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We study the expansion of single-particle and two-particle imaginary-time Matsubara Green's functions of quantum impurity models in the basis of Legendre orthogonal polynomials. We discuss various applications within the dynamical…

Strongly Correlated Electrons · Physics 2015-03-19 Lewin Boehnke , Hartmut Hafermann , Michel Ferrero , Frank Lechermann , Olivier Parcollet

We present a generalization of the discrete Lehmann representation (DLR) to three-point correlation and vertex functions in imaginary time and Matsubara frequency. The representation takes the form of a linear combination of judiciously…

Computational Physics · Physics 2025-03-27 Dominik Kiese , Hugo U. R. Strand , Kun Chen , Nils Wentzell , Olivier Parcollet , Jason Kaye

A technique allowing for a perturbative treatment of nonlocal corrections to the single-site dynamical mean-field theory (DMFT) in finite dimensions is developed. It is based on the observation that in the case of strong electron…

Strongly Correlated Electrons · Physics 2008-06-02 V. I. Tokar , R. Monnier

We present an efficient basis for imaginary time Green's functions based on a low rank decomposition of the spectral Lehmann representation. The basis functions are simply a set of well-chosen exponentials, so the corresponding expansion…

Numerical Analysis · Mathematics 2023-07-31 Jason Kaye , Kun Chen , Olivier Parcollet

The dynamical susceptibility of strongly correlated electronic systems can be calculated within the framework of the dynamical mean-field theory (DMFT). The required measurement of the four-point vertex of the auxiliary impurity model is…

Strongly Correlated Electrons · Physics 2019-06-06 Friedrich Krien

Many-body calculations at the two-particle level require a compact representation of two-particle Green's functions. In this paper, we introduce a sparse sampling scheme in the Matsubara frequency domain as well as a tensor network…

Strongly Correlated Electrons · Physics 2020-01-29 Hiroshi Shinaoka , Dominique Geffroy , Markus Wallerberger , Junya Otsuki , Kazuyoshi Yoshimi , Emanuel Gull , Jan Kuneš

We present a new algorithm which allows for direct numerically exact solutions within dynamical mean-field theory (DMFT). It is based on the established Hirsch-Fye quantum Monte Carlo (HF-QMC) method. However, the DMFT impurity model is…

Strongly Correlated Electrons · Physics 2008-01-09 N. Blümer

We provide a mathematical analysis of the Dynamical Mean-Field Theory, a celebrated representative of a class of approximations in quantum mechanics known as embedding methods. We start by a pedagogical and self-contained mathematical…

Mathematical Physics · Physics 2024-06-06 Éric Cancès , Alfred Kirsch , Solal Perrin-Roussel

The accurate theoretical description of materials with strongly correlated electrons is a formidable challenge in condensed matter physics and computational chemistry. Dynamical Mean Field Theory (DMFT) is a successful approach that…

We present a time-domain iteration scheme for solving the Dynamical Mean-Field Theory (DMFT) self-consistent equations using retarded Green's functions in real time. Unlike conventional DMFT approaches that operate in imaginary time or…

Strongly Correlated Electrons · Physics 2026-01-28 Chakradhar Rangi , Aadi Singh , Ka-Ming Tam

We present an algorithm for solving the self-consistency equations of the dynamical mean-field theory (DMFT) with high precision and efficiency at low temperatures. In each DMFT iteration, the impurity problem is mapped to an auxiliary…

Strongly Correlated Electrons · Physics 2013-06-11 D. Rost , F. Assaad , N. Blümer

Dynamical mean-field theory (DMFT) provides an optimal local approximation for correlated lattice systems by mapping the lattice onto a self-consistent effective impurity model. To account for the missing long-range correlations, we propose…

Strongly Correlated Electrons · Physics 2026-03-04 S. D. Semenov , A. I. Lichtenstein , A. N. Rubtsov

We implement an efficient numerical method to calculate response functions of complex impurities based on the Density Matrix Renormalization Group (DMRG) and use it as the impurity-solver of the Dynamical Mean Field Theory (DMFT). This…

Strongly Correlated Electrons · Physics 2017-11-27 Y. Núñez Fernández , K. Hallberg

Since higher-order tensors are naturally suitable for representing multi-dimensional data in real-world, e.g., color images and videos, low-rank tensor representation has become one of the emerging areas in machine learning and computer…

Computer Vision and Pattern Recognition · Computer Science 2022-12-02 Yisi Luo , Xile Zhao , Zhemin Li , Michael K. Ng , Deyu Meng

We propose real-space renormalized dynamical mean field theory (rr-DMFT) to deal with large clusters in the framework of a cluster extension of the DMFT. In the rr-DMFT, large clusters are decomposed into multiple smaller clusters through a…

Strongly Correlated Electrons · Physics 2016-05-20 Dai Kubota , Shiro Sakai , Masatoshi Imada

Dynamical mean-field theory (DMFT) is a non-perturbative technique for the investigation of correlated electron systems. Its combination with the local density approximation (LDA) has recently led to a material-specific computational scheme…

Strongly Correlated Electrons · Physics 2009-11-10 D. Vollhardt , K. Held , G. Keller , R. Bulla , Th. Pruschke , I. A. Nekrasov , V. I. Anisimov

The simulation of nuclear magnetic resonance (NMR) experiments is a notoriously difficult task, if many spins participate in the dynamics. The recently established dynamic mean-field theory for high-temperature spin systems (spinDMFT)…

Chemical Physics · Physics 2026-02-04 Timo Gräßer , Götz S. Uhrig

We propose a method for estimating smooth real-frequency self-energy in the dynamical mean-field theory with the finite-temperature exact diagonalization (DMFT-ED). One of the benefits of DMFT-ED calculations is that one can obtain…

Strongly Correlated Electrons · Physics 2019-06-10 Yuki Nagai , Hiroshi Shinaoka

In this paper, we present a novel low rank representation (LRR) algorithm for data lying on the manifold of square root densities. Unlike traditional LRR methods which rely on the assumption that the data points are vectors in the Euclidean…

Computer Vision and Pattern Recognition · Computer Science 2015-08-19 Yifan Fu , Junbin Gao , Xia Hong , David Tien

The dynamical mean field theory (DMFT) has become a standard technique for the study of strongly correlated models and materials overcoming some of the limitations of density functional approaches based on local approximations. An important…

Strongly Correlated Electrons · Physics 2015-10-28 K. Hallberg , D. J. García , Pablo S. Cornaglia , Jorge I. Facio , Y. Núñez-Fernández
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