Editing SPC/Fw model of water
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| q-SPC/Fw || 1059.162 || 1.000 || 75.90 || 112.0 || 3.165492 || 0.1554252 || -0.84 || 0.42 | | q-SPC/Fw || 1059.162 || 1.000 || 75.90 || 112.0 || 3.165492 || 0.1554252 || -0.84 || 0.42 | ||
|} | |} | ||
where the | where the units of <math>k_b</math> and <math>k_a</math> are kcal.mol<sup>-1</sup>Å<sup>-2</sup>. | ||
==Dielectric constant== | ==Dielectric constant== | ||
The dielectric constant has been calculated by Raabe and Sadus <ref>[http://dx.doi.org/10.1063/1.3600337 Gabriele Raabe and Richard J. Sadus "Molecular dynamics simulation of the dielectric constant of water: The effect of bond flexibility", Journal of Chemical Physics '''134''' 234501 (2011)]</ref>. | The dielectric constant has been calculated by Raabe and Sadus <ref>[http://dx.doi.org/10.1063/1.3600337 Gabriele Raabe and Richard J. Sadus "Molecular dynamics simulation of the dielectric constant of water: The effect of bond flexibility", Journal of Chemical Physics '''134''' 234501 (2011)]</ref>. |