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Related papers: One-Dimensional Lieb-Oxford Bounds

200 papers

The Lieb-Oxford bound, a nontrivial inequality for the indirect part of the many-body Coulomb repulsion in an electronic system, plays an important role in the construction of approximations in density functional theory. Using the…

Chemical Physics · Physics 2016-05-04 Michael Seidl , Stefan Vuckovic , Paola Gori-Giorgi

We prove a new lower bound on the indirect Coulomb energy in quantum mechanics in terms of the single particle density of the system. The new universal lower bound is an alternative to the classical Lieb--Oxford bound (with a smaller…

Mathematical Physics · Physics 2011-03-14 Rafael D. Benguria , Gonzalo Bley , Michael Loss

Universal properties of the Coulomb interaction energy apply to all many-electron systems. Bounds on the exchange-correlation energy, inparticular, are important for the construction of improved density functionals. Here we investigate one…

Chemical Physics · Physics 2015-05-13 Mariana M. Odashima , K. Capelle

We study the energetic properties of finite but internally homogeneous D-dimensional electron droplets in the strict-correlation limit. The indirect Coulomb interaction is found to increase as a function of the electron number, approaching…

Strongly Correlated Electrons · Physics 2011-05-11 E. Rasanen , M. Seidl , P. Gori-Giorgi

Lieb and Oxford (1981) derived rigorous lower bounds, in the form of local functionals of the electron density, on the indirect part of the Coulomb repulsion energy. The greatest lower bound for a given electron number N depends…

Applied Physics · Physics 2022-06-22 John P. Perdew , Jianwei Sun

In the framework of density-functional theory, several popular density functionals for exchange and correlation have been constructed to satisfy a local form of the Lieb-Oxford bound. In its original global expression, the bound represents…

Other Condensed Matter · Physics 2012-05-31 J. G. Vilhena , E. Rasanen , L. Lehtovaara , M. A. L. Marques

The Lieb-Oxford inequality provides a lower bound on the Coulomb energy of a classical system of $N$ identical charges only in terms of their one-particle density. We prove here a new estimate on the best constant in this inequality.…

Mathematical Physics · Physics 2024-03-27 Mathieu Lewin , Elliott H. Lieb , Robert Seiringer

We prove a Lieb-Oxford-type inequality on the indirect part of the Coulomb energy of a general many-particle quantum state, with a lower constant than the original statement but involving an additional gradient correction. The result is…

Mathematical Physics · Physics 2015-02-12 Mathieu Lewin , Elliott H. Lieb

We prove a new lower bound on the indirect Coulomb energy in two dimensional quantum mechanics in terms of the single particle density of the system. The new universal lower bound is an alternative to the Lieb--Solovej--Yngvason bound with…

Mathematical Physics · Physics 2015-05-28 Rafael D. Benguria , Pablo Gallegos , Matej Tusek

The Lieb-Oxford bound is a constraint upon approximate exchange-correlation functionals. We explore a non-empirical tightening of that bound in both universal and electron-number-dependent form. The test functional is PBE. Regarding both…

Chemical Physics · Physics 2009-05-14 Mariana M. Odashima , K. Capelle , S. B. Trickey

Density-functional theory requires ever better exchange-correlation (xc) functionals for the ever more precise description of many-body effects on electronic structure. Universal constraints on the xc energy are important ingredients in the…

Chemical Physics · Physics 2009-11-13 Mariana M. Odashima , K. Capelle

Lewin and Lieb have recently proven several new bounds on the exchange-correlation energy that complement the Lieb-Oxford bound. We test these bounds for atoms, for slowly-varying gases, and for Hooke's atom, finding them usually less…

Chemical Physics · Physics 2014-12-25 David V. Feinblum , John Kenison , Kieron Burke

We introduce a new paradigm for finite and infinite strict-one-dimensional uniform electron gases. In this model, $n$ electrons are confined to a ring and interact via a bare Coulomb operator. In the high-density limit (small-$r_s$, where…

Strongly Correlated Electrons · Physics 2012-08-15 Pierre-François Loos , Peter M. W. Gill

We consider one-dimensional regularizations of the Coulomb potential formed by taking a two-dimensional expectation of the Coulomb potential with respect to the Landau states. It is well-known that such functions arises naturally in the…

Mathematical Physics · Physics 2007-05-23 Raymond Brummelhuis , Mary Beth Ruskai , Elisabeth Werner

In this manuscript we provide a family of lower bounds on the indirect Coulomb energy for atomic and molecular systems in two dimensions in terms of a functional of the single particle density with gradient correction terms.

Mathematical Physics · Physics 2015-06-05 Rafael D. Benguria , Matěj Tušek

We study interacting Bose gases and prove lower bounds for the kinetic plus interaction energy of a many-body wave function in terms of its particle density. These general estimates are then applied to various types of interactions,…

Mathematical Physics · Physics 2015-04-14 Douglas Lundholm , Fabian Portmann , Jan Philip Solovej

We consider a large class of interacting particle systems in 1D described by an energy whose interaction potential is singular and non-local. This class covers Riesz gases (in particular, log gases) and applications to plasticity and…

Analysis of PDEs · Mathematics 2020-10-27 Masato Kimura , Patrick van Meurs

A simple and completely general representation of the exact exchange-correlation functional of density-functional theory is derived from the universal Lieb-Oxford bound, which holds for any Coulomb-interacting system. This representation…

Materials Science · Physics 2015-05-13 Mariana M. Odashima , K. Capelle

We consider a two-dimensional Coulomb gas confined to a disk when the external potential is radially symmetric. In the presence of a hard-wall constraint effective to change the equilibrium, the density of the equilibrium measure acquires a…

Mathematical Physics · Physics 2020-10-20 Seong-Mi Seo

We briefly review the limits on new interactions implied by electroweak precision data. Special attention is payed to the bounds on the Higgs boson mass. We also comment on the required cancellation among the new contributions to precisely…

High Energy Physics - Phenomenology · Physics 2015-05-28 F. del Aguila , J. de Blas
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