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The density functional theory (DFT) is based on the existence and uniqueness of a universal functional $E[\rho]$, which determines the dependence of the total energy on single-particle density distributions. However, DFT says nothing about…

Nuclear Theory · Physics 2017-04-26 Hana Gil , Panagiota Papakonstantinou , Chang Ho Hyun , Tae-Sun Park , Yongseok Oh

We present new ab initio calculations of the electronic structure of various atoms and molecules in strong magnetic fields ranging from B=10^12 G to 2x10^15 G, appropriate for radio pulsars and magnetars. For these field strengths, the…

Astrophysics · Physics 2008-11-26 Zach Medin , Dong Lai

New energy-density functionals (EDFs) inspired by effective-field theories (EFTs) have been recently proposed. The present work focuses on three of such functionals which were developed to produce satisfactory equations of state for nuclear…

Nuclear Theory · Physics 2018-09-26 Jérémy Bonnard , Marcella Grasso , Denis Lacroix

Kohn-Sham density functional theory is in principle an exact formulation of quantum mechanical electronic structure theory, but in practice we have to rely on approximate exchange-correlation (xc) functionals. The objective of our work has…

Chemical Physics · Physics 2013-09-09 Roberto Peverati , Donald G. Truhlar

While ab initio many-body techniques have been able to successfully describe the properties of light and intermediate mass nuclei based on chiral effective field theory interactions, neutron-rich nuclei still remain out of reach for these…

Nuclear Theory · Physics 2020-01-08 R. Navarro Pérez , N. Schunck

The problem of pairing in the $^{1}$S$_{0}$ channel of finite nuclei is revisited. In nuclear matter forces of separable form can be adjusted to the bare nuclear force, to any phenomenological pairing interaction such as the Gogny force or…

Nuclear Theory · Physics 2010-11-23 Y. Tian , Z. Y. Ma , P. Ring

The long-range terms of the subleading chiral three-nucleon force [published in Phys.\,Rev.\,C77, 064004 (2008)] are specified to the case of three neutrons. From these $3n$-interactions an effective density-dependent neutron-neutron…

Nuclear Theory · Physics 2020-12-21 N. Kaiser

We have recently developed a set of equations of state based on the nuclear energy density functional theory providing a unified description of the different regions constituting the interior of neutron stars and magnetars. The nuclear…

We proposed in Ref. [arXiv:1812.09285v2] a way to improve energy density functionals in the density functional theory based on the combination of the inverse Kohn-Sham method and the density functional perturbation theory. In this…

Chemical Physics · Physics 2020-12-24 Tomoya Naito , Daisuke Ohashi , Haozhao Liang

We study the bulk deformation properties of the Skyrme nuclear energy density functionals. Following simple arguments based on the leptodermous expansion and liquid drop model, we apply the nuclear density functional theory to assess the…

Nuclear Theory · Physics 2011-03-22 N. Nikolov , N. Schunck , W. Nazarewicz , M. Bender , J. Pei

We re-adapt a spectral renormalization method, introduced in nonlinear optics, to solve the Kohn-Sham (KS) equations of density functional theory (DFT), with a focus on functionals based on the strictly-correlated electrons (SCE) regime,…

Strongly Correlated Electrons · Physics 2020-04-23 Juri Grossi , Ziad H. Musslimani , Michael Seidl , Paola Gori-Giorgi

Kohn-Sham spin-density functional theory provides an efficient and accurate model to study electron-electron interaction effects in quantum dots, but its application to large systems is a challenge. An efficient algorithm for the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Hong Jiang , Harold U. Baranger , Weitao Yang

Nuclear structure models built from phenomenological mean fields, the effective nucleon-nucleon interactions (or Lagrangians), and the realistic bare nucleon-nucleon interactions are reviewed. The success of covariant density functional…

Nuclear Theory · Physics 2019-10-14 Shihang Shen , Haozhao Liang , Wen Hui Long , Jie Meng , Peter Ring

An effective nucleon-nucleon interaction calculated in nuclear matter from the Bonn potential has been parametrized in terms of a local density- and energy-dependent two-body interaction. This allows to calculate the real part of the…

Nuclear Theory · Physics 2009-10-30 G. Bartnitzky , H. Clement , P. Czerski , H. Müther , F. Nuoffer , J. Siegler

Nuclear density functional theory (DFT) is the only microscopic, global approach to the structure of atomic nuclei. It is used in numerous applications, from determining the limits of stability to gaining a deep understanding of the…

Nuclear Theory · Physics 2015-02-06 Nicolas Schunck , Jordan D. McDonnell , Jason Sarich , Stefan M. Wild , Dave Higdon

The time-dependent version of nuclear density functional theory, using functionals derived from Skyrme interactions, is able to approximately describe nuclear dynamics. We present time-dependent results of calculations of dipole resonances,…

Nuclear Theory · Physics 2016-02-17 P. D. Stevenson

It is shown that the equation of state of nuclear matter can be determined within the mean-field theory of $\sigma \omega$ model provided only that the nucleon effective mass curve is given. We use a family of the possible nucleon effective…

Nuclear Theory · Physics 2008-11-26 Jae Hwang Lee , Young Jae Lee , Suk-Joon Lee

The practical success of density functional theory (DFT) is largely credited to the Kohn-Sham approach, which enables the exact calculation of the non-interacting electron kinetic energy via an auxiliary noninteracting system. Yet, the…

Computational Physics · Physics 2025-03-21 Sangita Majumdar , Zekun Shi , Giovanni Vignale

We present a new two-body finite-range and momentum-dependent but density-independent effective interaction, which can be interpreted as a regularized zero-range force. We show that no three-body or density-dependent terms are needed for a…

Nuclear Theory · Physics 2015-06-16 K. Bennaceur , J. Dobaczewski , F. Raimondi

Nuclear density functional theory is the only microscopical theory that can be applied throughout the entire nuclear landscape. Its key ingredient is the energy density functional. In this work, we propose a new parameterization UNEDF2 of…

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