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We present a practical approach to treat static and dynamical correlation accurately in large multi-configurational systems. The static correlation is accounted for using the spin-flip approach which is well known for capturing static…

Strongly Correlated Electrons · Physics 2021-02-08 Oinam Romesh Meitei , Nicholas J. Mayhall

Multi-center transition metal complexes (MCTMs) with magnetically interacting ions have been proposed as components for information processing devices and storage units. For any practical application of MCTMs as magnetic units, it is…

Chemical Physics · Physics 2023-04-03 Henry C. Fitzhugh , James W. Furness , Mark R. Pederson , Juan E. Peralta , Jianwei Sun

It is well known that cellular dynamical mean-field theory (CDMFT) leads to the artificial breaking of translation invariance. In spite of this, it is one of the most successful methods to treat strongly correlated electrons systems. Here,…

Strongly Correlated Electrons · Physics 2020-01-01 S. Verret , J. Roy , A. Foley , M. Charlebois , D. Sénéchal , A. -M. S. Tremblay

The dual boson approach [Ann. Phys. 327, 1320 (2012)] provides a means to construct a diagrammatic expansion around the extended dynamical mean-field theory (EDMFT). In this paper, we present the numerical implementation of the approach and…

Deconfined quantum critical point (DQCP) characterizes the continuous transition beyond Landau-Ginzburg-Wilson paradigm, occurring between two phases that exhibit distinct symmetry breaking. The debate over whether genuine DQCP exists in…

Strongly Correlated Electrons · Physics 2025-11-06 Xuan Zou , Shuai Yin , Zi-Xiang Li , Hong Yao

We present two Diffusion Monte Carlo (DMC) algorithms for systems of ultracold quantum gases featuring synthetic spin-orbit interactions. The first one is a discrete spin generalization of the T- moves spin-orbit DMC, which provides an…

Quantum Gases · Physics 2018-12-05 J. Sanchez-Baena , J. Boronat , F. Mazzanti

In this work, we study the extended Falicov-Kimball model at half-filling within the Hartree-Fock approach (HFA) (for various crystal lattices) and compare the results obtained with the rigorous ones derived within the dynamical mean field…

Strongly Correlated Electrons · Physics 2020-11-17 Konrad Jerzy Kapcia , Romuald Lemański , Marcin Jakub Zygmunt

Recently, a diffusion Monte Carlo algorithm was applied to the study of spin dependent interactions in condensed matter. Following some of the ideas presented therein, and applied to a Hamiltonian containing a Rashba-like interaction, a…

Strongly Correlated Electrons · Physics 2015-05-27 Alberto Ambrosetti , Pier Luigi Silvestrelli , Flavio Toigo , Lubos Mitas , Francesco Pederiva

A generalized version of the fidelity susceptibility of single-band and multi-orbital Hubbard models is systematically studied using single-site dynamical mean-field theory in combination with a hybridization expansion continuous-time…

Strongly Correlated Electrons · Physics 2016-12-08 Li Huang , Yilin Wang , Lei Wang , Philipp Werner

Pseudogap physics in strongly correlated systems is essentially scale dependent. We generalize the dynamical mean field theory (DMFT) by including into the DMFT equations dependence on correlation length of pseudogap fluctuations via…

Strongly Correlated Electrons · Physics 2007-05-23 E. Z. Kuchinskii , I. A. Nekrasov , M. V. Sadovskii

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…

We review the basic ideas of the dynamical mean field theory (DMFT) and some of the insights into the electronic structure of strongly correlated electrons obtained by this method in the context of model Hamiltonians. We then discuss the…

Strongly Correlated Electrons · Physics 2007-05-23 G. Kotliar , S. Y. Savrasov

Strong electronic correlations pose one of the biggest challenges to solid state theory. We review recently developed methods that address this problem by starting with the local, eminently important correlations of dynamical mean field…

Strongly Correlated Electrons · Physics 2018-05-23 G. Rohringer , H. Hafermann , A. Toschi , A. A. Katanin , A. E. Antipov , M. I. Katsnelson , A. I. Lichtenstein , A. N. Rubtsov , K. Held

We present a systematic and reliable methodology, termed hierarchical mean-field theory (HMFT), to study and predict the behavior of strongly coupled many-particle systems. HMFT is a simple approximation, based upon group theoretical…

Strongly Correlated Electrons · Physics 2007-05-23 Gerardo Ortiz , Cristian D. Batista

We study the influence of short-range quantum correlations and classical spatial correlations on the phase diagram of the dissipative XYZ model by using a Gutzwiller Monte carlo method and a cluster Gutzwiller ansatz for the wave function.…

Statistical Mechanics · Physics 2019-05-08 Dolf Huybrechts , Michiel Wouters

An overarching question in strongly correlated electron systems is how the landscape of quantum phases emerges from electron correlations. The method of extended dynamical mean field theory (EDMFT) has been developed for clean lattice…

Strongly Correlated Electrons · Physics 2022-10-26 Haoyu Hu , Lei Chen , Qimiao Si

Attempts to go beyond the local density approximation (LDA) of Density Functional Theory (DFT) have been increasingly based on the incorporation of more realistic Coulomb interactions. In their earliest implementations, methods like…

Strongly Correlated Electrons · Physics 2009-11-13 Jean-Pierre Julien , Jian-Xin Zhu , Robert C. Albers

We explore the use of exact diagonalization methods for solving the self consistent equations of the cellular dynamical mean field theory (CDMFT) for the one dimensional regular and extended Hubbard models. We investigate the nature of the…

Strongly Correlated Electrons · Physics 2007-05-23 C. J. Bolech , S. S. Kancharla , G. Kotliar

Full charge self-consistence (CSC) over the electron density has been implemented into the local density approximation plus dynamical mean-field theory (LDA+DMFT) scheme based on a full-potential linear muffin-tin orbital method (FP-LMTO).…

Strongly Correlated Electrons · Physics 2014-08-07 O. Grånäs , I. Di Marco , P. Thunström , L Nordström , O. Eriksson , T. Björkman , J. M. Wills

We generalize the dynamical-mean field (DMFT) approximation by including into the DMFT equations some length scale via a (momentum dependent) ``external'' self-energy \Sigma_k. This external self-energy describes non-local dynamical…

Strongly Correlated Electrons · Physics 2007-08-29 M. V. Sadovskii , I. A. Nekrasov , E. Z. Kuchinskii , Th. Pruschke , V. I. Anisimov
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