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Bulletin of the American Physical Society

Multiscale quantum defect theory for two atoms in a trap

Yujun Chen, Bo Gao

Published May 19, 2005• 0 citations
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We present a multiscale quantum-defect theory for two identical atoms in a symmetric harmonic trap that combines the quantum-defect theory for the van der Waals interaction [B. Gao, Phys. Rev. A 64, 010701(R) (2001)] at short distances with a quantum-defect theory for the harmonic trapping potential at large distances. The theory provides a systematic understanding of two atoms in a trap, from deeply bound molecular states and states of different partial waves, to highly excited trap states. It shows, e.g., that a strong ppp-wave pairing can lead to a lower energy state around the threshold than a sss-wave pairing.
We present a unified exact analytic solution of the radial Schrödinger equation with a class of four long-range potentials, three of which are two-scale. The physics of different potentials are encapsulated in the solution variable and parameters. Based on this solution and its asymptotic behaviors, we generalize Bo Gao’s formulation of quantum defect theory for single-scale potentials to two-scale regime. As an application of this two-scale quantum defect theory, we propose a concept of harmonic oscillator quantum defect of energy levels in a spherical harmonic trap, which characterizes the effect of the two-body interactions on their trap states. This concept is a generalization of the standard quantum defect for Coulomb potential, with a distinct feature that the equations followed by the two types of quantum defects induced by the potentials under study are formally the same yet with different parameters. Examples of these two quantum defects are illustrated for Rb and Cs atoms.
We present a variational Monte Carlo (VMC) method that works equally well for the ground and the excited states of a quantum system. The method is based on the minimization of the variance of energy, as opposed to the energy itself in standard methods. As a test, it is applied to the investigation of the universal spectrum at the van der Waals length scale for two identical Bose atoms in a symmetric harmonic trap, with results compared to the basically exact results obtained from a multiscale quantum-defect theory.