کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
5352072 1503678 2013 7 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
A DFT study of SF6 decomposed gas adsorption on an anatase (1 0 1) surface
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
A DFT study of SF6 decomposed gas adsorption on an anatase (1 0 1) surface
چکیده انگلیسی
The detection of partial discharge through the analysis of SF6 gas components in gas-insulated switchgears is important for the diagnosis and assessment of the operational state of power equipment. A gas sensor based on anatase TiO2 is used to detect SF6 decomposed gases. In this paper, first principles density functional theory calculations are adopted for the theoretical investigation of the process of anatase (1 0 1) surface adsorbing SO2, SOF2 and SO2F2, which are the main components of SF6 decomposed gases. Simulation results show that the surface of anatase (1 0 1) is more sensitive and selective to SO2 than to SOF2 and SO2F2. This theoretical finding is corroborated by the sensing experiment using a TiO2 nanotube arrays gas sensor. The interpretation of the sensing mechanism is based on the simulation results. The study concludes that, under the same temperature and concentration, the response R% of the sensor to the three gases depends on the impurity state introduced by adsorbed gas molecules.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Applied Surface Science - Volume 286, 1 December 2013, Pages 47-53
نویسندگان
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