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The cumulant Green's functions method for the single impurity Anderson model

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Abstract

Using the cumulant Green's functions method (CGFM), we study the single impurity Anderson model (SIAM). The CGFM starting point is a diagonalization of the SIAM Hamiltonian expressed in a semi-chain form, containing N sites, viz., a correlated site (simulating an impurity) connected to the remaining N-1 uncorrelated conduction-electron sites. An exact solution can be obtained since the complete system has few sites. That solution is employed to calculate the atomic Green's functions and the approximate cumulants used to obtain the impurity and conduction Green's functions for the SIAM, and no self-consistency loop is required.

We calculated the density of states, the Friedel sum rule, and the impurity occupation number, all bench-marked against results from the numerical renormalization group (NRG). One of the main insights obtained is that, at very low temperatures, only four atomic transitions contribute to generating the entire SIAM density of states, regardless of the number of sites in the chain and the model's parameters and different regimes: Empty orbital, mixed-valence, and Kondo. We also pointed out the possibilities of the CGFM as a valid alternative to describe strongly correlated electron systems like the Hubbard and t-J models, the periodic Anderson model, the Kondo and Coqblin-Schrieffer models, and their variants.

Publication: 1. T. M. Sobreira et al. The cumulant Green's functions method for the single impurity Anderson model, arXiv, cond-mat.str-el, 2409.16881.<br>2. R. N. Lira, et al. The cumulant Green's functions method for the Hubbard model, Journal of Physics: Condensed Matter<br>35, 245601 (2023).<br>3. R. N. Lira, et al. The one-dimensional Hubbard model in a magnetic field: Density profiles and ground-state phase diagram, Physics Letters A 474, 128818 (2023).<br>4. Oral contribution to the March Meeting 2024, R. N. Lira et al. The cumulant Green's functions method for a triangular<br>lattice: Mott transition and superconductivity.<br>5. Fortran 90/95 code available: https://github.com/DrLIRAAAAAAA/CGFM_Anderson_impurity_1D

Presenters

  • Marcos S Figueira

    Universidade Federal Fluminense

Authors

  • Marcos S Figueira

    Universidade Federal Fluminense

  • Tomas M Sobreira

    Universidade Federal Fluminense

  • Renan N Lira

    Universidade Federal Fluminense

  • Jereson Silva-Valencia

    Universidad Nacional de Colombia

  • George B Martins

    Universidade Federal de Uberlândia, Universidade Federal de Uberlandia

  • Tharnier O Puel

    University of Iowa

  • Marco A Manya

    Technological University of Peru

  • Sergio E Ulloa

    Ohio University