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Calculation of electron-impact total-ionization cross sections
Journal article   Open access   Peer reviewed

Calculation of electron-impact total-ionization cross sections

P.L. Bartlett and A.T. Stelbovics
Physical Review A - Atomic, Molecular, and Optical Physics, Vol.66(1)
2002
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Abstract

A computationally efficient analytic form of the Born-approximation electron-impact ionization amplitude is derived for general neutral-atom targets. High-quality Hartree-Fock Slater orbitals are used to model the target wave function. Full orthogonalization of the continuum Coulomb wave to all occupied orbitals of the target atom is enforced. Results are presented for noble gases (Ne, Ar, Kr, and Xe), selected transition metals (Fe, Cu, and Ag), and elements from the fourth, fifth, and sixth columns of the periodic table (Si, Ge, Sn, P, As, Sb, S, Se, and Te), where theoretical comparisons are lacking. Full orthogonalization significantly improves agreement with experimental data for the noble-gas series compared to previous Born models. Overall agreement with all elements is uniformly good and variations within each series are systematic.

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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
Optics
Physics, Atomic, Molecular & Chemical
ESI research areas
Physics
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