Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Log inSign up
Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Blog
Job Board
Q3AS

© 2026 Aqora Quantum S.A.S.

TermsPrivacyLegal Notice

International Symposium on Molecular Spectroscopy (ISMS)

Adaptive Analytic Mapping Procedures for Simple and Accurate Calculation of Scattering Lengths and Photoassociation Absorption Intensities

Robert J. Le Roy, Vladimir V. Meshkov, Andrej V. Stolyarov

Published Jun 1, 2009• 0 citations
OpenAlex

Related papers

Determination of the Scattering Lengths of 39K Scattering Lengths from K2 1u Photoassociation Lineshapes

Carl J. Williams, Eite Tiesinga, Paul S. Julienne +3 more

Physical Review A•Jan 1, 1999•1 citation

s -wave scattering length of a Gaussian potential

Péter Jeszenszki, Alexander Yu. Cherny, Joachim Brand

We provide accurate expressions for the $s$-wave scattering length for a Gaussian potential well in one, two, and three spatial dimensions. The Gaussian potential is widely used as a pseudopotential in the theoretical description of ultracold-atomic gases, where the $s$-wave scattering length is a physically relevant parameter. We first describe a numerical procedure to compute the value of the $s$-wave scattering length from the parameters of the Gaussian, but find that its accuracy is limited in the vicinity of singularities that result from the formation of new bound states. We then derive simple analytical expressions that capture the correct asymptotic behavior of the $s$-wave scattering length near the bound states. Expressions that are increasingly accurate in wide parameter regimes are found by a hierarchy of approximations that capture an increasing number of bound states. The small number of numerical coefficients that enter these expressions is determined from accurate numerical calculations. The approximate formulas combine the advantages of the numerical and approximate expressions, yielding an accurate and simple description from the weakly to the strongly interacting limit.

arXiv:1802.07063•Physical Review A•Apr 23, 2018•29 citations

Cold collisions of ground-state calcium atoms in a laser field: A theoretical study

Béatrice Bussery‐Honvault, Jean–Michel Launay, Robert Moszyński

State-of-the-art ab initio techniques have been applied to compute the potential-energy curves for the ground $X{}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ and excited ${}^{1}{\ensuremath{\Pi}}_{g}(4s3d)$ states of the calcium dimer in the Born-Oppenheimer approximation. The weakly bound ground state was calculated by symmetry-adapted perturbation theory, while the strongly bound excited state was computed using a combination of the linear-response theory within the coupled-cluster singles and doubles framework for the core-valence electronic correlation and of the full configuration interaction for the valence-valence correlation. The ground-state potential has been corrected by considering the relativistic terms resulting from the first-order many-electron Breit theory, and the retardation corrections. The magnetic electronic transition dipole moment governing the ${}^{1}{\ensuremath{\Pi}}_{g}{\ensuremath{\leftarrow}}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ transitions has been obtained as the first residue of the polarization propagator computed with the coupled-cluster method restricted to single and double excitations. The computed energies and transition moments have been analytically fitted and used in the dynamical calculations of the rovibrational energy levels, ground-state scattering length, photoassociation intensities at ultralow temperatures, and spontaneous emission coefficients from the ${}^{1}{\ensuremath{\Pi}}_{g}(4s3d)$ to the $X{}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ state. The spectroscopic constants of the theoretical ground-state potential are in a good agreement with the experimental values derived from the Fourier-transform spectra [O. Allard et al., Eur. Phys. J. D (to be published)]. The theoretical s-wave scattering length for the ground state is $a=44\mathrm{bohrs},$ suggesting that it should be possible to obtain a stable Bose-Einstein condensate of calcium atoms. Finally, the computed photoassociation intensities and spontaneous emission coefficients suggest that it should be possible to obtain cold calcium molecules by photoassociation of cold atoms to the first ${}^{1}{\ensuremath{\Pi}}_{g}$ state followed by a spontaneous emission to the ground state.

