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POL3 model of water - Revision history
2024-03-28T12:48:02Z
Revision history for this page on the wiki
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http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=11493&oldid=prev
Carl McBride: Added melting point
2011-06-15T14:49:39Z
<p>Added melting point</p>
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<td colspan="2" style="background-color: #fff; color: #202122; text-align: center;">Revision as of 15:49, 15 June 2011</td>
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<tr><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>{{Stub-water}}</div></td><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>{{Stub-water}}</div></td></tr>
<tr><td class="diff-marker" data-marker="−"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #ffe49c; vertical-align: top; white-space: pre-wrap;"><div>'''POL3''' is a three-site model of [[water]]. </div></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div>'''POL3''' is a three-site model <ins style="font-weight: bold; text-decoration: none;"><ref>[http://dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman "Structure and Properties of Neat Liquids Using Nonadditive Molecular Dynamics: Water, Methanol, and N-Methylacetamide", Journal of Physical Chemistry '''99''' pp. 6208-6219 (1995)]</ref> </ins>of [[water]]<ins style="font-weight: bold; text-decoration: none;">.</ins></div></td></tr>
<tr><td colspan="2" class="diff-side-deleted"></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;">==Melting point==</ins></div></td></tr>
<tr><td colspan="2" class="diff-side-deleted"></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;">The [[Ice Ih]]-[[water]] melting point has been calculated to be <math>180~K \pm 10~K </math><ref>[http://dx.doi.org/10.1021/jp110391q Eva Muchová, Ivan Gladich, Sylvain Picaud, Paul N. M. Hoang, and Martina Roeselová "The Ice−Vapor Interface and the Melting Point of Ice Ih for the Polarizable POL3 Water Model", Journal of Physical Chemistry A '''115''' pp. 5973-5982 (2011)]</ref></ins>.</div></td></tr>
<tr><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>==References==</div></td><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>==References==</div></td></tr>
<tr><td class="diff-marker" data-marker="−"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #ffe49c; vertical-align: top; white-space: pre-wrap;"><div><del style="font-weight: bold; text-decoration: none;">#[http:</del>/<del style="font-weight: bold; text-decoration: none;">/dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman "Structure and Properties of Neat Liquids Using Nonadditive Molecular Dynamics: Water, Methanol, and N-Methylacetamide", Journal of Physical Chemistry '''99''' pp. 6208-6219 (1995)]</del></div></td><td class="diff-marker" data-marker="+"></td><td style="color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #a3d3ff; vertical-align: top; white-space: pre-wrap;"><div><ins style="font-weight: bold; text-decoration: none;"><references</ins>/<ins style="font-weight: bold; text-decoration: none;">></ins></div></td></tr>
<tr><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>[[category: water]]</div></td><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>[[category: water]]</div></td></tr>
<tr><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>[[category: models]]</div></td><td class="diff-marker"></td><td style="background-color: #f8f9fa; color: #202122; font-size: 88%; border-style: solid; border-width: 1px 1px 1px 4px; border-radius: 0.33em; border-color: #eaecf0; vertical-align: top; white-space: pre-wrap;"><div>[[category: models]]</div></td></tr>
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Carl McBride
http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=9784&oldid=prev
Nice and Tidy: POL3 moved to POL3 model of water
2010-02-23T14:39:15Z
<p><a href="/SklogWiki/index.php/POL3" class="mw-redirect" title="POL3">POL3</a> moved to <a href="/SklogWiki/index.php/POL3_model_of_water" title="POL3 model of water">POL3 model of water</a></p>
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<td colspan="1" style="background-color: #fff; color: #202122; text-align: center;">← Older revision</td>
<td colspan="1" style="background-color: #fff; color: #202122; text-align: center;">Revision as of 15:39, 23 February 2010</td>
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Nice and Tidy
http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=7152&oldid=prev
Carl McBride: New page: {{Stub-water}} '''POL3''' is a three-site model of water. ==References== #[http://dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman "Structure and Properties of Ne...
2008-09-05T10:26:30Z
<p>New page: {{Stub-water}} '''POL3''' is a three-site model of <a href="/SklogWiki/index.php/Water" title="Water">water</a>. ==References== #[http://dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman "Structure and Properties of Ne...</p>
<p><b>New page</b></p><div>{{Stub-water}}<br />
'''POL3''' is a three-site model of [[water]]. <br />
==References==<br />
#[http://dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman "Structure and Properties of Neat Liquids Using Nonadditive Molecular Dynamics: Water, Methanol, and N-Methylacetamide", Journal of Physical Chemistry '''99''' pp. 6208-6219 (1995)]<br />
[[category: water]]<br />
[[category: models]]</div>
Carl McBride