SPC/F model of water: Difference between revisions
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{{Stub-water}} | {{Stub-water}} | ||
This model is a modified version of the simple point-charge model [[SPC]] for [[water]]. The SPC model is rigid, | This model is a modified version of the simple point-charge model [[SPC]] for [[water]]. The SPC model is rigid, | ||
whilst the '''SPC/F''' model is flexible. | whilst the '''SPC/F''' model is flexible. This model gives the correct density and dielectric permittivity of water. The model implemented in the programs [[MDynaMix]] and [[Abalone]]. | ||
==References== | ==References== | ||
#[http://dx.doi.org/10.1103/PhysRevB.31.2643 Kahled Toukan and Aneesur Rahman "Molecular-dynamics study of atomic motions in water", Physical Review B '''31''' pp. 2643 - 2648 (1985)] | #[http://dx.doi.org/10.1103/PhysRevB.31.2643 Kahled Toukan and Aneesur Rahman "Molecular-dynamics study of atomic motions in water", Physical Review B '''31''' pp. 2643 - 2648 (1985)] | ||
[[category: water]] | [[category: water]] | ||
[[category: models]] | [[category: models]] | ||
Revision as of 22:33, 18 April 2009
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This article is a 'stub' about water and/or ice. It has no, or next to no, content. It is here at the moment to help form part of the structure of SklogWiki. If you add material to this article, remove the {{Stub-water}} template from this page. |
This model is a modified version of the simple point-charge model SPC for water. The SPC model is rigid, whilst the SPC/F model is flexible. This model gives the correct density and dielectric permittivity of water. The model implemented in the programs MDynaMix and Abalone.