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Hedin's scheme is solved with the inclusion of the vertex function ($GW\Gamma$) for a set of small molecules. The computational scheme allows for the consistent inclusion of the vertex both at the polarizability level and in the…

Materials Science · Physics 2017-08-17 Emanuele Maggio , Georg Kresse

The $GW$ approximation has become a method of choice for predicting quasiparticle properties in solids and large molecular systems, owing to its favorable accuracy-cost balance. However, its accuracy is the result of a fortuitous…

Chemical Physics · Physics 2026-05-20 Antoine Marie , Pierre-François Loos

Historically, the GW approach was put forward by Hedin as the simplest approximation to the so-called Hedin equations. In Section 2, we will derive these Hedin equations from a Feynman-diagrammatical point of view. Section 3.1 shows how GW…

Materials Science · Physics 2011-09-20 K. Held , C. Taranto , G. Rohringer , A. Toschi

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

Taking the competition and the mutual screening of various bosonic fluctuations in correlated electron systems into account requires an unbiased approach to the many-body problem. One such approach is the self-consistent solution of the…

Strongly Correlated Electrons · Physics 2020-01-01 Friedrich Krien , Angelo Valli

Hedin's $GW$ approximation to the electronic self-energy has been impressively successful to calculate quasiparticle energies, such as ionization potentials, electron affinities, or electronic band structures. The success of this fairly…

Chemical Physics · Physics 2024-10-31 Arno Förster , Fabien Bruneval

Self-consistent vertex corrected GW calculations have been performed to evaluate the equilibrium volume and corresponding bulk modulus of 3d transition metal vanadium. The study demonstrates the feasibility of this approach. The accuracy of…

Strongly Correlated Electrons · Physics 2018-10-10 Andrey L Kutepov

This paper presents a simplified weak Galerkin (WG) finite element method for solving biharmonic equations avoiding the use of traditional stabilizers. The proposed WG method supports both convex and non-convex polytopal elements in finite…

Numerical Analysis · Mathematics 2024-12-17 Chunmei Wang

A new weak Galerkin (WG) finite element method is introduced and analyzed in this paper for the biharmonic equation in its primary form. This method is highly robust and flexible in the element construction by using discontinuous piecewise…

Numerical Analysis · Mathematics 2013-03-06 Lin Mu , Junping Wang , Xiu Ye

We present and implement a parquet approximation within the dual-fermion formalism based on a partial bosonization of the dual vertex function which substantially reduces the computational cost of the calculation. The method relies on…

Strongly Correlated Electrons · Physics 2020-11-19 Friedrich Krien , Angelo Valli , Patrick Chalupa , Massimo Capone , Alexander I. Lichtenstein , Alessandro Toschi

Generalized Hydrodynamics (GHD) has recently been devised as a method to solve the dynamics of integrable quantum many-body systems beyond the mean-field approximation. In its original form, a major limitation is the inability to predict…

The parquet equations present a cornerstone of some of the most important diagrammatic many-body approximations and methods currently on the market for strongly correlated materials: from non-local extensions of the dynamical mean-field…

Strongly Correlated Electrons · Physics 2026-03-16 Aiman Al-Eryani

The GW self-energy method has long been recognized as the gold standard for quasiparticle (QP) calculations of solids in spite of the fact that the neglect of vertex corrections and the use of a DFT starting point lacks rigorous…

Materials Science · Physics 2017-12-06 Per S. Schmidt , Christopher E. Patrick , Kristian S. Thygesen

A new stabilizer free weak Galerkin (WG) method is introduced and analyzed for the biharmonic equation. Stabilizing/penalty terms are often necessary in the finite element formulations with discontinuous approximations to ensure the…

Numerical Analysis · Mathematics 2019-07-23 Xiu Ye , Shangyou Zhang

Hedin's equations provide an elegant route to compute the exact one-body Green's function (or propagator) via the self-consistent iteration of a set of non-linear equations. Its first-order approximation, known as $GW$, corresponds to a…

Chemical Physics · Physics 2025-04-15 Antoine Marie , Pina Romaniello , Pierre-François Loos

We show that the equations underlying the $GW$ approximation have a large number of solutions. This raises the question: which is the physical solution? We provide two theorems which explain why the methods currently in use do, in fact,…

Strongly Correlated Electrons · Physics 2015-09-16 F. Tandetzky , J. K. Dewhurst , S. Sharma , E. K. U. Gross

A new weak Galerkin (WG) finite element method for solving the biharmonic equation in two or three dimensional spaces by using polynomials of reduced order is introduced and analyzed. The WG method is on the use of weak functions and their…

Numerical Analysis · Mathematics 2016-01-27 Ran Zhang , Qilong Zhai

Within many-body perturbation theory, Hedin's formalism offers a systematic way to iteratively compute the self-energy $\Sigma$ of any interacting system, provided one can evaluate the interaction vertex $\Gamma$ exactly. This is however…

Chemical Physics · Physics 2022-11-04 Carlos Mejuto-Zaera , Vojtěch Vlček

The band gaps of a few selected semiconductors/insulators are obtained from the self-consistent solution of the Hedin's equations. Two different schemes to include the vertex corrections are studied: (i) the vertex function of the…

Strongly Correlated Electrons · Physics 2017-05-17 Andrey L. Kutepov

In many-body perturbation theory (MBPT) the self-energy \Sigma=iGW\Gamma plays the key role since it contains all the many body effects of the system. The exact self-energy is not known; as first approximation one can set the vertex…

Strongly Correlated Electrons · Physics 2012-04-23 Pina Romaniello , Friedhelm Bechstedt , Lucia Reining
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