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arXiv:2011.11803

Electronic properties of the boson mode in a three-point fermion loop and the emergent SYK physics

Chen-Huan Wu

Published Nov 24, 2020• 1 citation
arXivHTMLPDF

Abstract

We investigate the electronic properties of the boson mode in a three-point fermion loop. In this framwork, the single-particle excitation and the many-body local (in imaginary time and momentum space) field effects are investigated in IR or UV limits with the density fluctuation induced by external potential (or bosonic frequency). While in the limit of vanishing effect of external potential, which is equivalent to UV limit of the fermionic frequency, the conserving approximation can be applied together with the Luttinger-Ward analysis, in which case the anomalous contribution to the fermion self-energy or the expectation value of many-body interaction term, which is $g^{2}\langle Δ^†Δ\rangle$ ($g$ is the irreducible particle-particle vertex and $Δ$ is the boson field operator), vanishes, and results in a Hartree-Fock type momentum- and frequency-independent fermion self-energy. The correlator $\langleΔ^†Δ\rangle$ is positive which can be obtained through the local moment sum rule of dynamical susceptibility.

DOI
10.48550/arxiv.2011.11803

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The main focus of the present thesis lies on the development and application of numerical approaches based on quantum lattice models to describe collective excitations in strongly correlated materials. To this end, an efficient and balanced dual triply irreducible local expansion (D-TRILEX) approach that captures the major effects of spatial correlations in strongly correlated fermionic systems is presented, which is based on partial bosonization of the collective electronic fluctuations. Thereby, a specific choice of the bare interaction in the corresponding channel of instability allows a simultaneous description of collective excitations in different channels without facing the Fierz ambiguity problem which usually arises in methods based on partial bosonization. Compared to more elaborate methods, D-TRILEX does not require the computation of the numerically expensive four-point vertex. Furthermore, taking into account only the leading longitudinal contribution of the bosonic modes to the self-energy reduces the complexity of the diagrammatic structure drastically making the method applicable to more complex realistic multi-orbital systems. As the main result of this thesis, the D-TRILEX approach is introduced and its limit of applicability is studied by applying it to the two-dimensional single-band Hubbard model. Performing a comprehensive diagrammatic analysis by comparing D-TRILEX with methods, which consider different sets of diagrams and different approximations for the four-point vertex, we find that contributions that are not considered by the partially bosonized approximation of the four-point vertex have only a minor effect on electronic degrees of freedom and the longitudinal bosonic modes taking into account in D-TRILEX self-energy are the leading ones in a broad range of control parameters. After investigating the applicability of the D-TRILEX approach we apply the method to study collective electronic effects in the hole-doped InSe monolayers using a realistic electronic-structure model. Thereby, we find that due to the weakly screened long-range Coulomb interaction the system shows a charge density waves phase for the broad range of considered parameters, however, inside this regime we have found a coexisting ferromagnetic phase. D-TRILEX can be considered as an approximation of the more elaborate dual boson (DB) theory, which accounts for local correlations within the dynamical mean-field theory (DMFT) and nonlocal correlations perturbatively. As a further result of this thesis, we investigate the weak coupling regime of the two-dimensional single-band Hubbard model within the ladder DB approximation and compare our results to the numerically exact diagrammatic quantum Monte Carlo (DiagMC) method. We find that the DB method qualitatively captures all the different regimes. Even quantitatively DB shows a good agreement with the exact results for single- and two-particle quantities at high and moderate temperatures. However, the ladder approximation slightly underestimates the strong antiferromagnetic fluctuations that appear in the system at low temperatures. As the final result of this thesis, we perform a parametrization of the local four-point vertex in terms of the (three-point) Hedin vertex and screened interactions in the framework of single-boson exchange (SBE) decomposition. Similar to the D-TRILEX approach the computational costs are reduced by neglecting the interaction-irreducible part of the four-point vertex. The approximated vertex is used to calculate the DMFT susceptibility for different interaction strengths at different temperatures. We find that the approximation shows a good agreement in the limits of weak and strong couplings. Thereby, our study highlights the importance of the Hedin vertex for local vertex corrections.
Collective excitations in fermionic systems play a crucial role in determining their physical properties. An important challenge is to develop efficient theoretical approaches for describing these excitations and their coupling to fermionic degrees of freedom. In this work, we revisit the problem of quantifying the contributions of individual bosonic modes of collective fluctuations to observable properties of correlated fermion systems within the framework of the Fluctuating Local Field (FLF) method. Whereas the auxiliary field in this method was previously considered only classically, we formulate its systematic extension termed Quantum FLF (Q-FLF) that incorporates selected bosonic Matsubara modes, thus tailoring it to description of quantum collective fluctuations. As a testbed, we apply the approach to a half-filled one-dimensional Hubbard chain and compute the Green's function, the total energy, and the antiferromagnetic susceptibility. Our results demonstrate that the proposed scheme enables an efficient and selective characterization of the contributions of individual bosonic modes. In particular, low Matsubara frequencies are found to have a quantitative impact on integrated observables such as total energy and antiferromagnetic susceptibility. At the same time, an accurate description of single-particle properties requires inclusion of higher-frequency bosonic modes.
