Calculation of electron-impact ionization of various benzene derivatives

Author:

Krishnadas AnirudhORCID,Sinha NidhiORCID,Kirchner TomORCID,Antony BobbyORCID

Abstract

Abstract Calculations of the electron-impact ionization cross-section of pyrene, anthracene, benzoyl chloride, benzophenone, and phthalonitrile are reported over a wide energy range. A comparison of theoretical models, viz. spherical complex optical potential (SCOP), pixel counting method (PCM), and the binary encounter Bethe (BEB) model is carried out. SCOP calculations provide the inelastic cross-section, and the ionization cross-section is extracted from it. This result is modified with PCM, a model previously applied to ion collisions which takes geometric screening corrections into account. The BEB model is used as an independent approach to calculate the ionization cross-section. It is demonstrated that all model results are in reasonable agreement with each other. Comparison is also made with other theoretical data where available.

Funder

Natural Sciences and Engineering Research Council of Canada

Publisher

IOP Publishing

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