Magnetically quantized continuum distorted-wave theory in atomic and molecular collisions


Autoria(s): O'Rourke, Sheelagh; McSherry, D.M.; Crothers, Derrick
Data(s)

15/09/2004

Resumo

The continuum distorted-wave eikonal initial-state (CDW-EIS) theory of Crothers and McCann (J Phys B 1983, 16, 3229) used to describe ionization in ion-atom collisions is generalized (G) to GCDW-EIS to incorporate the azimuthal angle dependence of each CDW in the final-state wave function. This is accomplished by the analytic continuation of hydrogenic-like wave functions from below to above threshold, using parabolic coordinates and quantum numbers including magnetic quantum numbers, thus providing a more complete set of states. At impact energies lower than 25 keVu(-1), the total ionization cross-section falls off, with decreasing energy, too quickly in comparison with experimental data. The idea behind and motivation for the GCDW-EIS model is to improve the theory with respect to experiment by including contributions from nonzero magnetic quantum numbers. We also therefore incidentally provide a new derivation of the theory of continuum distorted waves for zero magnetic quantum numbers while simultaneously generalizing it. (C) 2004 Wiley Periodicals, Inc.

Identificador

http://pure.qub.ac.uk/portal/en/publications/magnetically-quantized-continuum-distortedwave-theory-in-atomic-and-molecular-collisions(1ca8585f-a7f5-42b1-b6cb-1219e5950304).html

http://www.scopus.com/inward/record.url?scp=4544342497&partnerID=8YFLogxK

Idioma(s)

eng

Direitos

info:eu-repo/semantics/restrictedAccess

Fonte

O'Rourke , S , McSherry , D M & Crothers , D 2004 , ' Magnetically quantized continuum distorted-wave theory in atomic and molecular collisions ' International Journal of Quantum Chemistry , vol 99 , no. 5 SPEC. ISS. , pp. 569-576 .

Palavras-Chave #/dk/atira/pure/subjectarea/asjc/1600/1606 #Physical and Theoretical Chemistry
Tipo

article