[gmx-users] tip5p tip, not good, energy can only get -39, not -45

MD ptf1242 at 163.com
Tue Jun 5 15:47:19 CEST 2012

HI All,

I run the tip5p water model, i found the computed properties are not good, e.g. energy.

Can anyone know the problem? i need to get the surface potential, it can get -1 V

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