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相关论文: Correlation energies in the random phase approxima…

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The random phase approximation (RPA) for the electron correlation energy, combined with the exact-exchange energy, represents the state-of-the-art exchange-correlation functional within density-functional theory (DFT). However, the standard…

其他凝聚态物理 · 物理学 2015-05-20 Xinguo Ren , Patrick Rinke , Alexandre Tkatchenko , Matthias Scheffler

The random phase approximation (RPA) for the correlation energy functional of density functional theory has recently attracted renewed interest. Formulated in terms of the Kohn-Sham (KS) orbitals and eigenvalues, it promises to resolve some…

其他凝聚态物理 · 物理学 2009-11-13 Hong Jiang , Eberhard Engel

The random-phase approximation (RPA) as an approach for computing the electronic correlation energy is reviewed. After a brief account of its basic concept and historical development, the paper is devoted to the theoretical formulations of…

材料科学 · 物理学 2017-07-26 Xinguo Ren , Patrick Rinke , Christian Joas , Matthias Scheffler

The random phase approximation (RPA) builds in correlations left out by mean-field theory. In full 0-hbar-omega shell-model spaces we calculate the Hartree-Fock + RPA binding energy, and compare it to exact diagonalization. We find that in…

核理论 · 物理学 2009-11-07 Ionel Stetcu , Calvin W. Johnson

We study the correlation energy associated with the pair fluctuations in BCS theory. We use a schematic two-level pairing model and discuss the behavior of the correlation energy across shell closures, including the even-odd differences. It…

核理论 · 物理学 2009-11-06 K. Hagino , G. F. Bertsch

We develop a scheme to exactly evaluate the correlation energy in the random-phase approximation, based on linear response theory. It is demonstrated that our formula is completely equivalent to a contour integral representation recently…

核理论 · 物理学 2009-10-31 Y. R. Shimizu , P. Donati , R. A. Broglia

Relativistic Continuum Random Phase Approximation (CRPA) is used to investigate collective excitation phenomena in several spherical nuclei along the periodic table. We start from relativistic mean field calculations based on a covariant…

核理论 · 物理学 2011-03-21 J. Daoutidis , P. Ring

We examine to which extent correlated realistic nucleon-nucleon interactions, derived within the Unitary Correlation Operator Method (UCOM), can describe nuclear collective motion in the framework of first-order random-phase approximation…

核理论 · 物理学 2008-11-26 P. Papakonstantinou , R. Roth , N. Paar

The random-phase approximation to the ground state correlation energy (RPA) in combination with exact exchange (EX) has brought Kohn-Sham (KS) density functional theory one step closer towards a universal, "general purpose first principles…

We explore different variants of the random phase approximation (RPA) to the correlation energy derived from closed-shell ring-diagram approximations to coupled cluster doubles theory. We implement these variants in range-separated…

化学物理 · 物理学 2011-09-01 Julien Toulouse , Wuming Zhu , Andreas Savin , Georg Jansen , János G. Angyán

The Random Phase Approximation (RPA) for total energies has previously been shown to provide a qualitatively correct description of static correlation in molecular systems, where density functional theory (DFT) with local functionals are…

材料科学 · 物理学 2017-09-27 Thomas Olsen

We investigate collective multipole excitations for closed shell nuclei from 16O to 208Pb using correlated realistic nucleon -nucleon interactions in the framework of the random phase approximation (RPA). The dominant short-range central…

核理论 · 物理学 2009-11-11 N. Paar , P. Papakonstantinou , H. Hergert , R. Roth

We explore several random phase approximation (RPA) correlation energy variants within the adiabatic-connection fluctuation-dissipation theorem approach. These variants differ in the way the exchange interactions are treated. One of these…

化学物理 · 物理学 2014-04-08 János G. Angyán , Ru-Fen Liu , Julien Toulouse , Georg Jansen

The ground-state correlation energy calculated in the random-phase approximation (RPA) is known to be identical to that calculated using a subset of terms appearing in coupled-cluster theory with double excitations. In particular, this…

化学物理 · 物理学 2019-04-16 Timothy C. Berkelbach

The RPA long range correlations are known to play a significant role in understanding the depletion of single particle-hole states observed in (e, e') and (e, e'p) measurements. Here the Random Phase Approximation (RPA) theory, implemented…

核理论 · 物理学 2009-11-11 M. Dupuis , S. Karataglidis , E. Bauge , J. P. Delaroche , D. Gogny

We present a real-space method for computing the random phase approximation (RPA) correlation energy within Kohn-Sham density functional theory, leveraging the low-rank nature of the frequency-dependent density response operator. In…

计算物理 · 物理学 2025-04-03 Boqin Zhang , Shikhar Shah , John E. Pask , Edmond Chow , Phanish Suryanarayana

A fast method is developed for calculating the Random-Phase-Approximation (RPA) correlation energy for density functional theory. The correlation energy is given by a trace over a projected RPA response matrix and the trace is taken by a…

化学物理 · 物理学 2013-01-01 Daniel Neuhauser , Eran Rabani , Roi Baer

The collective excitation phenomena in atomic nuclei are studied in two different formulations of the Random Phase Approximation (RPA): (i) RPA based on correlated realistic nucleon-nucleon interactions constructed within the Unitary…

核理论 · 物理学 2009-11-11 N. Paar , P. Papakonstantinou , H. Hergert , R. Roth

The relativistic mean field approach (RMF) is well known for describing accurately binding energies and nucleon distributions in atomic nuclei throughout the nuclear chart. The random phase approximation (RPA) built on top of the RMF is…

核理论 · 物理学 2008-11-26 Nguyen Van Giai , Haozhao Liang , Jie Meng

The matrix equations of the relativistic random-phase approximation (RRPA) are derived for an effective Lagrangian characterized by density-dependent meson-nucleon vertex functions. The explicit density dependence of the meson-nucleon…

核理论 · 物理学 2009-11-07 T. Niksic , D. Vretenar , P. Ring
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