysics · Physics 2020-09-28 Rafael Yunis , Carlos R. Argüelles , Diana López Nacir

The Hohenberg-Kohn theorem of density functional theory (DFT) for the case of electrons interacting with an external magnetic field (that couples to spin only) is examined in more detail than previously. A unexpected generalization is…

Strongly Correlated Electrons · Physics 2009-10-31 H. Eschrig , W. E. Pickett

A relativistic density-functional theory based on a Fock-space effective quantum-electrodynamics (QED) Hamiltonian using the Coulomb or Coulomb-Breit two-particle interaction is developed. This effective QED theory properly includes the…

Chemical Physics · Physics 2021-05-03 Julien Toulouse

The development of a modern and more realistic nuclear energy density functional (EDF) for accurate predictions of properties of nuclei is the subject of enhanced activity, since it is very important for the study of properties of nuclear…

Nuclear Theory · Physics 2019-11-14 S. Shlomo , A. I. Sanzhur

The theoretical description of sparse matter attracts much interest, in particular for those ground-state properties that can be described by density functional theory (DFT). One proposed approach, the van der Waals density functional…

The inclusion of nucleonic exchange energy has been a long-standing challenge for the relativistic density functional theory (RDFT) in nuclear physics. We propose an orbital-dependent relativistic Kohn-Sham density functional theory to…

Nuclear Theory · Physics 2023-04-26 Qiang Zhao , Zhengxue Ren , Pengwei Zhao , Tae-Sun Park

Within the framework of linear-scaling Kohn-Sham density functional theory, a robust method for maintaining compact localized orbitals close to the ground state is coupled with nuclear dynamics. This allows to obviate the commonly employed…

Computational Physics · Physics 2018-08-01 Hayden Scheiber , Yifei Shi , Rustam Z. Khaliullin

The effects of short-range correlations derived from a realistic meson-exchange potential on the single-particle density matrix in finite nuclei are investigated by analyzing the one-body density in terms of the natural orbits. Basic…

Nuclear Theory · Physics 2016-09-08 A. Polls , H. Müther , W. H. Dickhoff

Density functional theory (DFT), the most widely adopted method in modern computational chemistry, fails to describe accurately the electronic structure of strongly correlated systems. Here we show that DFT can be formally and practically…

Chemical Physics · Physics 2022-04-18 Daniel Gibney , Jan-Niklas Boyn , David A. Mazziotti

We investigate the global dynamics of the universe within the framework of the Interacting Dark Matter (IDM) scenario. Considering that the dark matter obeys the collisional Boltzmann equation, we can obtain analytical solutions of the…

Cosmology and Nongalactic Astrophysics · Physics 2014-11-20 Spyros Basilakos , Manolis Plionis

The Hohenberg-Kohn theorem and Kohn-Sham procedure are extended to functionals of the localized intrinsic density of a self-bound system such as a nucleus. After defining the intrinsic-density functional, we modify the usual Kohn-Sham…

Nuclear Theory · Physics 2008-11-26 J. Engel

This paper concerns the asymptotic ground state properties of heavy atoms in strong, homogeneous magnetic fields. In the limit when the nuclear charge Z tends to infinity with the magnetic field B satisfying B >> Z^{4/3} all the electrons…

Mathematical Physics · Physics 2009-10-31 Christian Hainzl , Robert Seiringer

The present contribution does not aim at replacing the huge and often excellent literature on DFT for atomic nuclei, but tries to provide an updated introduction to this topic. The goal would be, ideally, to help a fresh M.Sc. or Ph.D.…

Nuclear Theory · Physics 2019-08-09 G. Colò

A recent calculation of the nuclear energy density functional from chiral two- and three-nucleon forces is extended to the isovector terms pertaining to different proton and neutron densities. An improved density-matrix expansion is adapted…

Nuclear Theory · Physics 2015-06-04 N. Kaiser

We present a general approach for the construction of the exact local-energy-density functionals for a uniform N-dimensional electronic system in a magnetic field. For arbitrary dimension, we obtain explicit expressions for the matter,…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 B. P. van Zyl