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We present a real-time second-order Green's function (GF) method for computing excited states in molecules and nanostructures, with a computational scaling of $O(N_{\rm e}^3$), where $N_{\rm e}$ is the number of electrons. The cubic scaling…

Chemical Physics · Physics 2024-01-29 Leopoldo Mejía , Jia Yin , David R. Reichman , Roi Baer , Chao Yang , Eran Rabani

A new perturbational approach to spectral and thermal properties of strongly correlated electron systems is presented: The Anderson model is reexamined for $U\to\infty$\,, and it is shown that an expansion of Green's functions with respect…

Condensed Matter · Physics 2009-10-22 Jan Brinckmann

We report an exhaustive study of the performance of different variants of Green function methods for the spherium model in which two electrons are confined to the surface of a sphere and interact via a genuine long-range Coulomb operator.…

Chemical Physics · Physics 2018-07-23 Pierre-François Loos , Pina Romaniello , J. A. Berger

We present an implementation and analysis of a stochastic high performance algorithm to calculate the correlation energy of three dimensional periodic systems in second-order M{\o}ller-Plesset perturbation theory (MP2). In particular we…

Chemical Physics · Physics 2018-02-12 Tobias Schäfer , Benjamin Ramberger , Georg Kresse

In this work, the theory of second gradient electrodynamics, which is an important example of generalized electrodynamics, is proposed and investigated. Second gradient electrodynamics is a gradient field theory with up to second-order…

Classical Physics · Physics 2020-05-13 Markus Lazar

We investigate phase transitions in scalar field theories using the functional renormalization group (RG) equation. We analyze a system with $U(2)\times U(2)$ symmetry, in which there is a parameter $\lambda_2$ that controls the strength of…

High Energy Physics - Phenomenology · Physics 2023-03-27 Kenji Fukushima , Kazuhiko Kamikado , Bertram Klein

The Wilsonian renormalisation group is applied to a system of two nonrelativistic particles interacting via short-range forces and coupled to an external EM field. By demanding that a fully off-shell one-particle-irreducible 5-point…

Nuclear Theory · Physics 2019-01-30 A. N. Kvinikhidze , M. C. Birse

We derive an expansion of the functional renormalization (fRG) equations that treats the frequency and momentum dependencies of the vertices in a systematic manner. The scheme extends the channel-decomposed fRG equations to the frequency…

Strongly Correlated Electrons · Physics 2021-07-07 Nahom K. Yirga , David K. Campbell

A non-perturbative method which can go beyond the weak coupling perturbation theory is introduced. Essential idea is to formulate a set of exact differential equations as a function of the coupling strength $g$. Unlike other resummation in…

Quantum Physics · Physics 2011-03-21 Tomoya Hayata

In a previous paper it was shown how to calculate the ground-state energy density $E$ and the $p$-point Green's functions $G_p(x_1,x_2,...,x_p)$ for the $PT$-symmetric quantum field theory defined by the Hamiltonian density…

High Energy Physics - Theory · Physics 2021-10-13 Alexander Felski , Carl M. Bender , S. P. Klevansky , Sarben Sarkar

We show how to construct an effective Hamiltonian whose dimension scales linearly with system size, and whose eigenvalues systematically approximate the excitation energies of GW theory. This is achieved by rigorously expanding the…

Chemical Physics · Physics 2023-07-18 Charles J. C. Scott , Oliver J. Backhouse , George H. Booth

We suggest a version of renormalizable Quantum Field Theory which does not contain non-perturbative effects. This is otained by the proper use of the boundary conditions in the functional integral of the generating functional of Green…

General Physics · Physics 2024-12-17 S. A. Larin

The perturbation method is an approximation scheme with a solvable leading order. The standard way is to choose a non-interacting sector for the leading order. The adaptive perturbation method improves the solvable part by using all…

High Energy Physics - Theory · Physics 2022-10-17 Chen-Te Ma

Using generalizations of natural orbitals, spin-averaged natural orbitals, and two-particle charge correlators for solids, we investigate electronic structure of antiferromagnetic transition-metal oxides with a fully self-consistent,…

Strongly Correlated Electrons · Physics 2024-02-07 Pavel Pokhilko , Dominika Zgid

We propose new approach for treatment of local and non-local interactions in correlated electronic systems, which uses self-energy and the two-particle irreducible vertices, obtained from (extended) dynamical mean-field theory, as an input…

Strongly Correlated Electrons · Physics 2019-03-12 A. A. Katanin

Despite its reasonable accuracy for ground-state properties of semiconductors and insulators, second-order Moller-Plesset perturbation theory (MP2) significantly underestimates band gaps. Here, we evaluate the band gap predictions of…

Materials Science · Physics 2021-09-15 Malte F. Lange , Timothy C. Berkelbach

We present an implementation of a fully self-consistent finite temperature second order Green's function perturbation theory (GF2) within the diagrammatic Monte Carlo framework. In contrast to the previous implementations of stochastic GF2…

Chemical Physics · Physics 2020-09-22 Blair Winograd , Emanuel Gull , Dominika Zgid

The non-commutative version of the euclidean $g^2\phi^4$ theory is considered. By using Wilsonian flow equations the ultraviolet renormalizability can be proved to all orders in perturbation theory. On the other hand, the infrared sector…

High Energy Physics - Theory · Physics 2009-11-07 Luca Griguolo , Massimo Pietroni

By introducing multipe-site correlation functions, we propose a hierarchical Green function approach, and apply it to study the characteristic properties of a 2D square lattice Hubbard model by solving the equation of motions of a…

Strongly Correlated Electrons · Physics 2018-09-26 Yu-Liang Liu

Due to non-linear structure, iterative Green's function methods can result in multiple different solutions even for simple molecular systems. In contrast to the wave-function methods, a detailed and careful analysis of such molecular…

Chemical Physics · Physics 2021-08-24 Pavel Pokhilko , Dominika Zgid