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arXiv:1509.09268 · Physical Review A

Two-state Bogoliubov theory of a molecular Bose gas

Brandon M. Peden, Ryan Wilson, Maverick L. McLanahan, Jesse Hall, Seth T. Rittenhouse

Published Dec 17, 2015• 1 citation
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Abstract

We present an analytic Bogoliubov description of a Bose-Einstein condensate of polar molecules trapped in a quasi-two-dimensional geometry and interacting via internal state-dependent dipole-dipole interactions. We derive the mean-field ground-state energy functional, and we derive analytic expressions for the dispersion relations, Bogoliubov amplitudes, and static structure factors. This method can be applied to any homogeneous, two-component system with linear coupling and direct, momentum-dependent interactions. The properties of the mean-field ground state, including polarization and stability, are investigated, and we identify three distinct instabilities: a density-wave rotonization that occurs when the gas is fully polarized, a spin-wave rotonization that occurs near zero polarization, and a mixed instability at intermediate fields. The nature of these instabilities is clarified by means of the real-space density-density correlation functions, which characterize the spontaneous fluctuations of the ground state, and the momentum-space structure factors, which characterize the response of the system to external perturbations. We find that the gas is susceptible to both density-wave and spin-wave responses in the polarized limit but only a spin-wave response in the zero-polarization limit. These results are relevant for experiments with rigid rotor molecules such as RbCs, $\mathrm{\ensuremath{\Lambda}}$-doublet molecules such as ThO that have an anomalously small zero-field splitting, and doublet-$\mathrm{\ensuremath{\Sigma}}$ molecules such as SrF where two low-lying opposite-parity states can be tuned to zero splitting by an external magnetic field.

