کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
5377253 | 1504337 | 2006 | 10 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
The Herman-Kluk approximation: Derivation and semiclassical corrections
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کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
شیمی
شیمی تئوریک و عملی
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چکیده انگلیسی
The Herman-Kluk (HK) approximation for the propagator is derived semiclassically for a multidimensional system as an asymptotic solution of the Schrödinger equation. The propagator is obtained in the form of an expansion in â, in which the lowest-order term is the HK formula. Thus, the result extends the HK approximation to higher orders in â. Examination of the various terms shows that the expansion is a uniform asymptotic series and establishes the HK formula as a uniform semiclassical approximation. Successive terms in the series should allow one to improve the accuracy of the HK approximation for small â in a systematic and purely semiclassical manner, analogous to a higher-order WKB treatment of time-independent wave functions.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Chemical Physics - Volume 322, Issues 1â2, 6 March 2006, Pages 3-12
Journal: Chemical Physics - Volume 322, Issues 1â2, 6 March 2006, Pages 3-12
نویسندگان
Kenneth G. Kay,