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arXiv:cond-mat/0610314 · Physical Review A

Energy-dependent effective interactions for dilute many-body systems

Anssi Collin, Pietro Massignan, C. J. Pethick

Published Jan 12, 2007• 68 citations
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Abstract

We address the issue of determining an effective two-body interaction for mean-field calculations of the energies of many-body systems. We show that the effective interaction is proportional to the phase shift and demonstrate this result in the quasiclassical approximation when there is a trapping potential in addition to the short-range interaction between a pair of particles. We calculate numerically energy levels for the case of an interaction with a short-range square well and a harmonic trapping potential and show that the numerical results agree well with the analytical expression. We derive a generalized Gross-Pitaevskii equation which includes effective range corrections and discuss the form of the electron-atom effective interaction to be used in calculations of Rydberg atoms and molecules.

DOI
10.1103/physreva.75.013615

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We address the issue of determining an effective two-body interaction for mean-field calculations of the energies of many-body systems. We show that the effective interaction is proportional to the phase shift and demonstrate this result in the quasiclassical approximation when there is a trapping potential in addition to the short-range interaction between a pair of particles. We calculate numerically energy levels for the case of an interaction with a short-range square well and a harmonic trapping potential and show that the numerical results agree well with the analytical expression. We derive a generalized Gross-Pitaevskii equation which includes effective range corrections and discuss the form of the electron-atom effective interaction to be used in calculations of Rydberg atoms and molecules.
To clarify the relation of energy shifts to scattering phase shifts in one-body and many-body problems, we examine their relation in a number of different situations. We derive, for a particle in a container of arbitrary shape with a short-range scattering center, a general result for the energy eigenvalues in terms of the s-wave scattering phase shift and the eigenstates in the absence of the scatterer. We show that, while the energy shifts for a spherical container are proportional to the phase shift over large ranges, those for a cubic container have a more complicated behavior. We connect our result to the description of energy shifts in terms of the scattering T-matrix. The general relation is extended to problems of particles in traps with smoothly varying potentials, including, e.g., the interaction of a small neutral atom with a Rydberg atom. We then consider the many-body problem for particles with a two-body interaction and show that the free energy change due to the interaction is proportional to an average of a generalized phase shift that includes the effects of the medium. Finally, we discuss why, even though individual energy levels are very sensitive to boundary conditions, the energy of a many-body system is not.
We present an effective potential and the corresponding modified Gross-Pitaevskii equation, which account for the energy dependence of the two-body scattering amplitude through an effective-range expansion. For the ground-state energy of a trapped condensate, the theory leads to what we call a shape-dependent confinement correction that improves agreements with diffusion Monte Carlo calculations. The theory illustrates, for relatively strong confinement and/or high density, how the shape dependence on atom-atom interaction can come into play in a many-atom quantum system.
The energy shift due to the interaction of two particles in a large box is proportional to the free particle scattering phase-shift. This provides an approximation to the effective interaction referred to as the phase-shift approximation. For a many-body fermion system this effective interaction has to be corrected for the Pauli-blocking. It is used to calculate the energy of a spin 1/2 fermion system as a function of the two-body scattering length and effective range. In the unitary limit with scattering length going to infinity and effective range going to zero the energy is 0.540 (in the units of the non-interactiong fermi gas energy) with a pp-ladder summation. Including hh-ladders the energy is 0.570. A smooth crossover from the BCS to the BEC region is observed. Pairing is not included.
The energy spectrum of two short-range interacting particles in a harmonic potential trap has previously been related to free-space scattering phase shifts. But the existing formula for systems with a nonzero interaction range is exact only in the limit of an infinitely shallow trap. Here I provide a systematically improved formula---describing the low-energy dynamics---that enables the use of finite traps. This paves the way for extracting nuclear scattering phase shifts from ab initio nuclear many-body structure calculations, a long-sought goal in nuclear physics. The derivation establishes effective field theory as a powerful framework for studying the connection between structure information of a trapped system (with two or more subclusters) and continuum physics in the fields of both nuclear and condensed-matter physics.
We consider many-body effects on particle scattering in one-, two-, and three-dimensional (3D) Bose gases. We show that at T=0T=0T=0 these effects can be modeled by the simpler two-body T matrix evaluated off the energy shell. This is important in 1D and 2D because the two-body T matrix vanishes at zero energy and so mean-field effects on particle energies must be taken into account to obtain a self-consistent treatment of low-energy collisions. Using the off-shell two-body T matrix we obtain the energy and density dependence of the effective interaction in 1D and 2D and the appropriate Gross-Pitaevskii equations for these dimensions. Our results provide an alternative derivation of those of Kolomeisky and co-workers. We present numerical solutions of the Gross-Pitaevskii equation for a 2D condensate of hard-sphere bosons in a trap. We find that the interaction strength is much greater in 2D than for a 3D gas with the same hard-sphere radius. The Thomas-Fermi regime is, therefore, approached at lower condensate populations and the energy required to create vortices is lowered compared to the 3D case.
A method is proposed for a self-consistent evaluation of the coupling constant in the Gross-Pitaevskii equation without involving a pseudopotential replacement. A renormalization of the coupling constant occurs due to medium effects and the trapping potential, e.g., in quasi-1D or quasi-2D systems. It is shown that a simplified version of the Hartree-Fock-Bogoliubov approximation leads to a variational problem for both the condensate and a two-body wave function describing the behavior of a pair of bosons in the Bose-Einstein condensate. The resulting coupled equations are free of unphysical divergences. Particular cases of this scheme that admit analytical estimations are considered and compared to the literature. In addition to the well-known cases of low-dimensional trapping, crossover regimes can be studied. The values of the kinetic, interaction, external, and release energies in low dimensions are also evaluated and contributions due to short-range correlations are found to be substantial.