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Accuracy of ghost rotationally invariant slave-boson and dynamical mean field theory as a function of the impurity-model bath size

Tsung-Han Lee, Nicola Lanatà, Gabriel Kotliar

2023Physical review. B./Physical review. B23 citationsDOIOpen Access PDF

Abstract

We compare the accuracy of the ghost rotationally invariant slave-boson (g-RISB) theory and dynamical mean field theory (DMFT) on the single-band Hubbard model, as a function of the number of bath sites in the embedding impurity Hamiltonian. Our benchmark calculations confirm that the accuracy of g-RISB can be systematically improved by increasing the number of bath sites, similar to DMFT. With a few bath sites, we observe that g-RISB is systematically more accurate than DMFT for the ground-state observables. On the other hand, the relative accuracy of these methods is generally comparable for the quasiparticle weight and the spectral function. As expected, we observe that g-RISB satisfies the variational principle in infinite dimensions, as the total energy decreases monotonically towards the exact value as a function of the number of bath sites, suggesting that the g-RISB wave function may approach the exact ground state in infinite dimensions. Our results suggest that the g-RISB is a promising method for first-principles simulations of strongly correlated matter, which can capture the behavior of both static and dynamical observables, at a relatively low computational cost.

Topics & Concepts

Invariant (physics)ImpurityMean field theorySlave bosonPhysicsBosonStatistical physicsMathematicsMathematical physicsQuantum mechanicsSuperconductivityHubbard modelCold Atom Physics and Bose-Einstein CondensatesPhysics of Superconductivity and MagnetismQuantum and electron transport phenomena
Accuracy of ghost rotationally invariant slave-boson and dynamical mean field theory as a function of the impurity-model bath size | Litcius