Theoretical study of electron-induced vibrational excitation of NO2

被引:5
作者
Liu, Hainan [1 ]
dos Santos, Samantha Fonseca [2 ]
Yuen, Chi Hong [3 ]
Cortona, Pietro [1 ]
Kokoouline, Viatcheslav [3 ]
Ayouz, Mehdi [4 ]
机构
[1] Univ Paris Saclay, Cent Supelec, CNRS, UMR8580,Lab SPMS, F-91190 Gif Sur Yvette, France
[2] Rollins Coll, Dept Phys, Winter Pk, FL 32789 USA
[3] Univ Cent Florida, Dept Phys, Orlando, FL 32816 USA
[4] Univ Paris Saclay, Cent Supelec, Lab LGPM, F-91190 Gif Sur Yvette, France
基金
美国国家科学基金会;
关键词
non-equilibrium plasmas; electron-NO2; collisions; vibrational excitation; vibrational frame transformation; molecular R-matrix; MOLECULE; IONIZATION; IMPACT; ION;
D O I
10.1088/1361-6595/ab4b8a
中图分类号
O35 [流体力学]; O53 [等离子体物理学];
学科分类号
070204 ; 080103 ; 080704 ;
摘要
In this study, we compute cross sections for vibrational excitation of NO2 by electron impact. Calculations are performed using a theoretical approach based on a combination of the normal mode approximation for vibrational states of the target molecule, fixed-nuclei electron-NO2 scattering matrices and the vibrational frame transformation employed to evaluate the scattering matrix for vibrational transitions. Thermally-averaged rate coefficients are derived from the obtained cross sections for temperatures in the 10?10000 K interval for excitation of each normal mode of the target molecule. Analytical fits for the rate coefficients for singlets and triplets are provided. In addition, a comprehensive set of calculations are performed for assessing the uncertainty of the present calculations. The uncertainty assessments indicate that the computed observables for vibrational (de-)excitation is reasonable for later use in NO2-containing plasma kinetics modeling.
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页数:8
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