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arXiv:cond-mat/0404552 · Physical Review A

Quantum Monte Carlo simulations of confined bosonic atoms in optical lattices

Stefan Weßel, Fabien Alet, Matthias Troyer, G. G. Batrouni

Published Nov 19, 2004• 205 citations
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Abstract

We study properties of ultracold bosonic atoms in one-, two-, and three-dimensional optical lattices by large scale quantum Monte Carlo simulations of the Bose-Hubbard model in parabolic confining potentials. Our results indicate that local properties of the atoms can be accessed by probing the system's response to local potential perturbations. Furthermore, we show how the formation of Mott insulating regions is reflected in the momentum distribution of the atoms, amenable to experimental detection. We disprove previous claims concerning the relevance of fine structure in the momentum distribution function. Furthermore, we discuss limitations of local density approximations for confined systems, and demonstrate the absence of quantum criticality due to the inhomogenous potential. Instead, we show that quantum critical behavior can be observed in flat confining potentials. Our results indicate that the experimental detection of the Mott transition in moderately sized optical lattices would be significantly eased in flat confinement potentials.

DOI
10.1103/physreva.70.053615

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We study properties of ultracold bosonic atoms in one-, two-, and three-dimensional optical lattices by large scale quantum Monte Carlo simulations of the Bose-Hubbard model in parabolic confining potentials. Our results indicate that local properties of the atoms can be accessed by probing the system's response to local potential perturbations. Furthermore, we show how the formation of Mott insulating regions is reflected in the momentum distribution of the atoms, amenable to experimental detection. We disprove previous claims concerning the relevance of fine structure in the momentum distribution function. Furthermore, we discuss limitations of local density approximations for confined systems, and demonstrate the absence of quantum criticality due to the inhomogenous potential. Instead, we show that quantum critical behavior can be observed in flat confining potentials. Our results indicate that the experimental detection of the Mott transition in moderately sized optical lattices would be significantly eased in flat confinement potentials.
We investigate local and global properties of the one-dimensional Bose-Hubbard model with an external confining potential, describing an atomic condensate in an optical lattice. Using quantum Monte Carlo techniques we demonstrate that a local-density approximation, which relates the unconfined and the confined model, yields quantitatively correct results in most of the interesting parameter range. We also examine claims of universal behavior in the confined system, and demonstrate the origin of a previously calculated fine structure in the experimentally accessible momentum distribution.
We study the dynamic response of ultracold bosons trapped in one-dimensional optical lattices using Quantum Monte Carlo simulations of the boson Hubbard model with a confining potential. The dynamic structure factor reveals the inhomogeneous nature of the low temperature state, which contains coexisting Mott insulator and superfluid regions. We present new evidence for local quantum criticality and discuss implications for the experimental excitation spectrum of 87Rb^{87}\mathrm{Rb}87Rb atoms confined in one dimension.
We report results of quantum Monte Carlo simulations in the canonical and the grand-canonical ensemble of the two- and three-dimensional Bose-Hubbard model with quadratic and quartic confining potentials. The quantum criticality of the superfluid-Mott insulator transition is investigated both on the boundary layer separating the two coexisting phases and at the center of the traps where the Mott-insulating phase is first established. Recent simulations of systems in quadratic traps have shown that the transition is not in the critical regime due to the finite gradient of the confining potential and that critical fluctuations are suppressed. In addition, it has been shown that quantum critical behavior is recovered in flat confining potentials as they approach the uniform regime. Our results show that quartic traps display a behavior similar to quadratic ones, yet locally at the center of the traps the bulk transition has enhanced critical fluctuations in comparison to the quadratic case. Therefore quartic traps provide a better prerequisite for the experimental observation of true quantum criticality of ultracold bosonic atoms in optical lattices.
Using quantum Monte Carlo (QMC) simulations we study the ground-state properties of the one-dimensional fermionic Hubbard model in traps with an underlying lattice. Since due to the confining potential the density is space dependent, Mott-insulating domains always coexist with metallic regions, such that global quantities are not appropriate to describe the system. We define a local compressibility that characterizes the Mott-insulating regions and analyze other local quantities. It is shown that the momentum distribution function, a quantity that is commonly considered in experiments, fails in giving a clear signal of the Mott-insulating transition. Furthermore, we analyze a mean-field approach to these systems and compare it with the numerically exact QMC results. Finally, we determine a generic form for the phase diagram that allows us to predict the phases to be observed in the experiments.
Using quantum Monte Carlo simulations, we show that the one-dimensional fermionic Hubbard model in a harmonic potential displays quantum critical behavior at the boundaries of a Mott-insulating region. A local compressibility defined to characterize the Mott-insulating phase has a nontrivial critical exponent. Both the local compressibility and the variance of the local density show universality with respect to the confining potential. We determine a generic phase diagram, which allows the prediction of the phases to be observed in experiments with ultracold fermionic atoms trapped on optical lattices.