کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
521828 867789 2009 8 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Image charge approximations of reaction fields in solvents with arbitrary ionic strength
موضوعات مرتبط
مهندسی و علوم پایه مهندسی کامپیوتر نرم افزارهای علوم کامپیوتر
پیش نمایش صفحه اول مقاله
Image charge approximations of reaction fields in solvents with arbitrary ionic strength
چکیده انگلیسی

In this paper, we report a new development of image charge approximations of reaction fields for a charge inside a dielectric spherical cavity immersed in an ionic solvent with arbitrary ionic strength. This new development removes the requirement of low ionic strength of the solvent in a previous result [S. Deng, W. Cai, Extending the fast multipole method for charges inside a dielectric sphere in an ionic solvent: high-order image approximations for reaction fields, J. Comput. Phys. 227 (2007) 1246–1266], thus extending the applicability of the image charge approximations of reaction fields in the modeling of biomolecular solvation.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Computational Physics - Volume 228, Issue 6, 1 April 2009, Pages 2092–2099
نویسندگان
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