Editing TIP4Q model of water
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The '''TIP4Q''' model | The '''TIP4Q''' model | ||
<ref>[http://dx.doi.org/10.1039/C1CP20858F José Alejandre, Gustavo A. Chapela, Humberto Saint-Martin and Noé Mendoza "A non-polarizable model of water that yields the dielectric constant and the density anomalies of the liquid: TIP4Q", Phys. Chem. Chem. Phys. | <ref>[http://dx.doi.org/10.1039/C1CP20858F José Alejandre, Gustavo A. Chapela, Humberto Saint-Martin and Noé Mendoza "A non-polarizable model of water that yields the dielectric constant and the density anomalies of the liquid: TIP4Q", Phys. Chem. Chem. Phys., (2011) (Advance Article)]</ref> | ||
is a re-parameterisation of the original [[TIP4P]] potential for [[Computer simulation techniques | simulations]] of [[water]]. | is a re-parameterisation of the original [[TIP4P]] potential for [[Computer simulation techniques | simulations]] of [[water]]. | ||
TIP4Q is a rigid planar model, having a similar geometry to that of the [[BF |Bernal and Fowler model]]. | TIP4Q is a rigid planar model, having a similar geometry to that of the [[BF |Bernal and Fowler model]]. | ||
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| 0.9572 || 104.52 || 3.1666 || 93.2 || 0.5 || 0.525 || -2q(H) || 0.069 | | 0.9572 || 104.52 || 3.1666 || 93.2 || 0.5 || 0.525 || -2q(H) || 0.069 | ||
|} | |} | ||
==References== | ==References== | ||
<references/> | <references/> | ||
[[Category: Water]] | [[Category: Water]] | ||
[[Category: Models]] | [[Category: Models]] | ||
{{numeric}} | {{numeric}} |