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For homogeneous initial conditions, Hartree (gaussian) dynamical approximations are known to have problems with thermalization, because of insufficient scattering. We attempt to improve on this by writing an arbitrary density matrix as a…

High Energy Physics - Phenomenology · Physics 2009-10-31 M. Salle , J. Smit , J. C. Vink

We present a modification of the $\Delta$SCF method of calculating energies of excited states, in order to make it applicable to resonance calculations of molecules adsorbed on metal surfaces, where the molecular orbitals are highly…

Materials Science · Physics 2009-03-06 Jeppe Gavnholt , Thomas Olsen , Mads Engelund , Jakob Schiøtz

A microscopic model aimed at the description of charge-exchange nuclear excitations along isotopic chains which include open-shell systems, is developed. It consists of quasiparticle random phase approximation (QRPA) made on top of…

Nuclear Theory · Physics 2009-02-18 S. Fracasso , G. Colo`

The collective ground-state correlations stemming from low-lying quadrupole excitations are computed microscopically. To that end, the self-consistent mean-field model is employed on the basis of the Skyrme-Hartre-Fock (SHF) functional…

Nuclear Theory · Physics 2008-11-26 P. Klüpfel , J. Erler , P. --G. Reinhard , J. A. Maruhn

State-specific electronic structure theory provides a route towards balanced excited-state wave functions by exploiting higher-energy stationary points of the electronic energy. Multiconfigurational wave function approximations can describe…

Chemical Physics · Physics 2023-07-19 Antoine Marie , Hugh G. A. Burton

An enhanced static approximation for the electron self energy operator is proposed for efficient calculation of quasiparticle energies. Analysis of the static COHSEX approximation originally proposed by Hedin shows that most of the error…

Materials Science · Physics 2010-11-18 Wei Kang , Mark S. Hybertsen

A self-consistent semi-analytical theory of beam loading in inhomogeneous accelerating structures based on the generalized theory of coupled modes is proposed. A single-mode approximation was used when the fields are represented as a sum of…

Accelerator Physics · Physics 2025-08-19 M. I. Ayzatsky

We have performed a comprehensive study of the singlet ground state of two electrons on the surface of a sphere of radius $R$. We have used electronic structure models ranging from restricted and unrestricted Hartree-Fock theory to…

Other Condensed Matter · Physics 2010-02-19 Pierre-François Loos , Peter M. W. Gill

We present linear response theories in the continuum capable of describing continuum spectra and dynamical correlations of finite systems with no spatial symmetry. Our formulation is essentially the same as the continuum random-phase…

Nuclear Theory · Physics 2007-05-23 Takashi Nakatsukasa , Kazuhiro Yabana

This article examines the time-dependent Hartree-Fock (TDHF) approximation of single-particle dynamics in systems of interacting fermions. We find the TDHF approximation to be accurate when there are sufficiently many particles and the…

Mathematical Physics · Physics 2007-05-23 Claude Bardos , Francois Golse , Alex D. Gottlieb , Norbert J. Mauser

A novel self-consistent implementation of Hedin's GW perturbation theory is introduced. This finite-temperature method uses Hartree-Fock wave functions to represent Green's function. GW equations are solved with full potential linear…

Strongly Correlated Electrons · Physics 2015-05-13 Andrey Kutepov , Sergey Yu. Savrasov , Gabriel Kotliar

In this work we investigate the quantum nature of bcc $^{4}$He. We show that it is a solid phase with an Off-Diagonal Long Range Order of coherently oscillating local electric dipole moments. These dipoles arise from the correlated…

Condensed Matter · Physics 2007-05-23 Nir Gov

We present an ab-initio calculation of the longitudinal electron scattering response function off 4He with two- and three-nucleon forces and compare to experimental data. The full four-body continuum dynamics is considered via the Lorentz…

Nuclear Theory · Physics 2009-06-16 Sonia Bacca , Nir Barnea , Winfried Leidemann , Giuseppina Orlandini

The performance of many-body perturbation theory for calculating ground-state properties is investigated. We present fully numerical results for the electron gas in three and two dimensions in the framework of the GW approximation. The…

Condensed Matter · Physics 2009-10-31 P. Garcia-Gonzalez , R. W. Godby

We formulate the calculation of the ground-state wavefunction and energy of a system of strongly correlated electrons in terms of scattering matrices. A hierarchy of approximations is introduced which results in an incremental expansion of…

Condensed Matter · Physics 2009-10-31 P. Fulde , H. Stoll , K. Kladko

Relativistic Hartree-Fock theory is combined with the Green's function method in coordinate space to study both single-particle bound and resonant states within a unified framework. Within this approach, single-particle resonance energies…

Nuclear Theory · Physics 2026-03-06 Wei Gao , Ting Ting Sun , Wen Hui Long

There is increasing interest in many-body perturbation theory as a practical tool for the calculation of ground-state properties. As a consequence, unambiguous sum rules such as the conservation of particle number under the influence of the…

Materials Science · Physics 2007-05-23 Arno Schindlmayr , P. Garcia-Gonzalez , R. W. Godby

Based on previous works, analytical calculational procedures for dealing with the strongly interacting fermions ground state are further developed through a medium dependent potential in terms of the Bethe-Peierls contact interaction model.…

Statistical Mechanics · Physics 2008-11-26 Ji-sheng Chen , Chuan-ming Cheng , Jia-rong Li , Yan-ping Wang

Some general features of the spectrum of the Hartree-Fock-Bogoliubov equations are examined. Special attention is paid to the asymptotic behavior of the single quasiparticle wave functions (s.qp.w.fs.), matter density distribution and…

Nuclear Theory · Physics 2007-05-23 Aurel Bulgac

We report extensive self-consistent calculations of jellium surface energies, by going beyond the local-density approximation. The density-response function of a bounded free-electron gas is evaluated within the random-phase approximation,…

Materials Science · Physics 2009-10-31 J. M. Pitarke , A. G. Eguiluz
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