[gmx-users] 10-4 Wall Potential.

ttrudeau ttrudeau at uvic.ca
Wed Apr 29 02:08:52 CEST 2009


Just wanting to confirm:

The potential function for the 10-4 wall in GROMACS is of the form:

VLJ = c12*density*pi/(5*r^10) - c6*density*pi/(2*r^4)

It is NOT the same as the 10-4-3 function which is also sometimes used to
model surface-fluid interactions?

Thanks, Travis T.




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