http://www.sklogwiki.org/SklogWiki/index.php?action=history&feed=atom&title=POL3_model_of_water 2026-04-27T20:40:32Z Revision history for this page on the wiki MediaWiki 1.41.0 http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=11493&oldid=prev 2011-06-15T14:49:39Z

<p>Added melting point</p> <table style="background-color: #fff; color: #202122;" data-mw="interface"> <col class="diff-marker" /> <col class="diff-content" /> <col class="diff-marker" /> <col class="diff-content" /> <tr class="diff-title" lang="en"> <td colspan="2" style="background-color: #fff; color: #202122; text-align: center;">← Older revision</td> <td colspan="2" style="background-color: #fff; color: #202122; text-align: center;">Revision as of 16:49, 15 June 2011</td> </tr><tr><td colspan="2" class="diff-lineno" id="mw-diff-left-l1">Line 1:</td> <td colspan="2" class="diff-lineno">Line 1:</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>{{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;">&lt;ref&gt;[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)]&lt;/ref&gt;  </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 &lt;math&gt;180~K \pm 10~K &lt;/math&gt;&lt;ref&gt;[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)]&lt;/ref&gt;</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;">&lt;references</ins>/<ins style="font-weight: bold; text-decoration: none;">&gt;</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> </table>

Carl McBride http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=9784&oldid=prev 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> <table style="background-color: #fff; color: #202122;" data-mw="interface"> <tr class="diff-title" lang="en"> <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 16:39, 23 February 2010</td> </tr><tr><td colspan="2" class="diff-notice" lang="en"><div class="mw-diff-empty">(No difference)</div> </td></tr></table>

Nice and Tidy http://www.sklogwiki.org/SklogWiki/index.php?title=POL3_model_of_water&diff=7152&oldid=prev 2008-09-05T10:26:30Z

<p>New page: {{Stub-water}} &#039;&#039;&#039;POL3&#039;&#039;&#039; 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 &quot;Structure and Properties of Ne...</p> <p><b>New page</b></p><div>{{Stub-water}}<br /> &#039;&#039;&#039;POL3&#039;&#039;&#039; is a three-site model of [[water]]. <br /> ==References==<br /> #[http://dx.doi.org/10.1021/j100016a067 James W. Caldwell and Peter A. Kollman &quot;Structure and Properties of Neat Liquids Using Nonadditive Molecular Dynamics: Water, Methanol, and N-Methylacetamide&quot;, Journal of Physical Chemistry &#039;&#039;&#039;99&#039;&#039;&#039; pp. 6208-6219 (1995)]<br /> [[category: water]]<br /> [[category: models]]</div>

Carl McBride