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.
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