DOI
10.1103/physreva.92.063624

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•Jan 1, 2013•1 citation
We present an analytic Bogoliubov description of a Bose-Einstein condensate of polar molecules trapped in a quasi-two-dimensional geometry and interacting via internal state-dependent dipole-dipole interactions. We derive the mean-field ground-state energy functional, and we derive analytic expressions for the dispersion relations, Bogoliubov amplitudes, and static structure factors. This method can be applied to any homogeneous, two-component system with linear coupling and direct, momentum-dependent interactions. The properties of the mean-field ground state, including polarization and stability, are investigated, and we identify three distinct instabilities: a density-wave rotonization that occurs when the gas is fully polarized, a spin-wave rotonization that occurs near zero polarization, and a mixed instability at intermediate fields. The nature of these instabilities is clarified by means of the real-space density-density correlation functions, which characterize the spontaneous fluctuations of the ground state, and the momentum-space structure factors, which characterize the response of the system to external perturbations. We find that the gas is susceptible to both density-wave and spin-wave responses in the polarized limit but only a spin-wave response in the zero-polarization limit. These results are relevant for experiments with rigid rotor molecules such as RbCs, \ensuremathΛ\mathrm{\ensuremath{\Lambda}}\ensuremathΛ-doublet molecules such as ThO that have an anomalously small zero-field splitting, and doublet-\ensuremathΣ\mathrm{\ensuremath{\Sigma}}\ensuremathΣ molecules such as SrF where two low-lying opposite-parity states can be tuned to zero splitting by an external magnetic field.
Abstract We consider a BEC of rigid rotor molecules confined to quasi-2D through harmonic trapping. The molecules are subjected to an external electric field which polarizes the gas, and the molecules interact via dipole–dipole interactions. We present a description of the ground state and low-energy excitations of the system including an analysis of the mean-field energy, polarization, and stability. Under large electric fields the gas becomes fully polarized and we reproduce a well known density-wave instability which arises in polar BECs. Under smaller applied electric fields the gas develops an in-plane polarization leading to the emergence of a new global instability as the molecules ‘tilt’. The character of these instabilities is clarified by means of momentum-space density–density structure factors. A peak at zero momentum in the spin–spin structure factor for the in-plane component of the polarization indicates that the tilt instability is a global phonon-like instability.
We investigate the properties of the ground state and low-lying excitations of an oblate Bose-Einstein condensate composed of rigid rotor molecules in the presence of an external polarizing electric field. We build in a quantum model of molecular polarizability by including the full manifold of rotational states. The interplay between spatial and microscopic degrees of freedom via feedback between the molecular polarizability and inter-molecular dipole-dipole interactions leads to a rich quasi-particle spectrum. Under large applied fields, we reproduce the well-understood density-wave rotonization that appears in a fully polarized dipolar BEC, but under smaller applied fields, we predict the emergence of a spin wave instability and possible new stable ground state phases.
This work concerns a theoretical study of a two-component ultra-cold bosonic gas of polarised magnetic dipolar atoms. The atoms interact by short-ranged contact interactions and long-ranged dipole-dipole interactions. The two components can correspond to two different spin-states of a single atomic species or two different atomic species, as realised in recent experiments. Here, we develop a general theory for the ground states and excitations of a two-component dipolar Bose-Einstein condensate. The ground states are described by dipolar Gross-Pitaevskii equations and Bogoliubov-de Gennes equations describe the excitations. We apply these theories to systems in 3D harmonic traps and a uniform planar potential. Specialised numerical methods are developed to provide accurate solutions of these equations, and to deal with the singular dipole-dipole interaction kernel. These methods involve spectral representations based on plane waves and Bessel functions. We also discuss the methods we used for obtaining ground state solutions of the nonlinear Gross-Pitaevskii energy functional. Dipole-dipole interactions can favour spatial structure, as demonstrated in the recent observation of supersolid states of matter in a single-component dipolar gas. In the two-component system these interactions can also favour a ground state with a periodic order in the pseudo-spin density. A two-component system can be either miscible (components overlap) or immiscible (components are separated). Our focus here is in the spin-stripe state, which occurs in a flattened trap geometry and involves an immiscible stripe pattern along one of the weakly trapped or untrapped directions. We examine the dynamical stability conditions of the uniform miscible state in planar confinement, and produce an associated stability phase diagram. We identify the various instabilities and analytical criteria for estimating these. We focus on the occurrence of, and conditions that favour, density-roton or spin-roton excitations, anticipating that the softening of these excitations will lead to structured ground states. To characterize these excitations we introduce density and spin dynamical structure factors, which can be measured in experiments using Bragg spectroscopy. Building on the stability phase diagram we compute ground states where the immiscible state is unstable to spin-rotons, finding triangular and stripe immiscible states with a length scale set by the confinement and interactions. We find that the transition to the stripe state is continuous and coincides with the spin-roton softening in the uniform miscible state. We study the excitations of the spin stripe state which exhibits three gapless excitation branches arising from the spontaneous broken symmetries. We identify a balanced parameter regime, where the excitations exhibit a nonsymmorphic symmetry (a symmetry is nonsymmorphic when it is a combination of point-group operations with nonprimitive lattice translations, i.e. not an integer multiple of lattice constants), which is revealed in the density and spin dynamical structure factors. We also consider the dynamics of the system following a quench from the uniform to immiscible stripe states. In the early time dynamics, a spin-stripe state is formed in a such way that the stripe order only extends over small domains. In subsequent dynamics, these domain sizes grow as the system phase-orders towards its equilibrium state. We identify the relevant topological defects such as disclinations, dislocations and grain boundaries. Using ensembles of large scale simulations we show that dynamical scaling holds for the growth of order.
