3.9 Article

COARSE-GRAINED POTENTIAL FOR INTERACTION WITH A SPHERICAL COLLOIDAL PARTICLE AND PLANAR WALL

期刊

出版社

INST ORGANIC CHEM AND BIOCHEM
DOI: 10.1135/cccc2009542

关键词

Spherical colloidal particles; Surface interaction; Effective coarse-grained potential; Molecular simulations; Water at graphite surface

资金

  1. Czech Science Foundation [203/08/0094]
  2. Grant Agency of the Academy of Sciences of the Czech Republic [IAA400720802]
  3. Ministry of Education, Youth and Sports of the Czech Republic [ME09062]

向作者/读者索取更多资源

An effective coarse-grained interaction potential between a point particle and a spherical colloidal particle with continuously distributed inverse power-law interaction sites is derived. The potential covers all ranges of spherical particle size, from a point particle up to an infinitely large particle forming a planar surface. In the small size limit, the point-to-point interaction is recovered, while in the limit of an infinitely large sphere the potential comes over to the known particle-wall potentials as, e.g., the 9-3 potential in the case of the Lennard-Jones interaction. Correctness and usefulness of the derived potential is exemplified by its application to SPC/E water at a graphite sphere and wall.

作者

我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。

评论

主要评分

3.9
评分不足

次要评分

新颖性
-
重要性
-
科学严谨性
-
评价这篇论文

推荐

暂无数据
暂无数据