کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
9850844 1527275 2005 19 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Coordinates, modes and maps for the density functional
موضوعات مرتبط
مهندسی و علوم پایه فیزیک و نجوم فیزیک هسته ای و انرژی بالا
پیش نمایش صفحه اول مقاله
Coordinates, modes and maps for the density functional
چکیده انگلیسی
Special bases of orthogonal polynomials are defined, that are suited to expansions of density and potential perturbations under strict particle number conservation. Particle-hole expansions of the density response to an arbitrary perturbation by an external field can be inverted to generate a mapping between density and potential. Information is obtained for derivatives of the Hohenberg-Kohn functional in density space. A truncation of such an information in subspaces spanned by a few modes is possible. Numerical examples illustrate these algorithms.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Nuclear Physics A - Volume 761, Issues 1–2, 31 October 2005, Pages 22-40
نویسندگان
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