کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
1411831 1501900 2007 5 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Analytical solutions for the E ⊗ e dynamic Jahn–Teller problem in the strong coupling limit
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی آلی
پیش نمایش صفحه اول مقاله
Analytical solutions for the E ⊗ e dynamic Jahn–Teller problem in the strong coupling limit
چکیده انگلیسی

Correct boundary conditions for wavefunctions in the E ⊗ e dynamic Jahn–Teller problem explicitly is considered to obtain approximate analytical solutions in the strong coupling limit. We demonstrate that the pseudorotational energy j2/(2g2), where g is the dimensionless vibronic coupling constant, and j total angular momentum: j = 1/2, 3/2, …, in the conventional strong coupling expression for the vibronic levels of the lower sheet is exact. However, it is found that in the conventional treatment a term of the order of 1/g2 is missing. The solutions for the upper sheet with correct boundary conditions gives those which are entirely different from the corresponding Slonczewski’s solutions.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Structure - Volume 838, Issues 1–3, 16 July 2007, Pages 8–12
نویسندگان
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