Editing TIP4P-HB model of water
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{| style="width:75%; height:100px" border="1" | {| style="width:75%; height:100px" border="1" | ||
|- | |- | ||
| r | | r (OH) (nm)|| <math>\angle</math>HOH , deg|| <math>\sigma_0</math> (nm)|| <math>\epsilon_o</math> (kJmol<sup>-1</sup>)|| <math>|U_{min}^{OH}| </math>(kJmol<sup>-1</sup>) || q(H) (e) || <math>r_{\sigma}^{OH}</math> (nm) || r<sub>OM</sub> (nm) ||<math>\mu</math> (D) | ||
|- | |- | ||
| 0.09572 || 104.52 || 0.31536 || 0.6487 || 10.46 || 0.4415 || 0.14 || 0.015 || 1.85 | | 0.09572 || 104.52 || 0.31536 || 0.6487 || 10.46 || 0.4415 || 0.14 || 0.015 || 1.85 | ||
|} | |} | ||
==References== | ==References== | ||
*[http://dx.doi.org/10.1134/S1070363207100076 V. E. Petrenko, M. L. Antipova, A. V. Borovkov and O. V. Ved’ "New model pair potential for water. Effect of inclusion of specific O⋯H interactions on the topology and dynamics of the hydrogen-bond network", Russian Journal of General Chemistry '''77''' pp. 1700-1707 (2007)] | *[http://dx.doi.org/10.1134/S1070363207100076 V. E. Petrenko, M. L. Antipova, A. V. Borovkov and O. V. Ved’ "New model pair potential for water. Effect of inclusion of specific O⋯H interactions on the topology and dynamics of the hydrogen-bond network", Russian Journal of General Chemistry '''77''' pp. 1700-1707 (2007)] |