2D site-site correlation functions

These functions are given as (x-y-z) plots. Clicking a link lauches a new window. In the system name, ?=s stands for ST2 and ?=t for TIP4P.

state name TIP4P ST2
25oC 0.997 g cm-3
full, epsinf=80
?fh25 OO-OH OO-HH OO-OH OO-HH
25oC 0.997 g cm-3
cut (4/6)
?ch25 OO-OH OO-HH OO-OH OO-HH
100oC 0.958 g cm-3
full epsinf=80
?fh100 OO-OH OO-HH OO-OH OO-HH
100oC 0.958 g cm-3
cut (4/6)
?ch100 OO-OH OO-HH OO-OH OO-HH
700K 0.328 g cm-3
full epsinf=80
?fh700 OO-OH OO-HH OO-OH OO-HH
700K 0.328 g cm-3
cut (4/6)
?ch700 OO-OH OO-HH OO-OH OO-HH

[x-y-color plots] [water homepage]