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In the spirit of recently developed LDA+U and LDA+DMFT methods we implement a combination of density functional theory in its local density approximation (LDA) with a $k$- and $\omega -$dependent self-energy found from diagrammatic…

Strongly Correlated Electrons · Physics 2018-04-17 Sergey Y. Savrasov , Giacomo Resta , Xiangang Wan

A new variational method is developed to calculate the ground state energy of Fermi systems with strong short-range correlations. A trial wave function of Gutzwiller's type contains additional variational parameters corresponding to…

Strongly Correlated Electrons · Physics 2009-09-25 Yu. B. Kudasov

We calculate the local correlation functions of charge and spin for the one-chain and two-chain Hubbard model using the density matrix renormalization group method and the recursion technique. Keeping only finite number of states we get…

Strongly Correlated Electrons · Physics 2009-10-31 Youngho Park , Shoudan Liang

A novel effective Hamiltonian in the subspace of singly occupied states is obtained by applying the Gutzwiller projection approach to a generalized Hubbard model with the interactions between two nearest- neighbor sites. This model provides…

Strongly Correlated Electrons · Physics 2017-03-27 Tao Sun

We investigate the ground-state properties of the two-dimensional Hubbard model, based on the off-diagonal wave function variational Monte Carlo method. We use an optimized wave function that is improved from an initial one-body wave…

Strongly Correlated Electrons · Physics 2025-07-08 Takashi Yanagisawa

The insulating state of matter is characterized by the excitation spectrum, but also by qualitative features of the electronic ground state. The insulating ground wavefunction in fact: (i) sustains macroscopic polarization, and (ii) is…

Materials Science · Physics 2009-10-31 R. Resta , S. Sorella

Multideterminant calculations have been performed on model systems to emphasize the role of many-body effects in the general description of charge quantization experiments. We show numerically and derive analytically that a closed-shell…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 V. Geskin , R. Stadler , J. Cornil

Direct approaches to the quantum many-body problem suffer from the so-called "curse of dimensionality": the number of parameters needed to fully specify the exact wavefunction grows exponentially with increasing system size. This motivates…

Quantum Physics · Physics 2023-04-21 Valerii Chuiko , Paul W. Ayers

We formulate a multi-band generalisation of the time-dependent Gutzwiller theory. This approach allows for the calculation of general two-particle response functions, which are crucial for an understanding of various experiments in…

Strongly Correlated Electrons · Physics 2015-03-19 E. v. Oelsen , G. Seibold , J. Bünemann

We show that the Gutzwiller variational wave function is surprisingly accurate for the computation of magnetic phase boundaries in the infinite dimensional Hubbard model. This allows us to substantially extend known phase diagrams. For both…

Strongly Correlated Electrons · Physics 2008-06-16 F. Günther , G. Seibold , J. Lorenzana

We analyze the Mott transition in multi-band Hubbard models with the inclusion of multiplet exchange splittings as it arises in infinite dimensions by using the generalized Gutzwiller wave-function introduced by B\"unemann, Weber and…

Strongly Correlated Electrons · Physics 2009-11-10 Claudio Attaccalite , Michele Fabrizio

Elucidating the impact of strong electronic interactions on the collective excitations of metallic systems has been of longstanding interest, mainly due to the inadequacy of the random phase approximation (RPA) in the strongly correlated…

Strongly Correlated Electrons · Physics 2024-09-25 Loïc Philoxene , Vu Hung Dao , Raymond Frésard

We present a fully self-consistent combined GW and dynamical mean field (GW+DMFT) study of the spectral properties of the extended two-dimensional Hubbard model. The inclusion of the local dynamical vertex stemming from the DMFT self-energy…

Strongly Correlated Electrons · Physics 2013-01-22 Thomas Ayral , Philipp Werner , Silke Biermann

This paper has its motivation in the study of the Fractional Quantum Hall Effect. We consider 2D quantum particles submitted to a strong perpendicular magnetic field, reducing admissible wave functions to those of the Lowest Landau Level.…

Quantum Gases · Physics 2014-12-15 Nicolas Rougerie , Jakob Yngvason

Although effective for two dimensional (2D) systems, some approximations may fail in describing the properties of one-dimensional (1D) models, which belong to a different universality class. In this paper, we analyze the adequacy of the…

Strongly Correlated Electrons · Physics 2007-05-23 Adolfo Avella , Ferdinando Mancini , Maria del Mar Sanchez-Lopez

In this work we give a comprehensive derivation of an exact and numerically feasible method to perform ab-initio calculations of quantum particles interacting with a quantized electromagnetic field. We present a hierachy of…

We investigate the extended Hubbard model as an approximation to the local and spatial entanglement of a one-dimensional chain of nanostructures where the particles interact via a long range interaction represented by a `soft' Coulomb…

Strongly Correlated Electrons · Physics 2011-02-03 J. P. Coe , V. V. França , I. D'Amico

The one-dimensional Hubbard model at half-filling is studied in the framework of the Composite Operator Method using a static approximation. A solution characterized by strong antiferromagnetic correlations and a gap for any nonzero on-site…

Strongly Correlated Electrons · Physics 2007-05-23 M. M. Sanchez , A. Avella , F. Mancini

Hybrid functionals' non-local exchange-correlation potential contains a derivative discontinuity that improves on standard semi-local density functional theory (DFT) band gaps. Moreover, by careful parameterization, hybrid functionals can…

Materials Science · Physics 2017-11-06 Viktor Ivády , Adam Gali , Igor A. Abrikosov

We investigate the possibility of using a transcorrelated Hamiltonian to describe electron correlation. Amethod to obtain transcorrelatedwavefunctionswas developed based on the mathematical framework of the bi-variational principle. This…

Chemical Physics · Physics 2024-07-23 Nicholas Lee , Alex J. W. Thom
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