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arXiv:1711.01572

Thermal phases of correlated lattice boson: a classical fluctuation theory

Abhishek Joshi, Pinaki Majumdar

Published Nov 5, 2017• 0 citations
arXivHTMLPDF

Abstract

We present a method that generalises the standard mean field theory of correlated lattice bosons to include amplitude and phase fluctuations of the $U(1)$ field that induces onsite particle number mixing. This arises formally from an auxiliary field decomposition of the kinetic term in a Bose Hubbard model. We solve the resulting problem, initially, by using a classical approximation for the particle number mixing field and a Monte Carlo treatment of the resulting bosonic model. In two dimensions we obtain $T_c$ scales that dramatically improve on mean field theory and are within about 20% of full quantum Monte Carlo estimates. The `classical approximation' ground state, however, is still mean field, with an overestimate of the critical interaction, $U_c$, for the superfluid to Mott transition. By further including low order quantum fluctuations in the free energy functional we improve significantly on the $U_c$, and the overall thermal phase diagram. The classical approximation based method has a computational cost linear in system size. The methods readily generalise to multispecies bosons and the presence of traps.

DOI
10.48550/arxiv.1711.01572

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Abstract This paper is a first step toward rigorously establishing the validity of mean-field approximations for the dynamics of quantum systems in a large dimensional limit. Our result is a derivation of the large d mean-field limit of the Bose–Hubbard model on a square lattice. The Bose–Hubbard model effectively describes bosons on a lattice with on-site interactions and nearest-neighbour hopping, serving as a foundational framework for understanding strong particle interactions and the superfluid to Mott insulator phase transition. We prove a trace norm estimate between the one-lattice-site reduced density of the Schrödinger dynamics and the mean-field dynamics in the limit of large dimension. Here, the mean-field approximation is in the hopping amplitude and not in the interaction, leading to a very rich and non-trivial mean-field equation. This mean-field equation does not only describe the condensate, as is the case when the mean-field description comes from a large particle number limit averaging out the interaction, but it allows for a phase transition since it contains the full non-trivial interaction. Our work is a rigorous justification of a simple case of the highly successful dynamical mean-field theory (DMFT) for bosons, which somewhat surprisingly yields many qualitatively correct results in three dimensions.
Bosonic lattice systems with nontrivial interactions represent an intriguing platform to study exotic phases of matter. Here, we study the effects of extended correlated hopping processes in a system of bosons trapped in a lattice geometry. The interplay between single particle tunneling terms, correlated hopping processes, and onsite repulsion is studied by means of a combination of exact diagonalization, strong coupling expansion, and cluster mean field theory. We identify a rich ground state phase diagram where, apart from the usual Mott and superfluid states, superfluid phases with interesting clustering properties occur.
The exact solution of a quantum Bethe lattice model in the thermodynamic limit amounts to solve a functional self-consistent equation. In this paper we obtain this equation for the Bose-Hubbard model on the Bethe lattice, under two equivalent forms. The first one, based on a coherent-state path integral, leads in the large connectivity limit to the mean-field treatment of Fisher et al. [Phys. Rev. B 40, 546 (1989)] at the leading order, and to the bosonic dynamical mean field theory as a first correction, as recently derived by Byczuk and Vollhardt [Phys. Rev. B 77, 235106 (2008)]. We obtain an alternative form of the equation using the occupation number representation, which can be easily solved with an arbitrary numerical precision, for any finite connectivity. We thus compute the transition line between the superfluid and Mott insulator phases of the model, along with thermodynamic observables and the space and imaginary-time dependence of correlation functions. The finite connectivity of the Bethe lattice induces a richer physical content with respect to its infinitely connected counterpart: a notion of distance between sites of the lattice is preserved, and the bosons are still weakly mobile in the Mott insulator phase. The Bethe lattice construction can be viewed as an approximation to the finite-dimensional version of the model. We show indeed a quantitatively reasonable agreement between our predictions and the results of Quantum Monte Carlo simulations in two and three dimensions.
A versatile and numerically inexpensive method is presented allowing the accurate calculation of phase diagrams for bosonic lattice models. By treating clusters within the Gutzwiller theory, a surprisingly good description of quantum fluctuations beyond the mean-field theory is achieved approaching quantum Monte Carlo predictions for large clusters. Applying this powerful method to the Bose-Hubbard model, we demonstrate that it yields precise results for the superfluid to Mott-insulator transition in square, honeycomb, and cubic lattices. Due to the exact treatment within a cluster, the method can be effortlessly adapted to more complicated Hamiltonians in the fast progressing field of optical lattice experiments. This includes state- and site-dependent superlattices, large confined atomic systems, and disordered potentials, as well as various types of extended Hubbard models. Furthermore, the approach allows an excellent treatment of systems with arbitrary filling factors. We discuss the perspectives that allow for the computation of large, spatially varying lattices, low-lying excitations, and time evolution.
The boson lattice Hubbard model is used to study the role of quantum fluctuations of the phase and local density of the superfluid component in establishing a global superconducting state for a system of mesoscopic Josephson junctions or grains. The quantum Monte Carlo method is used to calculate the density of the superfluid component and fluctuations in the number of particles at sites of the two-dimensional lattice for various average site occupation numbers n 0 (i.e., number of Cooper pairs per grain). For a system of strongly interacting bosons, the phase boundary of the ordered superconducting state lies above the corresponding boundary for its quasiclassical limit—the quantum XY -model—and approaches the latter as n 0 increases. When the boson interaction is weak in the boson Hubbard model (i.e., the quantum fluctuations of the phase are small), the relative fluctuations of the order parameter modulus are significant when n 0 <10, while quantum fluctuations in the phase are significant when n 0 <8; this determines the region of mesoscopic behavior of the system. Comparison of the results of numerical modeling with theoretical calculations show that mean-field theory yields a qualitatively correct estimate of the difference between the phase diagrams of the quantum XY -model and the Hubbard model. For a quantitative estimate of this difference the free energy and thermodynamic averages of the Hubbard model are expanded in powers of 1/ n 0 using the method of functional integration.
We extend the variational cluster approach to deal with strongly correlated lattice bosons in the superfluid phase. To this end, we reformulate the approach within a pseudoparticle formalism, whereby cluster excitations are described by particlelike excitations. The approximation amounts to solving a multicomponent noninteracting bosonic system by means of a multimode Bogoliubov approximation. A source-and-drain term is introduced in order to break U(1) symmetry at the cluster level. We provide an expression for the grand potential, the single-particle normal and anomalous Green's functions, the condensate density, and other static quantities. As a first nontrivial application of the method we choose the two-dimensional Bose-Hubbard model and evaluate results in both the Mott and the superfluid phases. Our results show an excellent agreement with quantum Monte Carlo calculations.