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20042023
most citedLong-range/short-range separation of the electron-electron interaction in density functional theory

466 citations · 2.4k across the 48 of their papers we have counts for

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9 papers · 1 filter

cond-mat.mtrl-sci2008★ 267 cited

Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation

Julien Toulouse, Iann C. Gerber, Georg Jansen +2

An adiabatic-connection fluctuation-dissipation theorem approach based on a range separation of electron-electron interactions is proposed. It involves a rigorous combination of sh…

cond-mat.mtrl-sci2008★ 23 cited

Degeneracy and size consistency in electronic density functional theory

Paola Gori-Giorgi, Andreas Savin

The electronic structure calculations based upon energy density functionals are highly successful and widely used both in solid state physics and quantum chemistry. Moreover, the H…

cond-mat.mtrl-sci2007

Strictly correlated electrons in density functional theory: A general formulation with applications to spherical densities

Michael Seidl, Paola Gori-Giorgi, Andreas Savin

We reformulate the strong-interaction limit of electronic density functional theory in terms of a classical problem with a degenerate minimum. This allows us to clarify many aspect…

cond-mat.mtrl-sci2006

Short-range exchange-correlation energy of a uniform electron gas with modified electron-electron interaction

Julien Toulouse, Andreas Savin, Heinz-Jürgen Flad

We calculate the short-range exchange-correlation energy of the uniform electron gas with two modified electron-electron interactions. While the short-range exchange functionals ar…

cond-mat.mtrl-sci2006★ 7 cited

Kohn-Sham calculations combined with an average pair-density functional theory

Paola Gori-Giorgi, Andreas Savin

A recently developed formalism in which Kohn-Sham calculations are combined with an ``average pair density functional theory'' is reviewed, and some new properties of the effective…

cond-mat.mtrl-sci2006

Model hamiltonians in density functional theory

Paola Gori-Giorgi, Julien Toulouse, Andreas Savin

The formalism of Kohn and Sham uses a specific (model) hamiltonian which highly simplifies the many-electron problem to that of noninteracting fermions. The theorem of Hohenberg an…

cond-mat.mtrl-sci2005★ 78 cited

Properties of short-range and long-range correlation energy density functionals from electron-electron coalescence

Paola Gori-Giorgi, Andreas Savin

The combination of density functional theory with other approaches to the many-electron problem through the separation of the electron-electron interaction into a short-range and a…

cond-mat.mtrl-sci2005★ 324 cited

Van der Waals forces in density functional theory: perturbational long-range electron interaction corrections

Janos G. Angyan, Iann C. Gerber, Andreas Savin +1

Long-range exchange and correlation effects, responsible for the failure of currently used approximate density functionals in describing van der Waals forces, are taken into accoun…

cond-mat.mtrl-sci2004★ 39 cited

Simple model for the spherically- and system-averaged pair density: Results for two-electron atoms

Paola Gori-Giorgi, Andreas Savin

As shown by Overhauser and others, accurate pair densities for the uniform electron gas may be found by solving a two-electron scattering problem with an effective screened electro…