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Physica B Condensed Matter

Weak-coupling treatment of correlated electron systems in finite dimensions

H. Schweitzer, G. Czycholl

Published Aug 1, 1990• 0 citations
Publisher
DOI
10.1016/0921-4526(90)90599-p

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We show that even in $d=\ensuremath{\infty}$ dimensions the Hubbard model, when scaled properly, describes nontrivial correlations among fermions. Diagrammatic treatments are found to be substantially simpler than in finite dimensions. The weak-coupling correlation energy is seen to be a good approximation for that in d=3d=3d=3. Recent approximations based on slave-boson techniques are recovered by the exact evaluation of explicit variational wave functions in $d=\ensuremath{\infty}$.
We develop a Fermi-Bose bootstrap embedding framework for the ground state of interacting electrons coupled to a phonon mean field. The method combines bootstrap embedding for correlated electrons with a self-consistent coherent-state mean-field treatment for phonons. This method models the interacting electron-phonon problem as a system of correlated electrons traveling in a self-consistently specified potential landscape, allowing for efficient treatment of large lattice systems. Convergence of the methods for fragment size and total system size is demonstrated for the one-dimensional Hubbard-Holstein model for up to 350 sites. Finite-size scaling is performed to extrapolate to the infinite system size. Benchmarking against the density matrix renormalization group for a small 8-site system at half- and quarter-filling shows an orders-of-magnitude runtime advantage. The comparison further reveals that the method performs best in regimes dominated by localization, such as the Mott insulating phase and the strong-coupling tiny polaron regime, where the local embedding ansatz is still valid. However, due to the mean-field treatment for phonons, we find limitations of our methods in the weakly coupled delocalized region and at the Peierls transition, where quantum phonon fluctuations and long-range kinetic correlations become substantial.