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Related papers: Enhancements to the GW space-time method

200 papers

In the nonequilibrium Green's function approach, the approximation of the correlation self-energy at the second-Born level is of particular interest, since it allows for a maximal speed-up in computational scaling when used together with…

Computational Physics · Physics 2019-11-11 Riku Tuovinen , Fabio Covito , Michael A. Sentef

One-body Green's function theories implemented on the real frequency axis offer a natural formalism for the unbiased theoretical determination of quasiparticle spectra in molecules and solids. Self-consistent Green's function methods…

Computational Physics · Physics 2015-05-22 Alicia Rae Welden , Jordan J. Phillips , Dominika Zgid

Evaluating the total energy of an extended distribution of point charges, which interact through the Coulomb potential, is central to the study of condensed matter. With near ubiquity, the summation required is carried out using Ewald's…

Materials Science · Physics 2018-01-24 Chris J. Pickard

We show that Green function methods can be straightforwardly applied to nonlinear equations appearing as the leading order of a short time expansion. Higher order corrections can be then computed giving a satisfactory agreement with…

High Energy Physics - Theory · Physics 2008-11-26 Marco Frasca

We present a general procedure for obtaining progressively more accurate functional expressions for the electron self-energy by iterative solution of Hedin's coupled equations. The iterative process starting from Hartree theory, which gives…

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

Numerical projection methods are elaborated for the calculation of eigenstates of the non-relativistic many-particle Coulomb Hamiltonian with selected rotational and parity quantum numbers employing shifted explicitly correlated Gaussian…

Chemical Physics · Physics 2019-05-24 Andrea Muolo , Edit Mátyus , Markus Reiher

We provide a scheme for efficient simulation of a broad class of quantum optics experiments. Our efficient simulation extends the continuous variable Gottesman-Knill theorem to a large class of non-Gaussian mixed states, thereby identifying…

Quantum Physics · Physics 2013-02-19 Victor Veitch , Nathan Wiebe , Christopher Ferrie , Joseph Emerson

Full-potential electronic structure calculations for periodic systems retain the Coulomb singularity at the nuclei, which induces cusp behavior of the orbitals near the nuclei while leaving the interstitial region smooth. This multiscale…

Numerical Analysis · Mathematics 2026-05-26 Baowei Lai , Xucheng Meng , Xiaoxu Li

I review the application of self-consistent Green's functions methods to study the properties of infinite nuclear systems. Improvements over the last decade, including the consistent treatment of three-nucleon forces and the development of…

Nuclear Theory · Physics 2020-06-19 A. Rios

Relativistic formalism of Green's functions is dicussed in QCD and QED,where the relativistic Green's functions are constructed using the Schwinger proper time formalism and the Fock-Feynman-Schwinger method.As a result a simple and exact…

High Energy Physics - Phenomenology · Physics 2019-06-05 Yu. A. Simonov

In the present manuscript the basic Einstein--Hilbert cosmological model is extended, by adding a new functional $F(G, T_{\mu\nu}T^{\mu\nu})$ in the fundamental action, encoding specific geometrical effects due to a nontrivial coupling with…

General Relativity and Quantum Cosmology · Physics 2023-05-23 Mihai Marciu , Dana Maria Ioan

A new formalism is presented for high-energy analysis of the Green function for Fokker-Planck and Schr\"odinger equations in one dimension. Formulas for the asymptotic expansion in powers of the inverse wave number are derived, and…

Mathematical Physics · Physics 2011-12-30 Toru Miyazawa

It has been shown that an improved estimation of quantum vacuum energy can yield not only acceptable but also experimentally sensible results. The very idea consists in a straightforward extraction of gravitationally interacting part of the…

General Relativity and Quantum Cosmology · Physics 2008-12-29 Bogusław Broda , Piotr Bronowski , Marcin Ostrowski , Michał Szanecki

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

The $GW$ approximation has recently gained increasing attention as a viable method for the computation of deep core-level binding energies as measured by X-ray photoelectron spectroscopy (XPS). We present a comprehensive benchmark study of…

Chemical Physics · Physics 2022-06-14 Jiachen Li , Ye Jin , Patrick Rinke , Weitao Yang , Dorothea Golze

The one-particle Green function of a many-electron system is traditionally formulated within the self-energy picture. A different formalism was recently proposed, in which the self-energy is replaced by a dynamical exchange-correlation…

Strongly Correlated Electrons · Physics 2025-05-27 F. Aryasetiawan

We develop the reconstruction program for the number of modified gravities: scalar-tensor theory, $f(R)$, $F(G)$ and string-inspired, scalar-Gauss-Bonnet gravity. The known (classical) universe expansion history is used for the explicit and…

High Energy Physics - Theory · Physics 2010-04-06 Shin'ichi Nojiri , Sergei D. Odintsov

Accurate time-dependent quantum dynamics of Coulombic systems on grid-based representations remains computationally demanding due to the singularity of the Coulomb potential, which necessitates extremely fine spatial grids to mitigate…

Quantum Physics · Physics 2026-03-04 Xiaoning Feng , Hans Hon Sang Chan , David P. Tew

Electron correlation in finite and extended systems is often described in an effective single-particle framework within the $GW$ approximation. Here, we use the statically screened second-order exchange contribution to the self-energy…

Chemical Physics · Physics 2022-03-18 Arno Förster , Lucas Visscher

We apply the quasiparticle self-consistent GW method (QSGW) to slab models of ionic materials, LiF, KF, NaCl, MgO, and CaO, under electric field. Then we obtain the optical dielectric constants E(Slab) from the differences of the slopes of…

Strongly Correlated Electrons · Physics 2020-05-20 Hirofumi Sakakibara , Takao Kotani , Masao Obata , Tatsuki Oda