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Ultra-cold atoms in optical lattices: simulating quantum spin systems

Walters, Richard

Published Jan 1, 2012• 0 citations
Publisher

Abstract

Optical lattices provide ideal experimental tools for simulating a wide variety of physical systems. They exhibit excellent coherence properties, their microscopic dynamics are well-understood, and they can be dynamically controlled with great precision. Recent advances in cooling and trapping gases of dipolar molecules and Rydberg atoms have further increased the versatility of optical lattices as quantum simulators, particularly for solid state systems possessing long-range interactions. In this thesis we further examine the microscopic properties of cold atoms trapped in an optical lattice, going beyond the case where the lattice axes are orthogonal. We present a transformation of the single-particle energy eigenstates to a complete, orthonormal basis of so-called 'generalised Wannier functions' that are localised to each lattice site. Generalised Wannier functions, as opposed to ordinary Wannier functions, are formed by mixing states between bands and are required when the bands are degenerate. We modify an algorithm devised by Marzari and Vanderbilt (Phys. Rev. B 56(20) 12847) for calculating maximally localised generalised Wannier functions, specifically to determine these functions for optical lattice systems of arbitrary geometry, including those with degenerate lower bands. Moreover, we overcome an issue with the initialisation of the original algorithm to find the maximally localised set without fail. We then present results for a variety of optical lattice systems in one- and two-dimensions, including hexagonal and Kagomé geometries. In each case we use the generalised Wannier functions to calculate the hopping and interaction parameters, and thus determine a reduced form of the system's Hamiltonian that contains only local interactions. We also study two spin-1/2 systems with long-range interactions as paradigm examples of the models that can be simulated using optical lattices loaded with dipolar molecules. We first examine the critical properties of a 1D spin-1/2 Ising chain possessing exponentially decaying interactions as the range of the interactions is increased. Using the infinite density matrix renormalisation group method, we calculate the location of the critical point and observe a smooth approach to the classical mean-field result in the limit of infinite-ranged interactions. We go on to consider the quantum dynamics of a single spin-1/2 coupled to a bath of interacting spins as a model for decoherence in solid state quantum memories. The large degree of symmetry of the bath, described by the infinite-ranged Lipkin-Meshkov-Glick model, allows us to find parameter regimes where the initial qubit state is revived at well-defined times after the qubit preparation. We observe that these times may become independent of the bath size for large baths and thus enable faithful qubit storage even in the presence of strong coupling to the bath.

