Journal article
Born total ionisation cross sections: An algebraic computing program using Maple
Computer Physics Communications, Vol.154(2), pp.159-174
2003
Abstract
Born total ionization cross section was calculated by an algebraic computing program using Maple. The atomic orbitals were approximated by Hartree-Fock Slater functions, and the ejected electron was modeled by a hydrogenic Coulomb wave. The numerical integrations were performed using FORTRAN by automatically converting the analytic matrix element for each orbital into a FORTRAN subroutine.
Details
- Title
- Born total ionisation cross sections: An algebraic computing program using Maple
- Authors/Creators
- P.L. Bartlett (Author/Creator) - Murdoch UniversityA.T. Stelbovics (Author/Creator) - Murdoch University
- Publication Details
- Computer Physics Communications, Vol.154(2), pp.159-174
- Publisher
- Elsevier
- Identifiers
- 991005541269907891
- Copyright
- © 2003 Elsevier B.V.
- Murdoch Affiliation
- Murdoch University
- Language
- English
- Resource Type
- Journal article
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- Collaboration types
- Domestic collaboration
- Citation topics
- 2 Chemistry
- 2.15 Physical Chemistry
- 2.15.664 Dissociative Electron Attachment
- Web Of Science research areas
- Computer Science, Interdisciplinary Applications
- Physics, Mathematical
- ESI research areas
- Physics