This thesis is concerned with ground state properties of two-dimensional fermionic superfluids, in which fluctuation effects like the renormalization of the order parameter or infrared singularities are important. In the superfluid state, the fermionic two-particle vertex develops rich and singular dependences on momentum and frequency, for which an efficient parametrization in terms of boson-exchange interactions in the particle-hole and particle-particle channels is formulated. Based on this decomposition of the vertex, flow equations for the effective interactions are derived, extending existing channel-decomposition schemes to i) the description of symmetry breaking in the Cooper channel and ii) the inclusion of those two-loop renormalization contributions to the vertex that are neglected in the Katanin scheme. In the second part of this thesis, the superfluid ground state of various model systems is studied. For the attractive Hubbard model at weak coupling, the momentum and frequency dependence of the two-particle vertex and the frequency dependence of the self-energy are determined on one- and two-loop level. Results for the suppression of the superfluid gap by fluctuations are in good agreement with the literature. The two-loop approximation captures the singular infrared behaviour that is expected in a fermionic superfluid at zero temperature. For the repulsive Hubbard model at weak coupling, the momentum dependence of the two-particle vertex and the d-wave superfluid gap are determined on one-loop level as a function of the interaction, the next-nearest neighbour hopping and the fermionic density. The results for the critical scales and superfluid gaps are in qualitative agreement with the literature and suggest the existence of an optimal value of the next-nearest neighbour hopping for pairing.
This thesis is concerned with ground state properties of two-dimensional fermionic superfluids. In such systems, fluctuation effects are particularly strong and lead for example to a renormalization of the order parameter and to infrared singularities. In the first part of this thesis, the fermionic two-particle vertex is analysed and the fermionic renormalization group is used to derive flow equations for a decomposition of the vertex in charge, magnetic and pairing channels. In the second part, the channel-decomposition scheme is applied to various model systems. In the superfluid state, the fermionic two-particle vertex develops rich and singular dependences on momentum and frequency. After simplifying its structure by exploiting symmetries, a parametrization of the vertex in terms of boson-exchange interactions in the particle-hole and particle-particle channels is formulated, which provides an efficient description of the singular momentum and frequency dependences. Based on this decomposition of the vertex, flow equations for the effective interactions are derived on one- and two-loop level, extending existing channel-decomposition schemes to i) the description of symmetry breaking in the Cooper channel and ii) the inclusion of those two-loop renormalization contributions to the vertex that are neglected in the Katanin scheme. In the second part, the superfluid ground state of various model systems is studied using the channel-decomposition scheme for the vertex and the flow equations. A reduced model with interactions in the pairing and forward scattering channels is solved exactly, yielding insights into the singularity structure of the vertex. For the attractive Hubbard model at weak coupling, the momentum and frequency dependence of the two-particle vertex and the frequency dependence of the self-energy are determined on one- and two-loop level. Results for the suppression of the superfluid gap by fluctuations are in good agreement with the literature. The two-loop approximation captures the singular infrared behaviour that is expected in a fermionic superfluid at zero temperature. For the repulsive Hubbard model at weak coupling, the momentum dependence of the two-particle vertex and the d-wave superfluid gap are determined on one-loop level as a function of the interaction, the next-nearest neighbour hopping and the fermionic density. The results for the critical scales and superfluid gaps are in qualitative agreement with the literature and suggest the existence of an optimal value of the next-nearest neighbour hopping for pairing.
We study the relation between the microscopic properties of a many-body system and the electron spectra, experimentally accessible by photoemission. In a recent paper [O. Gunnarsson et al., Phys. Rev. Lett. 114, 236402 (2015)], we introduced the ``fluctuation diagnostics'' approach to extract the dominant wave-vector-dependent bosonic fluctuations from the electronic self-energy. Here, we first reformulate the theory in terms of fermionic modes to render its connection with resonance valence bond (RVB) fluctuations more transparent. Second, by using a large-UUU expansion, where UUU is the Coulomb interaction, we relate the fluctuations to real-space correlations. Therefore, it becomes possible to study how electron spectra are related to charge, spin, superconductivity, and RVB-like real-space correlations, broadening the analysis of an earlier work [J. Merino and O. Gunnarsson, Phys. Rev. B 89, 245130 (2014)]. This formalism is applied to the pseudogap physics of the two-dimensional Hubbard model, studied in the dynamical cluster approximation. We perform calculations for embedded clusters with up to 32 sites, having three inequivalent K\mathbf{K}K points at the Fermi surface. We find that as UUU is increased, correlation functions gradually attain values consistent with an RVB state. This first happens for correlation functions involving the antinodal point and gradually spreads to the nodal point along the Fermi surface. Simultaneously, a pseudogap opens up along the Fermi surface. We relate this to a crossover from a Kondo-type state to an RVB-like localized cluster state and to the presence of RVB and spin fluctuations. These changes are caused by a strong momentum dependence in the cluster bath couplings along the Fermi surface. We also show, from a more algorithmic perspective, how the time-consuming calculations in fluctuation diagnostics can be drastically simplified.
In the study of strongly interacting systems, correlations on the two-particle level are receiving more and more attention. In this work, we study a particular two-particle correlation function: the fermion-boson vertex. It describes the response of the Green's function when an external field is applied and is an important ingredient of diagrammatic extensions of dynamical mean-field theory. We provide several perspectives on this object, using Ward identities, sum rules, perturbative analysis, and asymptotic relations. We then use these tools to study the vertex across the doping-driven metal-insulator transition and find a divergent imaginary part.