Editing SCPDP model of water
Jump to navigation
Jump to search
The edit can be undone. Please check the comparison below to verify that this is what you want to do, and then publish the changes below to finish undoing the edit.
Latest revision | Your text | ||
Line 2: | Line 2: | ||
The '''SCPDP''' model | The '''SCPDP''' model | ||
<ref>[http://dx.doi.org/10.1063/1.472718 Ariel A. Chialvo and Peter T. Cummings "Engineering a simple polarizable model for the molecular simulation of water applicable over wide ranges of state conditions", Journal of Chemical Physics '''105''' pp. 8274-8281 (1996)]</ref> | <ref>[http://dx.doi.org/10.1063/1.472718 Ariel A. Chialvo and Peter T. Cummings "Engineering a simple polarizable model for the molecular simulation of water applicable over wide ranges of state conditions", Journal of Chemical Physics '''105''' pp. 8274-8281 (1996)]</ref> | ||
is | is used to study [[water]]. It is polarisable has a permanent [[dipole moment]] of 1.85D. | ||
==Parameters== | ==Parameters== | ||
[[Image:Thee_site_water_model.png|center|400px]] | [[Image:Thee_site_water_model.png|center|400px]] |