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Bulletin of the American Physical Society

Comparison of functional renormalization group and dynamic cluster quantum Monte Carlo results for the 2D Hubbard model

Thomas Maier, Carsten Honerkamp A, Daniel Rohe, Douglas J. Scalapino

Published Mar 15, 2017• 0 citations
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This thesis will describe efforts to enhance our ability to simulate the 2D Hubbard model. Chapter 2 provides a background on the main computational techniques used throughout the work, including quantum Monte Carlo (QMC), dynamical mean field theory (DMFT), the dynamical cluster approximation (DCA), the continuous time auxiliary field algorithm (CTAUX), and the Maximum Entropy Method (MEM) for numeric analytic continuation. Chapter 3 presents new work on applying Twisted Boundary Conditions to the DCA framework. This method is applied in a effort to access thermodynamic (i.e. large system) information about the Hubbard model without the immense computational expense required to simulate large lattices directly. Chapter 4 describes efforts to study the extended 2D Hubbard model, which re-introduces non-local interactions between electrons that drive the formation of charge ordered phases. The work includes a thorough analysis of the phase diagram of the model away from half-filling, as well as analysis of the effect of non-local interactions on anti-ferromagnetic fluctuations and competition between the charge order and AFM states. Chapter 5 includes a derivation of the dual fermions diagrammatic expansion and the dual fermions ladder approximation used to compute corrections to single site DMFT calculations. The method is applied to the 2D Hubbard model in order to study the evolution of its spectral function, Fermi surface, and momentum dependent mass renormalization as the temperature, interaction strength, and doping are changed. The great advantage of this method is that we are able to access arbitrary momenta throughout the Brillouin zone, in contrast to the limitation to a few cluster momenta that characterize cluster methods like DCA.

•Jan 1, 2019•1 citation
Accurate simulations of the two-dimensional (2D) Hubbard model constitute one of the most challenging problems in condensed matter and quantum physics. Here we develop a tangent space tensor renormalization group (tanTRG) approach for the calculations of the 2D Hubbard model at finite temperature. An optimal evolution of the density operator is achieved in tanTRG with a mild O(D^{3}) complexity, where the bond dimension D controls the accuracy. With the tanTRG approach we boost the low-temperature calculations of large-scale 2D Hubbard systems on up to a width-8 cylinder and 10×10 square lattice. For the half-filled Hubbard model, the obtained results are in excellent agreement with those of determinant quantum Monte Carlo (DQMC). Moreover, tanTRG can be used to explore the low-temperature, finite-doping regime inaccessible for DQMC. The calculated charge compressibility and Matsubara Green's function are found to reflect the strange metal and pseudogap behaviors, respectively. The superconductive pairing susceptibility is computed down to a low temperature of approximately 1/24 of the hopping energy, where we find d-wave pairing responses are most significant near the optimal doping. Equipped with the tangent-space technique, tanTRG constitutes a well-controlled, highly efficient and accurate tensor network method for strongly correlated 2D lattice models at finite temperature.
We apply the functional field-theoretical renormalization group methodology up to two-loop order to the 2D attractive Hubbard model for weak bare interaction. Since the momentum-resolved quasiparticle weight ZΛ(p) is always close to unity in the RG flow, higher-order quantum fluctuations do not affect crucially the low-energy dynamics in this case. As a result, we observe a s-wave singlet superconducting quasi-long-range order phase as a function of doping in good agreement with other numerical methods. To assess the role played by the fluctuations we compare the critical temperature Tc in which the quasi-long-range superconducting order phase takes place within our approach with mean-field theory and quantum Monte Carlo results.
This thesis will describe efforts to enhance our ability to simulate the 2D Hubbard model. Chapter 2 provides a background on the main computational techniques used throughout the work, including quantum Monte Carlo (QMC), dynamical mean field theory (DMFT), the dynamical cluster approximation (DCA), the continuous time auxiliary field algorithm (CTAUX), and the Maximum Entropy Method (MEM) for numeric analytic continuation. Chapter 3 presents new work on applying Twisted Boundary Conditions to the DCA framework. This method is applied in a effort to access thermodynamic (i.e. large system) information about the Hubbard model without the immense computational expense required to simulate large lattices directly. Chapter 4 describes efforts to study the extended 2D Hubbard model, which re-introduces non-local interactions between electrons that drive the formation of charge ordered phases. The work includes a thorough analysis of the phase diagram of the model away from half-filling, as well as analysis of the effect of non-local interactions on anti-ferromagnetic fluctuations and competition between the charge order and AFM states. Chapter 5 includes a derivation of the dual fermions diagrammatic expansion and the dual fermions ladder approximation used to compute corrections to single site DMFT calculations. The method is applied to the 2D Hubbard model in order to study the evolution of its spectral function, Fermi surface, and momentum dependent mass renormalization as the temperature, interaction strength, and doping are changed. The great advantage of this method is that we are able to access arbitrary momenta throughout the Brillouin zone, in contrast to the limitation to a few cluster momenta that characterize cluster methods like DCA.