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Parquet-like equations for the Hedin three-leg vertex

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 Added by Angelo Valli Dr.
 Publication date 2019
  fields Physics
and research's language is English




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Taking the competition and the mutual screening of various bosonic fluctuations in correlated electron systems into account requires an unbiased approach to the many-body problem. One such approach is the self-consistent solution of the parquet equations, whose numerical treatment in lattice systems is however prohibitively expensive. In a recent article it was shown that there exists an alternative to the parquet decomposition of the four-point vertex function, which classifies the vertex diagrams according to the principle of single-boson exchange (SBE) [F. Krien, A. Valli, and M. Capone, arXiv:1907.03581 (2019)]. Here we show that the SBE decomposition leads to a closed set of equations for the Hedin three-leg vertex, the polarization, and the electronic self-energy, which sums self-consistently the diagrams of the Maki-Thompson type. This circumvents the calculation of four-point vertex functions and the inversion of the Bethe-Salpeter equations, which are the two major bottlenecks of the parquet equations. The convergence of the calculation scheme starting from a fully irreducible vertex is demonstrated for the Anderson impurity model.



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We find that imposing the crossing symmetry in the iteration process considerably extends the range of convergence for solutions of the parquet equations for the Hubbard model. When the crossing symmetry is not imposed, the convergence of both simple iteration and more complicated continuous loading (homotopy) methods are limited to high temperatures and weak interactions. We modify the algorithm to impose the crossing symmetry without increasing the computational complexity. We also imposed time reversal and a subset of the point group symmetries, but they did not further improve the convergence. We elaborate the details of the latency hiding scheme which can significantly improve the performance in the computational implementation. With these modifications, stable solutions for the parquet equations can be obtained by iteration more quickly even for values of the interaction that are a significant fraction of the bandwidth and for temperatures that are much smaller than the bandwidth. This may represent a crucial step towards the solution of two-particle field theories for correlated electron models.
We have implemented the dynamical vertex approximation (D$Gamma$A) in its full parquet-based version to include spatial correlations on all length scales and in {sl all} scattering channels. The algorithm is applied to study the electronic self-energies and the spectral properties of finite-size one-dimensional Hubbard models with periodic boundary conditions (nanoscopic Hubbard rings). From a methodological point of view, our calculations and their comparison to the results obtained within dynamical mean-field theory, plain parquet approximation, and the exact numerical solution, allow us to evaluate the performance of the D$Gamma$A algorithm in the most challenging situation of low dimensions. From a physical perspective, our results unveil how non-local correlations affect the spectral properties of nanoscopic systems of various sizes in different regimes of interaction strength.
We exploit the parquet formalism to derive exact flow equations for the two-particle-reducible four-point vertices, the self-energy, and typical response functions, circumventing the reliance on higher-point vertices. This includes a concise, algebraic derivation of the multiloop flow equations, which have previously been obtained by diagrammatic considerations. Integrating the multiloop flow for a given input of the totally irreducible vertex is equivalent to solving the parquet equations with that input. Hence, one can tune systems from solvable limits to complicated situations by variation of one-particle parameters, staying at the fully self-consistent solution of the parquet equations throughout the flow. Furthermore, we use the resulting differential form of the Schwinger-Dyson equation for the self-energy to demonstrate one-particle conservation of the parquet approximation and to construct a conserving two-particle vertex via functional differentiation of the parquet self-energy. Our analysis gives a unified picture of the various many-body relations and exact renormalization group equations.
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