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Journal of Superconductivity and Novel Magnetism

Time-Dependent Gutzwiller Approximation: Theory and Applications

K. Noatschk, C. Martens, G. Seibold

Published Jan 7, 2020• 4 citations
Publisher
DOI
10.1007/s10948-019-05406-z

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We formulate a multi-band generalization of the time-dependent Gutzwiller theory. This approach allows for the calculation of general two-particle response functions, which are crucial for an understanding of various experiments in solid-state physics. As a first application, we study the momentum- and frequency-resolved magnetic susceptibility in a two-band Hubbard model. As in the case of underlying ground-state approaches, we find significant differences between the results of our method and those from a time-dependent Hartree–Fock approximation.
We review the recently proposed extension of the Gutzwiller approximation, M. Schiro' and M. Fabrizio, Phys. Rev. Lett. 105, 076401 (2010), designed to describe the out-of-equilibrium time-evolution of a Gutzwiller-type variational wave function for correlated electrons. The method, which is strictly variational in the limit of infinite lattice-coordination, is quite general and flexible, and it is applicable to generic non-equilibrium conditions, even far beyond the linear response regime. As an application, we discuss the quench dynamics of a single-band Hubbard model at half-filling, where the method predicts a dynamical phase transition above a critical quench that resembles the sharp crossover observed by time-dependent dynamical mean field theory. We next show that one can actually define in some cases a multi-configurational wave function combination of a whole set of mutually orthogonal Gutzwiller wave functions. The Hamiltonian projected in that subspace can be exactly evaluated and is equivalent to a model of auxiliary spins coupled to non-interacting electrons, closely related to the slave-spin theories for correlated electron models. The Gutzwiller approximation turns out to be nothing but the mean-field approximation applied to that spin-fermion model, which displays, for any number of bands and integer fillings, a spontaneous Z2Z_2Z2​ symmetry breaking that can be identified as the Mott insulator-to-metal transition.