Ultra-cold spinor Bose gases present rich physics due to the special combination of superfluidity and magnetism in a quantum system. This system was first realized in 1998 by confining a Bose-Einstein condensate in an all-optical trap.\nIn this thesis, we consider the fluctuations of observable quantities in a spin-1 Bose gas. Understanding how fluctuations arise due to the spin excitations of the condensate is important because it offers an insight into how measurement noise reveals the many-body physics of the system.\nTo begin, we present the mean-field and Bogoliubov theory of a uniform spin-1 Bose gas subject to a constant magnetic field, describing the condensate and its low-energy collective excitations.\nWe then develop a formalism to describe the fluctuations in a general density-like observable. We start from the two-point correlation function and cast it in the form of a generalised static structure factor determined by the three Bogoliubov quasiparticle excitation branches. We derive analytic results for the fluctuation amplitudes and the temperature-dependent static structure factors for observables of total density and the three spin densities.\nFor all four magnetic phases, we analyse the spinor order parameter and quasiparticle spectra while numerically mapping out the fluctuation amplitudes and static structure factors for the total and spin density operators.\nWe describe the fluctuations in experimental measurements made within finite cells, which is an important step to making meaningful predictions for experiments. We consider cylindrical cells and gaussian cells as two limiting cases. We apply this analysis to an experimentally realisable system of a quasi-2D spinor gas in a harmonic trap, comparing extensive numeric results with analytic limits.
This thesis contains a study of ultracold paramagnetic atoms or polar molecules characterized by a long-range anisotropic dipolar interaction. We particularly focus on two aspects of ultracold dipolar gases. In the first problem the ground state properties of dipolar Bose-Einstein condensates (BEC) are investigated. This problem has gained importance due to recent experimental advances in achieving a condensate of Chromium atoms and ongoing research to produce quantum degenerate polar molecules. In the second problem, we consider possible applications of ultracold polar molecules to rotation sensing and interferometry. First, we concentrate on the interplay between the trapping geometry and dipole-dipole interaction for a polarized dipolar bosonic condensate. As the dipole-dipole interaction is attractive along the polarized direction, the lowest energy state of the BEC is always a collapsed state. However by applying a trapping potential along the polarization direction it is possible to achieve a metastable dipolar BEC. By numerically solving the Gross-Pitaevskii equation, we show that below a critical interaction strength, a metastable state exists depending on the trapping geometry. We also show that a novel feature of dipolar BEC is the appearance of different structural metastable ground states for certain combinations of trapping geometry and particle number. Next, by mixing in single component fermions we show that dipolar BEC can be stabilized against collapse in pancake shaped or cylindrical traps. We also show that the excitation spectrum of the BEC may have a minimum for non-zero momentum, termed a “roton minimum”. This minimum leads to a transition to stable or metastable density-wave states depending on the density of the bosons and boson-fermion interaction strength. In the second problem, we study a proposal for a large-angle coherent beam splitter for polar molecules. By taking into account the effect of a quasi-static external electric field on the rotational levels of the polarized molecules we show that it is possible to coherently split a stationary cloud of molecules into two counter-propagating components. We then investigate the effect of longitudinal acceleration on the transverse motion of the particles, assuming that the longitudinal motion of the molecules can be approximated classically by a wave packet with some mean velocity while the transverse motion is governed by quantum mechanics. We propose a particular time-dependent shape of acceleration to minimize the excitations in the transverse motion. Our theory is also applicable to the general case of particles moving along a circular guide with time-dependent longitudinal velocity. In addition, we include the effects of velocity fluctuations due to noise in the accelerating field.
The work of this thesis concerns the properties of a Bose gas of polarised dipoles that have long-range and anisotropic interactions. Our work is divided into two parts. First, the stability of a dipolar Bose gas at finite temperature (both above and below the critical Bose-Einstein condensation (BEC) temperature Tc). Second, the fluctuations of a dipolar BEC at zero and small finite temperature (T ≪ Tc) in a regime where rotonic excitations emerge. \n \nPart I: Stability of a Trapped Finite Temperature Dipolar Bose Gas: Above Tc we implement a semiclassical Hartree-Fock theory and characterise the dependence of the stability boundary on temperature, trap geometry and the strength of the dipole-dipole interaction and contact interaction. We find that stability is greatly enhanced above Tc and that trap geometry continues to play a key role. Furthermore, we find that for oblate traps a novel double instability feature emerges. \nTo extend our stability analysis to the low temperature regime, T < Tc, we develop a beyond semiclassical Hartree theory. We use this to characterise the stability boundary as a function of geometry. Interestingly, we find large beyond semiclassical effects above Tc for prolate trapping geometries. We characterise thermal effects on biconcave condensate states. \n \nPart II: Rotons and Fluctuations in a Trapped Dipolar Condensate: To study density fluctuations we implement a numerical scheme to solve the Gross-Pitaevskii equation and the Bogoliubov de Gennes equations. We find that the phonon and roton gases spatially separate and we characterise the role of the anomalous density on the density fluctuations of the thermally activated rotons. We develop a numerical scheme that calculates number fluctuations within cells of various shapes and sizes, and find a strong peak in the fluctuations when the cell size is around half the roton wavelength, which should be detectable by current experiments. By tailoring the cell shape we predict that experiments should be able to detect the effects of individual roton modes. \nFor the study of zero temperature fluctuations we deploy the Gross-Pitaevskii and Bogoliubov de Gennes equations to calculate the dynamic and static structure factors for a highly oblate BEC. We find a clear signature of the roton gas dispersion relation within the structure factors. This signature should be detectible in current experiments using Bragg spectroscopy.