Physical Review A•Sep 23, 2003•51 citations

Photoassociation Spectroscopy: Determination of Parameters of Potentials of Diatomic Molecules

James Gary Eden, Henry Tran, V. S. Zuev

Journal of Russian Laser Research•Mar 1, 1998•1 citation

Linear and Nonlinear Optical Absorptions in Semiparabolic Quantum Wells

ZHANGLi, XIEHong-Jing

By using the compact density matrix approach and iterative procedure, a detailed procedure for the calculation of the linear and nonlinear optical absorption coefficients was given in the electric-field-biased semi parabolic quantum wells(QWs). The simple analytical formulas for the linear and nonlinear optical absorption coefficients in the systems are also deduced. Numerical result on typical GaAs materials shows that,the linear and nonlinear optical absorption coefficients sensitively depend on the applied electric field and the confined potential frequency of the semiparabolic QWs systems as well as the incident optics beam intensity.

Journal of Optoelectronics·laser•Jan 1, 2004•0 citations

Quantum Calculations including Hyperfine Structure in Photoassociation Spectra

Eite Tiesinga, Carl J. Williams, Paul S. Julienne

APS•May 1, 1996•0 citations
We provide accurate expressions for the sss-wave scattering length for a Gaussian potential well in one, two, and three spatial dimensions. The Gaussian potential is widely used as a pseudopotential in the theoretical description of ultracold-atomic gases, where the sss-wave scattering length is a physically relevant parameter. We first describe a numerical procedure to compute the value of the sss-wave scattering length from the parameters of the Gaussian, but find that its accuracy is limited in the vicinity of singularities that result from the formation of new bound states. We then derive simple analytical expressions that capture the correct asymptotic behavior of the sss-wave scattering length near the bound states. Expressions that are increasingly accurate in wide parameter regimes are found by a hierarchy of approximations that capture an increasing number of bound states. The small number of numerical coefficients that enter these expressions is determined from accurate numerical calculations. The approximate formulas combine the advantages of the numerical and approximate expressions, yielding an accurate and simple description from the weakly to the strongly interacting limit.
State-of-the-art ab initio techniques have been applied to compute the potential-energy curves for the ground $X{}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ and excited ${}^{1}{\ensuremath{\Pi}}_{g}(4s3d)$ states of the calcium dimer in the Born-Oppenheimer approximation. The weakly bound ground state was calculated by symmetry-adapted perturbation theory, while the strongly bound excited state was computed using a combination of the linear-response theory within the coupled-cluster singles and doubles framework for the core-valence electronic correlation and of the full configuration interaction for the valence-valence correlation. The ground-state potential has been corrected by considering the relativistic terms resulting from the first-order many-electron Breit theory, and the retardation corrections. The magnetic electronic transition dipole moment governing the ${}^{1}{\ensuremath{\Pi}}_{g}{\ensuremath{\leftarrow}}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ transitions has been obtained as the first residue of the polarization propagator computed with the coupled-cluster method restricted to single and double excitations. The computed energies and transition moments have been analytically fitted and used in the dynamical calculations of the rovibrational energy levels, ground-state scattering length, photoassociation intensities at ultralow temperatures, and spontaneous emission coefficients from the ${}^{1}{\ensuremath{\Pi}}_{g}(4s3d)$ to the $X{}^{1}{\ensuremath{\Sigma}}_{g}^{+}$ state. The spectroscopic constants of the theoretical ground-state potential are in a good agreement with the experimental values derived from the Fourier-transform spectra [O. Allard et al., Eur. Phys. J. D (to be published)]. The theoretical s-wave scattering length for the ground state is a=44bohrs,a=44\mathrm{bohrs},a=44bohrs, suggesting that it should be possible to obtain a stable Bose-Einstein condensate of calcium atoms. Finally, the computed photoassociation intensities and spontaneous emission coefficients suggest that it should be possible to obtain cold calcium molecules by photoassociation of cold atoms to the first ${}^{1}{\ensuremath{\Pi}}_{g}$ state followed by a spontaneous emission to the ground state.
By using the compact density matrix approach and iterative procedure, a detailed procedure for the calculation of the linear and nonlinear optical absorption coefficients was given in the electric-field-biased semi parabolic quantum wells(QWs). The simple analytical formulas for the linear and nonlinear optical absorption coefficients in the systems are also deduced. Numerical result on typical GaAs materials shows that,the linear and nonlinear optical absorption coefficients sensitively depend on the applied electric field and the confined potential frequency of the semiparabolic QWs systems as well as the incident optics beam intensity.