Total electron ionization cross-sections for neutral molecules relevant to astrochemistry

被引:8
|
作者
Heathcote, David [1 ]
Vallance, Claire [1 ]
机构
[1] Univ Oxford, Dept Chem, Chem Res Lab, 12 Mansfield Rd, Oxford OX1 3TA, England
基金
英国工程与自然科学研究理事会;
关键词
electron ionization cross-section; astrochemistry; binary-encounter Bethe model; GAUSSIAN-BASIS SETS; IMPACT IONIZATION; COLOGNE DATABASE; SPECTROSCOPY; CO;
D O I
10.1088/1361-6455/aadd42
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The binary-encounter Bethe model developed by Kim and Rudd (1994 Phys. Rev. A 50 3954-67), Hwang et al (1996 J. Chem. Phys. 104 2956-66) has previously been used successfully to predict total electron ionisation cross-sections for a wide variety of molecules. Here, we present total electron ionisation cross-sections calculated using the binary-encounter-Bethe model for a range of neutral molecules found in the interstellar medium, planetary and cometary atmospheres, and circumstellar shells. Many of these cross-sections are not amenable to experimental measurement due to the fact that the molecules of interest are highly chemically unstable under terrestrial conditions.
引用
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页数:9
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