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We showcase the advantages of orbital-free density-potential functional theory (DPFT), a more flexible variant of Hohenberg-Kohn density functional theory. DPFT resolves the usual trouble with the gradient-expanded kinetic energy functional…

Quantum Gases · Physics 2021-06-16 Martin-Isbjörn Trappe , Jun Hao Hue , Berthold-Georg Englert

We review two analytical approaches in Dynamical Mean-Field Theory (DMFT) based on a perturbation theory expansion over the electron hopping to and from the self consistent environment. In the first approach the effective single impurity…

Strongly Correlated Electrons · Physics 2007-05-23 I. V. Stasyuk , A. M. Shvaika

It has been shown that the Schwinger-Dyson equations for non-Hermitian theories implicitly include the Hilbert-space metric. Approximate Green functions for such theories may thus be obtained, without having to evaluate the metric…

High Energy Physics - Theory · Physics 2015-05-18 H. F. Jones

We present an embedding scheme for periodic systems that facilitates the treatment of the physically important part (here the unit cell) with advanced electronic-structure methods, that are computationally too expensive for periodic…

Materials Science · Physics 2016-04-08 Wael Chibani , Xinguo Ren , Matthias Scheffler , Patrick Rinke

Nonlocal correlations play an essential role in correlated electron systems, especially in the vicinity of phase transitions and crossovers, where two-particle correlation functions display a distinct momentum dependence. In nonequilibrium…

Strongly Correlated Electrons · Physics 2023-06-29 Olivier Simard , Philipp Werner

The Euclidian thermal Green function of the two-dimensional (2D) free massless scalar field in coordinate space is written as the real part of a complex analytic function of a variable that conformally maps the infinite strip…

High Energy Physics - Theory · Physics 2008-11-26 Leonardo Mondaini , E. C. Marino

We investigate the role of non-local correlations in LiFeAs by exploring an ab-initio-derived multi-orbital Hubbard model for LiFeAs via the Two-Particle Self-Consistent (TPSC) approach. The multi-orbital formulation of TPSC approximates…

Strongly Correlated Electrons · Physics 2020-10-26 Karim Zantout , Steffen Backes , Roser Valentí

The Green's function has been an indispensable tool to study many-body systems that remain one of the biggest challenges in modern quantum physics for decades. The complicated calculation of Green's function impedes the research of…

Quantum Physics · Physics 2022-05-04 Jie Zhu , Yuya O. Nakagawa , Chuan-Feng Li , Guang-Can Guo , Yong-Sheng Zhang

The extension of the density functional theory (DFT) to include pairing correlations without formal violation of the particle-number conservation condition is described. This version of the theory can be considered as a foundation of the…

Nuclear Theory · Physics 2007-05-23 S. Krewald , V. B. Soubbotin , V. I. Tselyaev , X. Vinas

Simulating the dynamics of quantum impurity models remains a fundamental challenge due to the complex memory effects that arise from system-environment interactions. Of particular interest are two-time correlation functions of an impurity,…

Quantum Physics · Physics 2025-10-31 David J. Strachan , Archak Purkayastha , Stephen R. Clark

We discuss the renormalizability of the massless Thirring model in terms of the causal fermion Green functions and correlation functions of left-right fermion densities. We obtain the most general expressions for the causal two-point Green…

High Energy Physics - Theory · Physics 2009-11-11 H. Bozkaya , A. N. Ivanov , M. Pitschmann

The nonequilibrium dynamics of strongly-correlated fermions in lattice systems have attracted considerable interest in the condensed matter and ultracold atomic-gas communities. While experiments have made remarkable progress in recent…

Strongly Correlated Electrons · Physics 2017-05-03 N. Schluenzen , J. -P. Joost , F. Heidrich-Meisner , M. Bonitz

We improved the decoupling approximation of the double-time Green's function theory, and applied it to study the spin-${1\over 2}$ two-dimensional antiferromagnetic Heisenberg model with broken bonds at finite temperature. Our decoupling…

Strongly Correlated Electrons · Physics 2009-10-31 Yun Song , H. Q. Lin , Jue-Lian Shen

Using the triangular-lattice extended Hubbard model as a test system, we compare $GW$+EDMFT results for the recently proposed self-consistency scheme with causal auxiliary fields to those obtained from the standard implementation which…

Strongly Correlated Electrons · Physics 2024-11-06 Jiyu Chen , Francesco Petocchi , Philipp Werner

We develop a general theory of a boson decomposition for both local and non-local interactions in lattice fermion models which allows us to describe fermionic degrees of freedom and collective charge and spin excitations on equal footing.…

Strongly Correlated Electrons · Physics 2015-05-28 A. N. Rubtsov , M. I. Katsnelson , A. I. Lichtenstein

We present a purely diagrammatic derivation of the dual fermion scheme [Phys. Rev. B 77 (2008) 033101]. The derivation makes particularly clear that a similar scheme can be developed for an arbitrary reference system provided it has the…

Strongly Correlated Electrons · Physics 2020-10-28 Sergey Brener , Evgeny A. Stepanov , Alexey N. Rubtsov , Mikhail I. Katsnelson , Alexander I. Lichtenstein

We study a proof-of-principle example of the recently proposed hybrid quantum-classical simulation of strongly correlated fermion models in the thermodynamic limit. In a "two-site" dynamical mean-field theory (DMFT) approach we reduce the…

The recently introduced coupled cluster (CC) downfolding techniques for reducing the dimensionality of quantum many-body problems recast the CC formalism in the form of the renormalization procedure allowing, for the construction of…

Quantum Physics · Physics 2021-11-08 Nicholas P. Bauman , Karol Kowalski

The calculation of dynamic response functions is expected to be an early application benefiting from rapidly developing quantum hardware resources. The ability to calculate real-time quantities of strongly-correlated quantum systems is one…

Density-potential functional theory (DPFT) is an alternative formulation of orbital-free density functional theory that may be suitable for modeling the electronic structure of large systems. To date, DPFT has been applied mainly to quantum…

Materials Science · Physics 2023-04-21 Martin-Isbjörn Trappe , William C. Witt , Sergei Manzhos