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I describe recent progress towards a theory of the NN force which captures the consequences of QCD's chiral symmetry and the pattern of its breaking, and is formulated as an expansion in a ratio of low and high mass scales, M_{lo}/M_{hi}.…

Nuclear Theory · Physics 2013-02-26 Daniel R. Phillips

We introduce a new relativistic energy density functional constrained by the ground state properties of atomic nuclei along with the isoscalar giant monopole resonance energy and dipole polarizability in $^{208}$Pb. A unified framework of…

Nuclear Theory · Physics 2019-03-27 E. Yuksel , T. Marketin , N. Paar

Chiral effective field theory (chiEFT) provides a systematic approach to describe low-energy nuclear forces. Moreover, chiEFT is able to provide well-founded estimates of statistical and systematic uncertainties -- although this unique…

Orbital-free density functional theory (OF-DFT) runs at low computational cost that scales linearly with the number of simulated atoms, making it suitable for large-scale material simulations. It is generally considered that OF-DFT strictly…

Materials Science · Physics 2022-04-05 Qiang Xu , Cheng Ma , Wenhui Mi , Yanchao Wang , Yanming Ma

The extension of the density functional theory (DFT) to include pairing correlations without formal violation of the particle-number conservation condition is described. This version of the theory can be considered as a foundation of the…

Nuclear Theory · Physics 2007-05-23 S. Krewald , V. B. Soubbotin , V. I. Tselyaev , X. Vinas

We establish necessary and sufficient conditions for the N-representability of the universal one-electron reduced density matrix functional. Functionals satisfying these conditions are guaranteed to yield variational upper bounds on the…

Quantum Physics · Physics 2026-04-08 Jannis Erhard , Paul W. Ayers

A study of parameter sensitivity of nuclear energy density functionals, initiated in the first part of this work \cite{NV.16}, is extended by the inclusion of data on ground-state properties of finite nuclei in the application of the…

Nuclear Theory · Physics 2017-05-24 Tamara Nikšić , Marko Imbrišak , Dario Vretenar

Background: Theoretical approaches based on density functional theory provide the only tractable method to incorporate the wide range of densities and isospin asymmetries required to describe finite nuclei, infinite nuclear matter, and…

Nuclear Theory · Physics 2015-06-22 Wei-Chia Chen , J. Piekarewicz

In the framework of the KIDS generalized energy density functional (EDF), the nuclear equation of state (EoS) is expressed as an expansion in powers of the Fermi momentum or the cubic root of the density ($\rho^{1/3}$). Although an optimal…

Nuclear Theory · Physics 2019-07-24 Hana Gil , Young-Min Kim , Chang Ho Hyun , Panagiota Papakonstantinou , Yongseok Oh

The Quark--Meson--Coupling (QMC) model self-consistently relates the dynamics of the internal quark structure of a hadron to the relativistic mean fields arising in nuclear matter. It offers a natural explanation to some open questions in…

The number and properties of the neutrons and photons emitted in nuclear fission are directly related to the excitation energy of the fission fragments when they are formed at scission. Though not observable experimentally because of the…

Nuclear Theory · Physics 2025-10-09 Antonio Bjelčić , Nicolas Schunck , Marc Verriere

We present an approach to the DFT+U method (Density Functional Theory + Hubbard model) within which the computational effort for calculation of ground state energies and forces scales linearly with system size. We employ a formulation of…

Strongly Correlated Electrons · Physics 2012-02-14 David D. O'Regan , Nicholas D. M. Hine , Mike C. Payne , Arash A. Mostofi

Using an energy density functional (EDF) based on the thermodynamic Gibbs-Duhem relation, found equivalent to the standard Skyrme EDF for infinite nuclear matter, it is demonstrated that the parameters of this EDF are not uniquely…

Nuclear Theory · Physics 2018-12-26 Tuhin Malik , C. Mondal , B. K. Agrawal , J. N. De , S. K. Samaddar

Rigorous mathematical foundations of density functional theory are revisited, with some use of infinitesimal (nonstandard) methods. A thorough treatment is given of basic properties of internal energy and ground-state energy functionals…

Other Condensed Matter · Physics 2016-06-30 Paul E. Lammert

A way to improve the accuracy of the spectral properties in density functional theory (DFT) is to impose constraints on the effective, Kohn-Sham (KS), local potential [J. Chem. Phys. {\bf 136}, 224109 (2012)]. As illustrated, a convenient…

Chemical Physics · Physics 2023-05-22 Thomas C. Pitts , Sofia Bousiadi , Nikitas I. Gidopoulos , Nektarios N. Lathiotakis

Chiral effective field theory has established itself as the method of choice to study nuclear forces and low-energy nuclear dynamics. I review the status and prospects of this approach and discuss ongoing efforts to advance the precision…

Nuclear Theory · Physics 2015-10-27 Evgeny Epelbaum

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

A new anchor-based optimization method of defining the energy density functionals (EDFs) is proposed. In this approach, the optimization of the parameters of EDF is carried out for the selected set of spherical anchor nuclei the physical…

Nuclear Theory · Physics 2023-04-19 A. Taninah , A. V. Afanasjev

Energy density functional (EDF) theory provides a unified framework for the description of nuclei and of infinite nuclear matter. In principle, it facilitates direct connections between nuclear data and the nuclear equation of state (EoS).…

Nuclear Theory · Physics 2025-12-01 Panagiota Papakonstantinou

Toward a universal description of pairing properties in nuclei far from stability, we extend the energy density functional by enriching the isovector density dependence in the particle-particle channel (pair density functional, pair-DF). We…

Nuclear Theory · Physics 2009-12-14 M. Yamagami , Y. R. Shimizu , T. Nakatsukasa