کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
9575297 1504345 2005 8 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
A theoretical study of the Si22+ dication
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
A theoretical study of the Si22+ dication
چکیده انگلیسی
Assuming the Born-Oppenheimer approximation, the low-lying electronic spectrum of the doubly charged silicon dimer cation is investigated by multireference configuration interaction methods. Despite of only a relatively small barrier in its ground state 1Σg+ potential energy curve, the lowest vibronic resonances enjoy lifetimes long enough to render Si22+ practically stable against dissociation. The same holds true for the other two metastable equilibria identified for the excited states 13Πuand13Σg-. A comparison with other diatomic dications and the isoelectronic neutral molecule Al2 assists in exposing the characteristics of Si22+.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chemical Physics - Volume 314, Issues 1–3, 18 July 2005, Pages 49-56
نویسندگان
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