GenIce3

Water models

Specify a water model with the :water_model suboption of exporter plugins.

symbol type References
3site, spce, tip3p A typical 3-site model. [Jorgensen 1983]
4site, tip4p A typical 4-site model. [Jorgensen 1983, Jorgensen 1985]
5site, tip5p A typical 5-site model. [Mahoney 2000]
6site, NvdE A 6-site water model. [Nada 2003]
7site A seven-site water model. [Zhao 2019]
ice TIP4P/Ice water model. [Abascal 2005]
physical_water Physical model of water; Oxygen atom is on the lattice point. [Jorgensen 1983]
tip4p2005 TIP4P/2005 water model. [Abascal 2005B]
  (Undocumented)