SPCP model of water: Difference between revisions
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{{Stub-water}} | {{Stub-water}} | ||
'''SPCP''' is a [[SPC]]-like model of [[water]]. | '''SPCP''' is a [[SPC]]-like model of [[water]]. | ||
==Parameters== | |||
[[Image:Thee_site_water_model.png|center|400px]] | |||
{| border="1" | |||
|- | |||
| parameter || value | |||
|- | |||
| <math>\sigma</math> || <math> --- {\mathrm {\AA}}</math> | |||
|- | |||
| <math>\epsilon</math> || <math> --- </math> kJ mol<sup>-1</sup> | |||
|- | |||
| <math>r_\mathrm{OH}</math> || <math> --- \mathrm{\AA}</math> | |||
|- | |||
| <math>\angle_\mathrm{HOH}</math> || <math>---^{\circ}</math> | |||
|- | |||
| <math>q_{\mathrm{O}}</math> || <math>---- e</math> | |||
|- | |||
| <math>q_{\mathrm{H}}</math> || <math>q_{\mathrm{O}}/2</math> (charge neutrality) | |||
|} | |||
==References== | ==References== | ||
#[http://dx.doi.org/10.1080/00268978900102361 Peter Ahlström, Anders Wallqvist, Sven Engström and Bo Jönsson "A molecular dynamics study of polarizable water", Molecular Physics '''68''' pp. 563-581 (1989)] | #[http://dx.doi.org/10.1080/00268978900102361 Peter Ahlström, Anders Wallqvist, Sven Engström and Bo Jönsson "A molecular dynamics study of polarizable water", Molecular Physics '''68''' pp. 563-581 (1989)] | ||
[[category: water]] | [[category: water]] | ||
[[category: models]] | [[category: models]] | ||
Revision as of 18:27, 8 June 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. |
SPCP is a SPC-like model of water.
Parameters
| parameter | value |
| kJ mol-1 | |
| (charge neutrality) |
