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The self consistent version of the density functional theory (DFT) is presented, which allows to calculate the ground state and dynamic properties of finite multi-electron systems such as atoms, molecules and clusters. The exact functional…

Condensed Matter · Physics 2007-05-23 M. Ya. Amusia , V. R. Shaginyan

We present a nonlocal statistical field theory of a diluted solution of dipolar particles which are capable of forming chain-like clusters in accordance with the 'head-to-tail' mechanism. As in our previous study [Yu.A. Budkov 2018 J.…

Soft Condensed Matter · Physics 2019-03-26 Yu. A. Budkov

Using the Kadanoff-Baym-Keldysh formalism, we employ nonequilibrium dynamical mean-field theory to exactly solve for the nonlinear response of an electron-mediated charge-density-wave-ordered material. We examine both the dc current and the…

Strongly Correlated Electrons · Physics 2016-01-20 O. P. Matveev , A. M. Shvaika , T. P. Devereaux , J. K. Freericks

We study dynamical properties of the one- and two-dimensional Falicov-Kimball model using lattice Monte Carlo simulations. In particular, we calculate the spreading of charge correlations in the equilibrium model and after an interaction…

Strongly Correlated Electrons · Physics 2018-04-11 Andreas J. Herrmann , Andrey E. Antipov , Philipp Werner

The general approach for the description of correlated hopping in the Dynamical Mean-Field Theory which is based on the expansion over electron hopping around the atomic limit is developed. It is formulated in terms of the local irreducible…

Strongly Correlated Electrons · Physics 2015-06-24 A. M. Shvaika

We develop a variational perturbation expansion around dynamical mean-field theory (DMFT) that systematically incorporates nonlocal correlations beyond the local correlations treated by DMFT. We apply this approach to investigate how the…

Strongly Correlated Electrons · Physics 2025-10-24 Yueyi Wang , Kristjan Haule

We analyze cellular dynamical mean-field theory (CDMFT) and the dynamical cluster approximation (DCA). We derive exact sum-rules for the hybridization functions and give examples for DMFT, CDMFT, and DCA. For impurity solvers based on a…

Strongly Correlated Electrons · Physics 2008-09-03 Erik Koch , Giorgio Sangiovanni , Olle Gunnarsson

The formation and condensation of excitonic bound states of conduction-band electrons and valence-band holes surely belongs to one of the most exciting ideas of contemporary solid state physics. In this short review we present the latest…

Strongly Correlated Electrons · Physics 2021-01-19 P. Farkašovský

The extended Falicov-Kimball model is analyzed exactly for finite temperatures ($T\geq0$) in the limit of large dimensions. Onsite and intersite density-density interactions $U$ and $V$ are included in the model. Using the dynamical mean…

Strongly Correlated Electrons · Physics 2019-06-26 Konrad Jerzy Kapcia , Romuald Lemański , Stanisław Robaszkiewicz

The typical medium dynamical cluster approximation (TMDCA) is reformulated in the language of multiple scattering theory to make possible first principles calculations of the electronic structure of substitutionally disordered alloys…

Disordered Systems and Neural Networks · Physics 2017-04-28 H. Terletska , Y. Zhang , L. Chioncel , D. Vollhardt , M. Jarrell

Many of the fascinating and unconventional properties of several transition-metal compounds with partially filled d-shells are due to strong electronic correlations. While local correlations are in principle treated exactly within the frame…

Strongly Correlated Electrons · Physics 2017-07-13 F. Lechermann , A. I. Lichtenstein , M. Potthoff

We propose a hybrid approach which employs the dynamical mean-field theory (DMFT) self-energy for the correlated, typically rather localized orbitals and a conventional density functional theory (DFT) exchange-correlation potential for the…

Strongly Correlated Electrons · Physics 2021-06-16 Sumanta Bhandary , Karsten Held

Reduced density-matrix functional theory (RDMFT) provides a variational route to electronic correlations beyond conventional density-functional approximations, but explicit evaluations of density-matrix functionals still scale exponentially…

Chemical Physics · Physics 2026-05-19 Konstantin Tamoev , Robert Schade , Thomas D. Kühne

We extend the single-site coherent potential approximation (CPA) to include the effects of non-local disorder correlations (alloy short-range order) on the electronic structure of random alloy systems. This is achieved by mapping the…

Strongly Correlated Electrons · Physics 2009-11-10 M. S. Laad , L. Craco

The effect of Coulomb correlations in the half-filled Hubbard model of the honeycomb lattice is studied within the dynamical cluster approximation (DCA) combined with exact diagonalization (ED) and continuous-time quantum Monte Carlo (QMC).…

Strongly Correlated Electrons · Physics 2015-06-15 Ansgar Liebsch , Wei Wu

We simulate the dynamical spin structure factor (DSSF) $\mathcal{S}({q},\omega)$ of the spin-1/2 Heisenberg antiferromagnetic chain using classical simulations. By employing Landau-Lifshitz Dynamics, we emulate quantum correlations through…

Strongly Correlated Electrons · Physics 2026-01-15 Chaebin Kim , Martin Mourigal

We first give a short review of the ``local-current approximation'' (LCA), derived from a general variation principle, which serves as a semiclassical description of strongly collective excitations in finite fermion systems starting from…

Atomic and Molecular Clusters · Physics 2008-11-26 M. Brack , P. Winkler , M. V. N. Murthy

The description of realistic strongly correlated systems has recently advanced through the combination of density functional theory in the local density approximation (LDA) and dynamical mean field theory (DMFT). This LDA+DMFT method is…

Strongly Correlated Electrons · Physics 2009-11-13 B. Amadon , F. Lechermann , A. Georges , F. Jollet , T. O. Wehling , A. I. Lichtenstein

When spatial correlations are short-range, the physics of strongly correlated systems is controlled by local quantum fluctuations. In those regimes, Dynamical Mean-Field Theory can be viewed as a `compass' which provides guidance on the…

Strongly Correlated Electrons · Physics 2015-06-03 Antoine Georges

We propose a self-consistent method for electronic structure calculations of correlated systems, which combines the local spin-density approximation (LSDA) and the dynamical mean field theory (DMFT). The LSDA part is based on the exact…

Strongly Correlated Electrons · Physics 2007-05-23 L. Chioncel , L. Vitos , I. A. Abrikosov , J. Kollar , M. I. Katsnelson , A. I. Lichtenstein