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In this work we explore the performance of approximations to electron correlation in reduced density-matrix functional theory (RDMFT) and of approximations to the observables calculated within this theory. Our analysis focuses on the…

Strongly Correlated Electrons · Physics 2015-02-26 Stefano Di Sabatino , Jan A. Berger , Lucia Reining , Pina Romaniello

Using quasiparticle self-consistent $GW$ calculations, we re-examined the electronic structure of Sr$_2$RuO$_4$ and SrRuO$_3$. Our calculations show that the correlation effects beyond the conventional LDA (local density approximation) and…

Strongly Correlated Electrons · Physics 2016-02-16 Hyeonsang Ryee , Seung Woo Jang , Hiori Kino , Takao Kotani , Myung Joon Han

A method for deriving quantum kinetic equations with initial correlations is developed on the basis of the nonequilibrium Green's function formalism. The method is applicable to a wide range of correlated initial states described by…

Statistical Mechanics · Physics 2009-10-31 V. G. Morozov , G. Röpke

We develop a second order correction to commonly used density functional approximations (DFA) to eliminate the systematic delocalization error. The method, based on the previously developed global scaling correction (GSC), is an exact…

Chemical Physics · Physics 2021-07-22 Yuncai Mei , Zehua Chen , Weitao Yang

We use the functional renormalization group (FRG) to derive analytical expressions for thermodynamic observables (density, pressure, entropy, and compressibility) as well as for single-particle properties (wavefunction renormalization and…

Quantum Gases · Physics 2017-01-19 Jan Krieg , Dominik Strassel , Simon Streib , Sebastian Eggert , Peter Kopietz

An approach is presented which allows a self-consistent description of the fragmentation of single-particle strength for nucleons in finite nuclei employing the Greens function formalism. The self-energy to be considered in the Dyson…

Nuclear Theory · Physics 2009-10-22 H. Müther , L. D. Skouras

The paper is an attempt to relate two vast areas of the applicability of the renormalization group (RG): field theoretic models and partial differential equations. It is shown that the Green function of a nonlinear diffusion equation can be…

Chaotic Dynamics · Physics 2008-12-18 N. V. Antonov , Juha Honkonen

We develop a stochastic resolution of identity approach to the real-time second-order Green's function (real-time sRI-GF2) theory, extending our recent work for imaginary-time Matsubara Green's function {\em J. Chem. Phys.} {\bf 151},…

Chemical Physics · Physics 2019-09-17 Wenjie Dou , Tyler Y. Takeshita , Ming Chen , Roi Baer , Daniel Neuhauser , Eran Rabani

A new method for non-perturbative calculation of Green functions in quantum mechanics and quantum field theory is proposed. The method is based on an approximation of Schwinger-Dyson equation for the generating functional by exactly soluble…

High Energy Physics - Theory · Physics 2008-11-26 V. E. Rochev

We propose a simple additive approach to simulate X-ray photoelectron spectra (XPS) of macromolecules based on the $GW$ method. Single-shot $GW$ ($G_0W_0$) is a promising technique to compute accurate core-electron binding energies (BEs).…

We compute the low energy threshold corrections to neutrino masses and mixing in the Standard Model (SM) and its minimal supersymmetric version, using the effective theory technique. We demonstrate that they stabilize the renormalization…

High Energy Physics - Phenomenology · Physics 2011-09-13 P. H. Chankowski , P. Wasowicz

A novel approach for GW-based calculations of quasiparticle properties for finite systems is presented, in which the screened interaction is obtained directly from a linear response calculation of the density-density correlation function.…

Strongly Correlated Electrons · Physics 2015-05-13 George Pal , Yaroslav Pavlyukh , Hans Christian Schneider , Wolfgang Huebner

The vertex function ($\Gamma$) within the Green's function formalism encapsulates information about all higher-order electron-electron interaction beyond those mediated by density fluctuations. Herein, we present an efficient approach that…

Chemical Physics · Physics 2023-03-28 Guorong Weng , Rushil Mallarapu , Vojtech Vlcek

A Green's function approach to the inclusive quasielastic ($e,e'$) scattering is presented. The components of the nuclear response are written in terms of the single-particle optical model Green's function. The explicit calculation of the…

Nuclear Theory · Physics 2007-05-23 F. Capuzzi , C. Giusti , A. Meucci , F. D. Pacati

The electron Green's functions $G({\bf k},\omega)$ within the t-J model and in the regime of intermediate doping is studied analytically using equations of motion for projected fermionic operators and the decoupling of the self energy into…

Strongly Correlated Electrons · Physics 2009-10-28 Peter Prelovsek

Measurement of particle emission source is a fundamental objective of femtoscopy in high-energy nuclear collisions. Conventional analyses rely on Gaussian parameterizations of pair emission sources, which makes the extraction of…

High Energy Physics - Phenomenology · Physics 2026-05-26 Liang Zhang , Song Zhang , Kai-Jia Sun , Yu-Gang Ma

The GW approach produces highly accurate quasiparticle energies, but its application to large systems is computationally challenging, which can be largely attributed to the difficulty in computing the inverse dielectric matrix. To address…

Materials Science · Physics 2023-07-26 Mario G. Zauchner , Andrew Horsfield , Johannes Lischner

The second-order Matsubara Green's function method (GF2) is a robust temperature dependent quantum chemistry approach, extending beyond the random-phase approximation. However, till now the scope of GF2 applications was quite limited as…

Chemical Physics · Physics 2017-09-20 Daniel Neuhauser , Roi Baer , Dominika Zgid

We provide an integration of the universal, perturbative explicitly correlated [2]$_\text{R12}$-correction in the context of the Variational Quantum Eigensolver (VQE). This approach is able to increase the accuracy of the underlying…

Quantum Physics · Physics 2022-07-08 Philipp Schleich , Jakob S. Kottmann , Alán Aspuru-Guzik

In this paper, we propose a generic and systematic approach for study of the electronic structure for atoms or molecules. In particular, we address the issue of single particle states, or orbitals, which should be one of the most important…

Chemical Physics · Physics 2007-05-23 Liqiang Wei
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