TIP4P/2005 model of water: Difference between revisions

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TIP4P/2005 is a rigid planar model, having a similar geometry to the Bernal and  Fowler ([[BF]]) model.
TIP4P/2005 is a rigid planar model, having a similar geometry to the Bernal and  Fowler ([[BF]]) model.
==Parameters==
==Parameters==
[[Image:Water_empirical1.png|center|300px]]
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Revision as of 11:34, 14 February 2008

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 page contains numerical values and/or equations. If you intend to use ANY of the numbers or equations found in SklogWiki in any way, you MUST take them from the original published article or book, and cite the relevant source accordingly.

The TIP4P/2005 model is a re-parameterisation of the original TIP4P potential for simulations of water. TIP4P/2005 is a rigid planar model, having a similar geometry to the Bernal and Fowler (BF) model.

Parameters

r (OH) (Å) HOH , deg (Å) (K) q(O) (e) q(H) (e) q(M) (e) r (OM) (Å)
0.9572 104.52 3.1589 93.2 0 0.5564 -2q(H) 0.1546

References