DOI
10.5287/ora-pp7nxb142

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Optical lattices provide ideal experimental tools for simulating a wide variety of physical systems. They exhibit excellent coherence properties, their microscopic dynamics are well-understood, and they can be dynamically controlled with great precision. Recent advances in cooling and trapping gases of dipolar molecules and Rydberg atoms have further increased the versatility of optical lattices as quantum simulators, particularly for solid state systems possessing long-range interactions. In this thesis we further examine the microscopic properties of cold atoms trapped in an optical lattice, going beyond the case where the lattice axes are orthogonal. We present a transformation of the single-particle energy eigenstates to a complete, orthonormal basis of so-called 'generalised Wannier functions' that are localised to each lattice site. Generalised Wannier functions, as opposed to ordinary Wannier functions, are formed by mixing states between bands and are required when the bands are degenerate. We modify an algorithm devised by Marzari and Vanderbilt (Phys. Rev. B 56(20) 12847) for calculating maximally localised generalised Wannier functions, specifically to determine these functions for optical lattice systems of arbitrary geometry, including those with degenerate lower bands. Moreover, we overcome an issue with the initialisation of the original algorithm to find the maximally localised set without fail. We then present results for a variety of optical lattice systems in one- and two-dimensions, including hexagonal and Kagomé geometries. In each case we use the generalised Wannier functions to calculate the hopping and interaction parameters, and thus determine a reduced form of the system's Hamiltonian that contains only local interactions. We also study two spin-1/2 systems with long-range interactions as paradigm examples of the models that can be simulated using optical lattices loaded with dipolar molecules. We first examine the critical properties of a 1D spin-1/2 Ising chain possessing exponentially decaying interactions as the range of the interactions is increased. Using the infinite density matrix renormalisation group method, we calculate the location of the critical point and observe a smooth approach to the classical mean-field result in the limit of infinite-ranged interactions. We go on to consider the quantum dynamics of a single spin-1/2 coupled to a bath of interacting spins as a model for decoherence in solid state quantum memories. The large degree of symmetry of the bath, described by the infinite-ranged Lipkin-Meshkov-Glick model, allows us to find parameter regimes where the initial qubit state is revived at well-defined times after the qubit preparation. We observe that these times may become independent of the bath size for large baths and thus enable faithful qubit storage even in the presence of strong coupling to the bath.
A quantum simulator is a well-controlled quantum system which can be used to simulate another quantum system. Quantum degenerate gases confined by optical standing waves(optical lattices) have been considered to simulate condensed matter systems. We focus on two issues in this problem. The first one is the realization of interesting quantum phases by engineering Hamiltonians with the cold atoms toolbox. Secondly, the systems we studied are often intractable to analytical methods, which makes it a crucial issue to solve them with numerical methods. For the first issue we find several interesting phases can be studied with cold atoms in optical lattices. We show that a ppp-wave superfluid is stablized through a dissipation blockade mechanism. This mechanism also induces a new insulator formed by ppp-wave Feshbach molecules. We find that the anisotropic nature of interaction between polar molecules or dipolar atoms can be used to realize two charge density waves with different patterns and a supersolid phase which has not been found conclusively in the condensed matter system. Finally, we propose to realize a long sought spin liquid phase with hard-core bosons subject to a spin-dependent lattice and Raman induced hoppings. For the second issue we choose to numerically study these systems with the so-called tensor network algorithm which is a variational method based on the matrix(tensor) product states product states which are designed to approximate generic wave functions from their entanglement properties. In general the tensor network algorithm has advantages that it is applicable beyond one dimension, and can be used to study physical properties in the thermodynamic limit directly. We apply this method to map out the phase diagrams of the above systems. Furthermore, we show that it is capable of capturing the phase diagram of a frustrated magnetism model, the Heisenberg model on a checkerboard lattice. The great controllability and isolation from the environment of a cold atom system offer a playground to study interesting physics in strongly correlated systems. Several proposed control schemes in this thesis have been demonstrated in experiments. By providing detailed evidence from numerical simulations, this work addresses practical routes to novel quantum phases.
Optical lattices make it possible to trap and coherently control large ensembles of ultracold atoms. They provide the possibility to create lattice potentials that mimic the structure of solid-state systems, and to control these potentials dynamically. In this thesis, we study how dynamical manipulations of the lattice geometry can be used to perform different tasks, ranging from quantum information processing to the creation of diatomic molecules. We first examine the dynamical properties of ultracold atoms trapped in a lattice whose periodicity is dynamically doubled. We derive a model describing the dynamics of the atoms during this process, and compute the different interaction parameters of this model. We investigate different ways of using this lattice manipulation to optimise the initialisation time of a Mott-insulating state with one atom per site, and provide a scaling law related to the interaction parameters of the system. We go on to show that entangling operations between the spin of adjacent atoms are realisable with optical lattices forming arrays of double-well potentials. We study the creation of a lattice containing a spin-encoded Bell-pair in each double-well, and show that resilient, highly-entangled many-body states are realisable using lattice manipulations. We show that the creation of cluster-like states encoded on Bell-pairs can be achieved