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. Author manuscript; available in PMC: 2019 Mar 12.
Published in final edited form as: J Phys Chem B. 2007 Apr 11;111(17):4393–4400. doi: 10.1021/jp068767m

TABLE 3:

Surface Tension (dyn/cm) of the Water/Vapor Interface with a Given LJ Cutoff (rc)a

rc (Å)
method water model temp (K) 8 10 12 25
PME  TIP3P 303.15 44.1 ± 0.6 47.5 ± 0.6 51.6 ± 0.6 54.8 ± 0.5
 TIP3P 323.15 41.5 ± 0.5 45.7 ± 0.3 47.7 ± 0.4 51.3 ± 0.4
 TIP4P-Ew 323.15 49.2 ± 0.7 53.2 ± 0.6 53.7 ± 0.9 59.2 ± 0.7
2D IPS  TIP3P 303.15 55.1 ± 0.5 54.1 ± 0.5 55.3 ± 0.4
 TIP3P 323.15 50.9 ± 0.5 50.7 ± 0.4 52.2 ± 0.7
 TIP4P-Ew 323.15 57.4 ± 0.6
3D IPS  TIP3P 303.15 51.4 ± 0.3 53.6 ± 0.8 54.4 ± 0.6
 TIP4P-Ew 323.15 58.0 ± 0.6 58.7 ± 0.7 59.0 ± 0.6
PME/IPS  TIP3P 323.15 47.9 ± 0.5 49.6 ± 0.5
 TIP4P-Ew 323.15 56.6 ± 0.3 57.2 ± 0.9
a

Experimental values at 303.15 and 323.15 K are 71.2 and 67.9 dyn/cm, respectively.27