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arXiv:cond-mat/0703620 · Physical Review B

Quantum melting of a crystal of dipolar bosons

Christophe Mora, Olivier Parcollet, Xavier Waintal

Published Aug 10, 2007• 55 citations
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Abstract

We investigate the behavior of dipolar bosons in two dimensions. We describe the large density crystalline limit analytically while we use quantum Monte Carlo to study the melting toward the Bose-Einstein condensate. We find strong evidence for a first order transition. We characterize the window of experimentally accessible parameters in the context of ultracold bosons and show that observing the quantum melting should be within grasp once one is able to form cold heteronuclear molecules. Close to the melting, we cannot conclude on the existence of a supersolid phase due to an insufficient overlap of our variational Bijl-Jastrow ansatz with the actual ground state.

DOI
10.1103/physrevb.76.064511

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We investigate the behavior of dipolar bosons in two dimensions. We describe the large density crystalline limit analytically while we use quantum Monte Carlo to study the melting toward the Bose-Einstein condensate. We find strong evidence for a first order transition. We characterize the window of experimentally accessible parameters in the context of ultracold bosons and show that observing the quantum melting should be within grasp once one is able to form cold heteronuclear molecules. Close to the melting, we cannot conclude on the existence of a supersolid phase due to an insufficient overlap of our variational Bijl-Jastrow ansatz with the actual ground state.
Low-temperature properties of harmonically confined two-dimensional assemblies of dipolar bosons are systematically investigated by Monte Carlo simulations. Calculations carried out for different numbers of particles and strengths of the confining potential yield evidence of a quantum phase transition from a superfluid to a crystal-like phase, consistently with what is observed in the homogeneous system. It is found that the crystal phase nucleates in the center of the trap, as the density increases. Bose-Einstein condensation vanishes at T=0T=0T=0 upon entering the crystalline phase, concurrently with the disappearance of the superfluid response.
The supersolid phase of soft-core bosons in two dimensions is investigated using the self-consistent Hartree-Fock and quantum Monte Carlo methods. An approximate phase diagram at finite temperatures is initially constructed using the mean-field approach, which is subsequently validated through precise path-integral simulations, enabling a microscopic characterization of the various phases. Superfluid and melting/freezing transitions are analyzed through the superfluid density and the long-range behavior of correlation functions associated with positional and orientational order, in accordance with the general picture of Berezinskii-Kosterlitz-Thouless transitions. A broad region at low temperatures is identified where the supersolid phase exists, separating the uniform superfluid phase from the normal quasicrystal phase. Additionally, a potential intermediate hexatic phase with quasi-long-range orientational order is identified in a narrow region between the normal solid and fluid phases. These findings establish self-consistent Hartree-Fock theory beyond the local density approximation as an effective tool, complementary to computationally intensive quantum Monte Carlo simulations, for investigating the melting of the supersolid phase and the possible emergence of the hexatic superfluid phase in bosonic systems with various interaction potentials.
A mesoscopic system of dipolar bosons trapped by a harmonic potential is considered. The system has a number of physical realizations including dipole excitons, atoms with large dipolar moment, polar molecules, and Rydberg atoms in inhomogeneous electric field. We carry out a diffusion Monte Carlo simulation to define the quantum properties of a two-dimensional system of trapped dipoles at zero temperature. In dimensionless units the system is described by two control parameters, namely, the number of particles and the strength of the interparticle interaction. We have shown that when the interparticle interaction is strong enough a mesoscopic crystal is formed. As the strength of interactions is decreased a multistage melting takes place. Off-diagonal order in the system is tested using natural-orbitals analysis. We have found that the system might be Bose condensed even in the case of strong interparticle interactions. There is a set of parameters for which a spatially ordered structure is formed while simultaneously the fraction of Bose-condensed particles is nonzero. This might be considered as a realization of a mesoscopic supersolid.
We study phase transitions and hysteresis in a system of dipolar bosons loaded into triangular optical lattices at zero temperature. We find that the quantum melting transition from supersolid to superfluid phase is first order, in contrast with the previous report. We also find that due to strong quantum fluctuations the supersolid (or solid)-superfluid transition can exhibit an anomalous hysteretic behavior, in which the curve of density versus chemical potential does not form a standard loop structure. Furthermore, we show that the transition occurs unidirectionally along the anomalous hysteresis curve.
The ground-state phase properties of a two-dimensional Bose system with dipole-dipole interactions is studied by means of quantum Monte Carlo techniques. Limitations of mean-field theory in a two-dimensional geometry are discussed. A quantum phase transition from gas to solid is found. Crystal is tested for existence of a supersolid in the vicinity of the phase transition. Existence of mesoscopic analogue of the off-diagonal long-range order is shown in the one-body density matrix in a finite-size crystal. Non-zero superfluid fraction is found in a finite-size crystal, the signal being dramatically increased in presence of vacancies.
We analyse the ground-state quantum phase diagram of hardcore Bosons interacting with repulsive dipolar potentials. The bosons dynamics is described by the extended-Bose-Hubbard Hamiltonian on a two-dimensional lattice. The ground state results from the interplay between the lattice geometry and the long-range interactions, which we account for by means of a classical spin mean-field approach limited by the size of the considered unit cells. This extended classical spin mean-field theory accounts for the long-range density-density interaction without truncation. We consider three different lattice geometries: square, honeycomb, and triangular. In the limit of zero hopping the ground state is always a devil’s staircase of solid (gapped) phases. Such crystalline phases with broken translational symmetry are robust with respect to finite hopping amplitudes. At intermediate hopping amplitudes, these gapped phases melt, giving rise to various lattice supersolid phases, which can have exotic features with multiple sublattice densities. At sufficiently large hoppings the ground state is a superfluid. The stability of phases predicted by our approach is gauged by comparison to the known quantum phase diagrams of the Bose-Hubbard model with nearest-neighbour interactions as well as quantum Monte Carlo simulations for the dipolar case on the square and triangular lattice. Our results are of immediate relevance for experimental realisations of self-organised crystalline ordering patterns in analogue quantum simulators, e.g., with ultracold dipolar atoms in an optical lattice.