کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
10357949 867925 2005 11 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Optimized periodic 1/r Coulomb potential in two dimensions
موضوعات مرتبط
مهندسی و علوم پایه مهندسی کامپیوتر نرم افزارهای علوم کامپیوتر
پیش نمایش صفحه اول مقاله
Optimized periodic 1/r Coulomb potential in two dimensions
چکیده انگلیسی
The 1/r Coulomb potential is calculated for a two dimensional system with periodic boundary conditions. Using polynomial splines in real space and a summation in reciprocal space we obtain numerically optimized potentials which allow us efficient calculations of any periodic (long-ranged) potential up to high precision. We discuss the parameter space of the optimized potential for the periodic Coulomb potential. Compared to the analytic Ewald potential, the optimized potentials can reach higher precisions by up to several orders of magnitude at comparable computational cost. We explicitly give simple expressions for fast calculations of the periodic Coulomb potential where the summation in reciprocal space is reduced to a few terms.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Computational Physics - Volume 206, Issue 1, 10 June 2005, Pages 111-121
نویسندگان
, ,