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Kohn-Sham (KS) formalism of Density Functional Theory is modified to include the systems with strong non-dynamic electron correlation. Unlike in extended KS and broken symmetry unrestricted KS formalisms, cases of both singlet-triplet and…

Chemical Physics · Physics 2007-05-23 Artem Masunov

In the well-known Kohn-Sham theory in Density Functional Theory, a fictitious non-interacting system is introduced that has the same particle density as a system of $N$ electrons subjected to mutual Coulomb repulsion and an external…

Mathematical Physics · Physics 2014-04-14 Andre Laestadius

We perform a systematic analysis of the density dependence of the nuclear symmetry energy within the microscopic Brueckner--Hartree--Fock (BHF) approach using the realistic Argonne V18 nucleon-nucleon potential plus a phenomenological three…

Nuclear Theory · Physics 2009-11-02 Isaac Vidana , Constanca Providencia , Artur Polls , Arnau Rios

An improved density-matrix expansion is used to calculate the nuclear energy density functional from chiral two- and three-nucleon interactions. The two-body interaction comprises long-range one- and two-pion exchange contributions and a…

Nuclear Theory · Physics 2015-05-30 J. W. Holt , N. Kaiser , W. Weise

Aspects of Density Functional Resonance Theory (DFRT) [Phys. Rev. Lett. \textbf{107}, 163002 (2011)], a recently developed complex-scaled version of ground-state Density Functional Theory (DFT), are studied in detail. The asymptotic…

Quantum Physics · Physics 2015-06-04 Daniel L. Whitenack , Adam Wasserman

The properties of asymmetric nuclear matter have been investigated in a relativistic Dirac-Brueckner-Hartree-Fock framework using the Bonn A potential. The components of the self-energies are extracted by projecting on Lorentz invariant…

Nuclear Theory · Physics 2009-11-10 E. N. E. van Dalen , C. Fuchs , Amand Faessler

How does subatomic matter organize itself? Neutron stars are cosmic laboratories uniquely poised to answer this fundamental question that lies at the heart of nuclear science. Newly commissioned rare isotope facilities, telescopes operating…

Nuclear Theory · Physics 2019-12-25 Junjie Yang , J. Piekarewicz

Density-functional theory for superfluid systems is developed in the framework of the functional renormalization group based on the effective action formalism. We introduce the effective action for the particle-number and nonlocal pairing…

Nuclear Theory · Physics 2021-05-11 Takeru Yokota , Haruki Kasuya , Kenichi Yoshida , Teiji Kunihiro

The density and temperature dependence of nucleonic single particle spectral function in symmetric nuclear matter at finite temperatures and densities beyond normal nuclear matter density is investigated in a model emphasizing short-range…

Nuclear Theory · Physics 2009-11-10 Frank Froemel , Horst Lenske , Ulrich Mosel

Nuclear density functional theory is the prevalent theoretical framework for accurately describing nuclear properties at the scale of the entire chart of nuclides. Given an energy functional and a many-body scheme (e.g., single- or…

Nuclear Theory · Physics 2020-06-19 N. Schunck , J. O'Neal , M. Grosskopf , E. Lawrence , S. M. Wild

The foundation of the local energy-density functional method to describe the nuclear ground-state properties is given. The method is used to investigate differential observables such as the odd-even mass differences and odd-even effects in…

Nuclear Theory · Physics 2009-11-07 S. A. Fayans , S. V. Tolokonnikov , E. L. Trykov , D. Zawischa

The nuclear symmetry energy characterizes the variation of the binding energy as the neutron to proton ratio of nuclear systems (e.g. finite nucleus, neutron star etc.) is varied. The densities associated to these nuclear systems vary over…

Nuclear Theory · Physics 2018-08-24 Chiranjib Mondal

The density functional renormalization group (density-fRG) is proposed to investigate the density fluctuations within the functional renormalization group approach, which allows us to quantify the medium effect and study physics of high…

Nuclear Theory · Physics 2025-08-05 Yong-rui Chen , Wei-jie Fu , Yang-yang Tan

We derive density-dependent corrections to the in-medium nucleon-nucleon interaction from the leading-order chiral three-nucleon force. To this order there are six distinct one-loop diagrams contributing to the in-medium nucleon-nucleon…

Nuclear Theory · Physics 2010-04-06 J. W. Holt , N. Kaiser , W. Weise

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

Calculations for infinite nuclear matter with realistic nucleon-nucleon interactions suggest that the isoscalar effective mass (IEM) of a nucleon at the saturation density equals $m^*/m\sim 0.8\pm 0.1$, at variance with empirical data on…

Nuclear Theory · Physics 2015-05-14 M. Zalewski , P. Olbratowski , W. Satula

Recently, we have proposed the adaptive local basis set for electronic structure calculations based on Kohn-Sham density functional theory in a pseudopotential framework. The adaptive local basis set is efficient and systematically…

Computational Physics · Physics 2015-10-23 Gaigong Zhang , Lin Lin , Wei Hu , Chao Yang , John E. Pask

A fermion ground state energy functional is set up in terms of particle density, relative pair density, and kinetic energy tensor density. It satisfies a minimum principle if constrained by a complete set of compatibility conditions. A…

Chemical Physics · Physics 2009-10-17 Bin Liu , Jerome K. Percus

Density functional theory is generalized to incorporate electron-phonon coupling. A Kohn-Sham equation yielding the electronic density $n_U(\mathbf{r})$, a conditional probability density depending parametrically on the phonon normal mode…

Materials Science · Physics 2019-04-25 Ryan Requist , C. R. Proetto , E. K. U. Gross

Basic issues of the time-dependent density-functional theory are discussed, especially on the real-time calculation of the linear response functions. Some remarks on the derivation of the time-dependent Kohn-Sham equations and on the…

Nuclear Theory · Physics 2017-01-06 Takashi Nakatsukasa