using these systems, and we provide measurement networks that allow the execution of quantum algorithms while maintaining intact the resilience of the system. Finally, we investigate the possibility to create a diatomic molecular state and simulate Fermi systems via the excitation to Rydberg levels of ground-state atoms trapped in optical lattices. We develop a method based on symbolical manipulations to compute the interaction parameters between highly-excited electrons, and evaluate them for different electronic configurations. We use these parameters to investigate the existence of diatomic molecular states with equilibrium distances comparable to typical lattice spacings. Considering the possibility to excite atoms trapped in an optical lattice to Rydberg levels such that the electronic cloud of neighbouring atoms overlap, we propose a model describing their interactions and compute its parameters. If such systems were realised, they would allow the simulation of Fermi systems at a temperature much below the Fermi temperature, thus enabling the observation of quantum phenomena hitherto inaccessible with current technology.
Beautiful experiments have shown that bosons in optical lattices provide a physical system with an unprecedented degree of control; that they can generate strongly correlated states; and that, as long-term goals, they may be useful for simulating other many-body systems, or realising a quantum computer. Recently a practical scheme for measuring temperature in an optical lattice has been demonstrated, which marks an important milestone necessary for the detailed study of the thermodynamics of this system. In this thesis, we consider both the translationally-invariant lattice, and the combined harmonic trap and optical lattice. We use an extended Bose-Hubbard Hamiltonian which goes beyond the usual Bose-Hubbard approach, and is valid for shallower lattices and higher temperatures, by allowing for beyond nearest-neighbour hopping and excited bands, and we have developed an approximation scheme for off-site interactions. We derive the equations of the Popov approximation to the Hartree-Fock-Bogoliubov method for our Hamiltonian, and diagonalise these equations in the local density approximation (LDA). We examine the density of states of the optical lattice in detail and in various limits. We derive new results on the structure of the density of states, and, in the ideal case, we compare the density of states from the full diagonalisation with our LDA calculation. We make an efficient numerical implementation of our theory and compare the results with the full diagonalisation (for the non-interacting case) and with the limited experimental results currently available. We consider the significance of beyond nearest-neighbour hopping and excited bands and illustrate the properties of our model. In contrast to the trapped gas with no lattice, few thermodynamic results for cold bosons in an optical lattice have been calculated. We analytically derive the first practical formula for the critical temperature in an optical lattice by using simplified shapes for the density of states. We derive corrections for the influence of excited bands, the finite-size effect and mean-field interactions. In all of these cases, we compare our results to full numerical calculations and show that the validity range of our method is complementary to that of the effective-mass approximation, so that the simple descriptions extend over a wide range.
We derive ab initio local Hubbard models for several optical-lattice potentials of current interest, including the honeycomb and kagome lattices, verifying their accuracy on each occasion by comparing the interpolated band structures against the originals. To achieve this, we calculate the maximally localized generalized Wannier basis by implementing the steepest-descent algorithm of Marzari and Vanderbilt [Phys. Rev. B 56, 12847 (1997)] directly in one and two dimensions. To avoid local minima we develop an initialization procedure that is both robust and requires no prior knowledge of the optimal Wannier basis.
Inspired by the growing interest in probing many-body phases in novel two-dimensional lattice geometries we investigate the properties of cold atoms as they could be observed in an optical Lieb lattice. We begin by computing Wannier functions localised at individual sites for a realistic experimental setup, and determining coefficients for a Hubbard-like model. Based on this, we show how experiments could probe the robustness of edge states in a Lieb lattice with diagonal boundary conditions to the effects of interactions and realise strongly correlated many-body phases in this geometry. We then generalise this to interacting particles in a half-filled 1D Lieb ladder, where excitations are dominated by flat band states. We show that for strong attractive interactions, pair correlations are enhanced even when there is strong mixing with the Dirac cone. These findings in 1D raise interesting questions about the phases in the full 2D Lieb lattice which we show can be explored in current experiments.
In this thesis, I present my research on the numerical simulation of finite-size strongly-correlated lattice systems using the density matrix renormalisation group (DMRG). Ultracold gases in optical lattices have become the experimental setup of choice to simulate models from condensed-matter physics, because of their high degree of tunability and control. Their inherently finite size and alternative implementation call for a more in-detail study of how to define and characterise the phases of the models that they simulate. I use DMRG to implement lattice Hamiltonians of highly-correlated systems with long-range interactions and identify their ground states on a finite system geometry. I describe in detail the process of constructing long-range Hamiltonians for their use in DMRG. I then apply these numerical methods to two fundamental models. I study the ground state of a fractional quantum Hall system and identify it as the well-known Laughlin state in a still unexplored parameter regime, by calculating its topological entanglement entropy and by using a set of physical observables that are available in a finite cylindrical geometry. I then study a dipolar Bose-Hubbard model and perform a systematic study of the order parameters that can best be used to characterise its phases in an ultracold gas setting by comparing how different types of observables are sensitive to finite-size and boundary effects. My results are meant to provide guidance for future experimental realisations of bosonic lattice models of small sizes.