کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
503513 863774 2008 7 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Calculation of atomic hydrogen and its photoelectron spectra in momentum space
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
Calculation of atomic hydrogen and its photoelectron spectra in momentum space
چکیده انگلیسی

An essential modification to the kernel in the numerical calculation of hydrogenic momentum wave functions, is presented in this paper. Using only 256 grid points, the calculated eigenvalues, eigenfunctions and the oscillator strengths are shown to be in excellent agreement with the exact analytic results. The reliable pseudocomplete set of momentum space eigenfunctions is then applied to the time-dependent calculation of intense laser pulse on the hydrogen atom. With the advantage of having no boundary reflection during the time evolution, like that inherent in the coordinate space method, the photoelectron spectra of above-threshold-ionization (ATI) are elucidated for four cases. Some of which are not feasible or very difficult to solve with the coordinate space method. Generalization of the method to single-active electron systems is straightforward. Due to the good accuracy with a reasonably small-sized basis set, applications to the currently interested intense case of laser pulse on atom or molecule are expected.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computer Physics Communications - Volume 178, Issue 8, 15 April 2008, Pages 571–577
نویسندگان
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