Time-dependent spin-density-functional-theory description of He+-He collisions

Matthew Baxter, Tom Kirchner, and Eberhard Engel
Phys. Rev. A 96, 032708 – Published 12 September 2017

Abstract

Theoretical total cross-section results for all ionization and capture processes in the He+-He collision system are presented in the approximate impact energy range of 10–1000 keV/amu. Calculations were performed within the framework of time-dependent spin-density functional theory. The Krieger-Li-Iafrate approximation was used to determine an accurate exchange-correlation potential in the exchange-only limit. The results of two models, one where electron translation factors in the orbitals used to calculate the potential are ignored and another where partial electron translation factors are included, are compared with available experimental data as well as a selection of previous theoretical calculations.

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  • Received 24 July 2017

DOI:https://doi.org/10.1103/PhysRevA.96.032708

©2017 American Physical Society

Physics Subject Headings (PhySH)

Atomic, Molecular & Optical

Authors & Affiliations

Matthew Baxter* and Tom Kirchner

  • Department of Physics and Astronomy, York University, Toronto, Ontario, Canada M3J 1P3

Eberhard Engel

  • Center for Scientific Computing, J. W. Goethe-Universität, D-60438 Frankfurt/Main, Germany

  • *baxterma@yorku.ca
  • tomk@yorku.ca

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Issue

Vol. 96, Iss. 3 — September 2017

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