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arXiv:cond-mat/0212597 · Physical Review A

Anisotropic pseudopotential for polarized dilute quantum gases

Andrei Derevianko

Published Mar 25, 2003• 69 citations
arXivHTMLPDF

Abstract

An anisotropic pseudopotential arising in the context of collisions of two particles polarized by an external field is rigorously derived and its properties are investigated. Such a low-energy pseudopotential may be useful in describing collective properties of dilute quantum gases, such as molecules polarized by an electric field or metastable ${}^{3}{P}_{2}$ atoms polarized by a magnetic field. The pseudopotential is expressed in terms of the reactance (K) matrix and derivatives of the Dirac $\ensuremath{\delta}$ function. In most applications, it may be represented as a sum of a traditional spherically symmetric contact term and an anisotropic part. The former contribution may be parametrized by a generalized scattering length. The anisotropic part of the pseudopotential may be characterized by the off-diagonal scattering length for dipolar interactions and off-diagonal scattering volume for quadrupolar interactions. The two-body matrix element of the pseudopotential in a basis of plane waves is also derived.

DOI
10.1103/physreva.67.033607

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An anisotropic pseudopotential arising in the context of collisions of two particles polarized by an external field is rigorously derived and its properties are investigated. Such a low-energy pseudopotential may be useful in describing collective properties of dilute quantum gases, such as molecules polarized by an electric field or metastable 3P2{}^{3}{P}_{2}3P2​ atoms polarized by a magnetic field. The pseudopotential is expressed in terms of the reactance (K) matrix and derivatives of the Dirac \ensuremathδ\ensuremath{\delta}\ensuremathδ function. In most applications, it may be represented as a sum of a traditional spherically symmetric contact term and an anisotropic part. The former contribution may be parametrized by a generalized scattering length. The anisotropic part of the pseudopotential may be characterized by the off-diagonal scattering length for dipolar interactions and off-diagonal scattering volume for quadrupolar interactions. The two-body matrix element of the pseudopotential in a basis of plane waves is also derived.
Motivated by the recent progress in cooling and trapping polar molecules, we present a simplified version of the rigorous contact pseudopotential for anisotropically-interacting polarized particles [A. Derevianko, Phys. Rev. A 67, 033607 (2003); Phys. Rev. A 72, 039901(E) (2005)]. The simplifications are carried out for a practically important case of harmonically confined particles described by sufficiently smooth wavefunctions. The resulting contact pseudo-potential depends on the K-matrix of the underlying scattering process and is represented as a sum over pairs of partial waves coupled by the collision. The contribution of each pair of the coupled waves (l and l') involves a tensor product of derivatives of orders l and l'. The asymmetry in the derivatives reflects the anisotropy of the original interaction potential: there is a preferential appearance of the derivatives along the polarizing field.
A microscopic description of the zero-energy two-body ground state and many-body static properties of anisotropic homogeneous gases of bosonic dipoles in two dimensions at low densities is presented and discussed. By changing the polarization angle with respect to the plane, we study the impact of the anisotropy, present in the dipole-dipole interaction, on the energy per particle, comparing the results with mean-field predictions. We restrict the analysis to the regime where the interaction is always repulsive, although the strength of the repulsion depends on the orientation with respect to the polarization field. We present a series expansion of the solution of the zero-energy two-body problem, which allows us to find the scattering length of the interaction and to build a suitable Jastrow factor that we use as a trial wave function for both a variational and diffusion Monte Carlo simulation of the infinite system. We find that the anisotropy has an almost negligible impact on the ground-state properties of the many-body system in the universal regime where the scattering length governs the physics of the system. We also show that scaling in the gas parameter persists in the dipolar case up to values where other isotropic interactions with the same scattering length yield different predictions.
We present a zero-range pseudopotential applicable for all partial wave interactions between neutral atoms. For p and d waves, we derive effective pseudopotentials, which are useful for problems involving anisotropic external potentials. Finally, we consider two nontrivial applications of the p-wave pseudopotential: we solve analytically the problem of two interacting spin-polarized fermions confined in a harmonic trap, and we analyze the scattering of p-wave interacting particles in a quasi-two-dimensional system.
Abstract Quantum gases of ultracold polar molecules have novel properties because of the strong dipolar forces between molecules. Current experiments shield the molecules from destructive collisions by engineering long-range repulsive interactions using microwave or static electric fields. These shielding methods produce interaction potentials with large repulsive cores that are not well described with contact potentials. In this paper we explore the anisotropic interaction potentials that arise for pairs of polar molecules shielded with static electric fields. We derive computationally inexpensive approximations for the potentials that are suitable for use in calculations of many-body properties. The interaction potentials for molecules shielded with static fields are substantially different from those that arise from microwave shielding and will produce quite different many-body physics.
We analytically derive the general pseudopotential operator of an arbitrary isotropic interaction for particles confined in two-dimensional (2D) systems using the frame work developed by Huang and Yang for three-dimensional scattering. We also analytically derive the low-energy dependence of the scattering phase shift for an arbitrary interaction with a power-law decaying tail, ${V}_{2\text{D}}(\ensuremath{\rho})\ensuremath{\propto}{\ensuremath{\rho}}^{\ensuremath{-}\ensuremath{\alpha}}$ (for $\ensuremath{\alpha}>2$). We apply our results to the 2D dipolar gases $(\ensuremath{\alpha}=3)$ as an example, calculating the momentum and dipole moment dependences of the pseudopotential for both sss- and ppp-wave scattering channels if the two scattering particles are in the same 2D layer. Results for the sss-wave scattering between particles in two different (parallel) layers are also investigated. Our results can be directly applied to the systems of dipolar atoms and/or polar molecules in a general 2D geometry.
The contact interaction is often used in modeling ultracold atomic gases, although it leads to pathological behavior arising from the divergence of the many-body wave function when two particles coalesce. This makes it difficult to use this model interaction in quantum Monte Carlo and other popular numerical methods. Researchers therefore model the contact interaction with pseudopotentials, such as the square well potential, whose scattering properties deviate markedly from those of the contact potential. In this article, we propose a family of pseudopotentials that reproduce the scattering phase shifts of the contact interaction up to a hundred times more accurately than the square well potential. Moreover, the pseudopotentials are smooth, resulting in significant improvements in efficiency when used in numerical calculations.