Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact

We introduce two models for the computation of direct ionization cross sections by positron impact over a wide range of collision energies. The models are based on the binary-encounter-Bethe model and take into account an extension of the Wannier theory. The cross sections computed with these models...

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Main Authors: Małgorzata Franz, Katarzyna Wiciak-Pawłowska, Jan Franz
Format: Article
Language:English
Published: MDPI AG 2021-11-01
Series:Atoms
Subjects:
Online Access:https://www.mdpi.com/2218-2004/9/4/99
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author Małgorzata Franz
Katarzyna Wiciak-Pawłowska
Jan Franz
author_facet Małgorzata Franz
Katarzyna Wiciak-Pawłowska
Jan Franz
author_sort Małgorzata Franz
collection DOAJ
description We introduce two models for the computation of direct ionization cross sections by positron impact over a wide range of collision energies. The models are based on the binary-encounter-Bethe model and take into account an extension of the Wannier theory. The cross sections computed with these models show good agreement with experimental data. The extensions improve the agreement between theory and experiment for collision energies between the first ionization threshold and the peak of the cross section. The models are based on a small set of parameters, which can be computed with standard quantum chemistry program packages.
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spelling doaj.art-5c4691c148244d689a529f5aa7a7c43f2023-11-23T03:48:11ZengMDPI AGAtoms2218-20042021-11-01949910.3390/atoms9040099Binary-Encounter Model for Direct Ionization of Molecules by Positron-ImpactMałgorzata Franz0Katarzyna Wiciak-Pawłowska1Jan Franz2Faculty of Applied Physics and Mathematics, Gdańsk University of Technology, 80-233 Gdańsk, PolandFaculty of Applied Physics and Mathematics, Gdańsk University of Technology, 80-233 Gdańsk, PolandFaculty of Applied Physics and Mathematics, Gdańsk University of Technology, 80-233 Gdańsk, PolandWe introduce two models for the computation of direct ionization cross sections by positron impact over a wide range of collision energies. The models are based on the binary-encounter-Bethe model and take into account an extension of the Wannier theory. The cross sections computed with these models show good agreement with experimental data. The extensions improve the agreement between theory and experiment for collision energies between the first ionization threshold and the peak of the cross section. The models are based on a small set of parameters, which can be computed with standard quantum chemistry program packages.https://www.mdpi.com/2218-2004/9/4/99positron impact ionizationpositron-molecule scatteringbinary-encounter-Bethe
spellingShingle Małgorzata Franz
Katarzyna Wiciak-Pawłowska
Jan Franz
Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
Atoms
positron impact ionization
positron-molecule scattering
binary-encounter-Bethe
title Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
title_full Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
title_fullStr Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
title_full_unstemmed Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
title_short Binary-Encounter Model for Direct Ionization of Molecules by Positron-Impact
title_sort binary encounter model for direct ionization of molecules by positron impact
topic positron impact ionization
positron-molecule scattering
binary-encounter-Bethe
url https://www.mdpi.com/2218-2004/9/4/99
work_keys_str_mv AT małgorzatafranz binaryencountermodelfordirectionizationofmoleculesbypositronimpact
AT katarzynawiciakpawłowska binaryencountermodelfordirectionizationofmoleculesbypositronimpact
AT janfranz binaryencountermodelfordirectionizationofmoleculesbypositronimpact