کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
9590602 1507008 2005 5 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
The electron localization function (ELF) and its relatives: interpretations and difficulties
موضوعات مرتبط
مهندسی و علوم پایه شیمی شیمی تئوریک و عملی
پیش نمایش صفحه اول مقاله
The electron localization function (ELF) and its relatives: interpretations and difficulties
چکیده انگلیسی
ELF is a function of the 3D-coordinates which is large in the regions where orbitals localize. It is closely related to LOL and the Fermi hole mobility function. While it has been used with considerable success for analyzing the chemical bond in molecules and crystals, it seems to have some intrinsic limits, which are discussed.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Structure: THEOCHEM - Volume 727, Issues 1–3, 16 August 2005, Pages 127-131
نویسندگان
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