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相关论文: RPA vs. exact shell-model correlation energies

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We propose a time-independent method for finding a correlated ground state of an extended time-dependent Hartree-Fock theory, known as the time-dependent density-matrix theory (TDDM). The correlated ground state is used to formulate the…

核理论 · 物理学 2009-11-10 M. Tohyama , S. Takahara , P. Schuck

We provide for the first time accurate assessments of the consequences of violations of self-consistency in the Hartree-Fock based random phase approximation (RPA) as commonly used to calculate the energy $E_c$ of the nuclear breathing…

核理论 · 物理学 2009-11-10 B. K. Agrawal , S. Shlomo

H-wave is an open-source software package for performing the Hartree--Fock approximation (HFA) and random phase approximation (RPA) for a wide range of Hamiltonians of interacting fermionic systems. In HFA calculations, H-wave examines the…

Partitioning of helium atom's correlation energy into radial and angular contributions, although of fundamental interest, has eluded critical scrutiny. Conventionally, radial and angular correlation energies of helium atom are defined for…

原子物理 · 物理学 2019-03-27 Anjana R Kammath , Raghunathan Ramakrishnan

The relative energies of different phases or polymorphs of molecular solids can be small, less than a kiloJoule/mol. Reliable description of such energy differences requires high quality treatment of electron correlations, typically beyond…

化学物理 · 物理学 2024-02-19 Khanh Ngoc Pham , Marcin Modrzejewski , Jiří Klimeš

Excited states of the nucleon are described as RPA configurations on a mean--field ground state taken from the MIT bag model. A residual interaction of a structure as in the Nambu--Jona--Lasinio model is used. The particle-hole states are…

核理论 · 物理学 2009-10-28 J. Geiss , S. Hardt , H. Lenske , U. Mosel

A method of the self-consistent calculation of the thermodynamical and correlation functions is presented. This approach is based on the GRPA (generalized random phase approximation) scheme with the inclusion of the mean field corrections.…

超导电性 · 物理学 2016-08-31 I. V. Stasyuk , A. M. Shvaika , K. V. Tabunshchyk

We present a readily computable semi-analytic Layer Response Theory (LRT) for analysis of cohesive energetics involving two-dimensional layers such as BN or graphene. The theory approximates the Random Phase Approximation (RPA) correlation…

材料科学 · 物理学 2016-05-04 John F. Dobson , Tim Gould , Sebastien Lebegue

Self-consistent relativistic random-phase approximation (RPA) in the radial coordinate representation is established by using the finite amplitude method (FAM). Taking the isoscalar giant monopole resonance in spherical nuclei as example,…

核理论 · 物理学 2013-10-16 Haozhao Liang , Takashi Nakatsukasa , Zhongming Niu , Jie Meng

We study the excitation spectra and the dynamical structure factor of quantum Hall states in a finite size system through exact diagonalization. Comparison is made between the numerical results so obtained and the analytic results obtained…

凝聚态物理 · 物理学 2009-10-22 Song He , Steven H. Simon , Bertrand I. Halperin

The optimized random phase approximation (ORPA) for classical liquids is re-examined in the framework of the generating functional approach to the integral equations. We show that the two main variants of the approximation correspond to the…

化学物理 · 物理学 2009-10-30 G. Pastore , O. Akinlade , F. Matthews , Z. Badirkhan

We use a fully self-consistent Hartree$-$Fock (HF) based continuum random phase approximation (CRPA) to calculate strength functions $S(E)$ and transition densities $\rho_t(r)$ for isoscalar giant resonances with multipolarities $L = 0$, 1…

核理论 · 物理学 2009-11-07 B. K. Agrawal , S. Shlomo , A. I. Sanzhur

A new method to determine electron correlation energy is described. This method is based on a better representation of the potential due to interacting electrons that is obtained by specifying both the average and standard deviation. The…

材料科学 · 物理学 2007-05-23 T. R. S. Prasanna

Density functional theory is a preferred microscopic method for calculation of nuclear properties over the whole nuclear chart. Besides ground-state properties, which are calculated by Hartree-Fock theory, nuclear excitations can be…

核理论 · 物理学 2020-06-02 Anton Repko

We find the RPA correlation energy and collective modes of the systems of composite fermions corresponding to the fillings of $1/3$, $1/5$, $2/5$ in the fractional quantum Hall effect. It is verified that transmutations to composite…

凝聚态物理 · 物理学 2015-06-25 P. Sitko , L. Jacak

The leading relativistic and QED corrections to the ground state energy of the three-body system (epe) are calculated numerically using a Hylleraas correlated basis set. The accuracy of the nonrelativistic variational ground state wave…

原子物理 · 物理学 2007-05-23 M. Grigorescu , G. W. F. Drake

Analytic approximations to the ground-state energy of closed-shell quantum dots (number of electrons from 2 to 210) are presented in the form of two-point Pade approximants. These Pade approximants are constructed from the small- and…

凝聚态物理 · 物理学 2009-10-30 A. Gonzalez , B. Partoens , F. M. Peeters

Simulations have shown that while semi-definite relaxations of AC optimal power flow (AC-OPF) on three-phase radial networks with only wye connections tend to be exact, the presence of delta connections seem to render them inexact. This…

最优化与控制 · 数学 2020-05-19 Fengyu Zhou , Ahmed S. Zamzam , Steven H. Low , Nicholas D. Sidiropoulos

We present a comparative study of particle-hole and particle-particle channels of random-phase approximation (RPA) for molecular dissociations of different bonding types. We introduced a \textit{direct} particle-particle RPA scheme, in…

材料科学 · 物理学 2019-06-05 Muhammad N. Tahir , Xinguo Ren

The finite basis set errors for all-electron random-phase approximation (RPA) correlation energy calculations are analyzed for isolated atomic systems. We show that, within the resolution-of-identity (RI) RPA framework, the major source of…

化学物理 · 物理学 2023-06-21 Hao Peng , Sixian Yang , Hong Jiang , Hongming Weng , Xinguo Ren
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