[gmx-users] Epsilon-rf

Alex nedomacho at gmail.com
Tue Apr 28 08:24:18 CEST 2015

Also, reaction-field-zero, as described here http://manual.gromacs.org/online/mdp_opt.html
which _only_ works with epsilon-rf=0. Any particular reason for doing
this to your electrostatics?


MK> Dear all,
MK> I use reaction-field-zero as the coulombtype for my system. I wonder how I
MK> should choose the right epsilon-rf. How can I calculate the dielectric
MK> constant in the system?
MK> Thank you.

More information about the gromacs.org_gmx-users mailing list