Efficient calculation of Rayleigh and Raman scattering

We present two methods for computing the Rayleigh and Raman scattering cross sections for photon scattering on atomic hydrogen or hydrogenlike systems. Both methods are applicable for incident photon energies above the ionization threshold. The first method implements the well-known Gaussian quadrat...

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Main Authors: McNamara, K., Fursa, Dmitry, Bray, Igor
Format: Journal Article
Published: 2018
Online Access:http://hdl.handle.net/20.500.11937/72983
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author McNamara, K.
Fursa, Dmitry
Bray, Igor
author_facet McNamara, K.
Fursa, Dmitry
Bray, Igor
author_sort McNamara, K.
building Curtin Institutional Repository
collection Online Access
description We present two methods for computing the Rayleigh and Raman scattering cross sections for photon scattering on atomic hydrogen or hydrogenlike systems. Both methods are applicable for incident photon energies above the ionization threshold. The first method implements the well-known Gaussian quadrature approach to deal with principal value integration and relies on evaluation of the exact eigenfunctions of hydrogen. The second, more computationally efficient approach uses a finite-L2 basis expansion of the target and applies complex exterior scaling methods to accurately account for the contribution of the intermediate continuum states. This method is much more general in that it does not rely on analytic solutions to the Hamiltonian, or evaluation of any special functions, and is expected to be applicable to more complex systems where exact wave functions are cumbersome to evaluate. Both methods are in complete agreement with previous work based on analytical representations of the Green's function or the dipole matrix elements. Rayleigh, Raman, and photoionization cross sections for scattering on the first few excited states of atomic hydrogen are presented and compared with previous results where available.
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spelling curtin-20.500.11937-729832019-05-09T01:49:12Z Efficient calculation of Rayleigh and Raman scattering McNamara, K. Fursa, Dmitry Bray, Igor We present two methods for computing the Rayleigh and Raman scattering cross sections for photon scattering on atomic hydrogen or hydrogenlike systems. Both methods are applicable for incident photon energies above the ionization threshold. The first method implements the well-known Gaussian quadrature approach to deal with principal value integration and relies on evaluation of the exact eigenfunctions of hydrogen. The second, more computationally efficient approach uses a finite-L2 basis expansion of the target and applies complex exterior scaling methods to accurately account for the contribution of the intermediate continuum states. This method is much more general in that it does not rely on analytic solutions to the Hamiltonian, or evaluation of any special functions, and is expected to be applicable to more complex systems where exact wave functions are cumbersome to evaluate. Both methods are in complete agreement with previous work based on analytical representations of the Green's function or the dipole matrix elements. Rayleigh, Raman, and photoionization cross sections for scattering on the first few excited states of atomic hydrogen are presented and compared with previous results where available. 2018 Journal Article http://hdl.handle.net/20.500.11937/72983 10.1103/PhysRevA.98.043435 restricted
spellingShingle McNamara, K.
Fursa, Dmitry
Bray, Igor
Efficient calculation of Rayleigh and Raman scattering
title Efficient calculation of Rayleigh and Raman scattering
title_full Efficient calculation of Rayleigh and Raman scattering
title_fullStr Efficient calculation of Rayleigh and Raman scattering
title_full_unstemmed Efficient calculation of Rayleigh and Raman scattering
title_short Efficient calculation of Rayleigh and Raman scattering
title_sort efficient calculation of rayleigh and raman scattering
url http://hdl.handle.net/20.500.11937/72983