[CP2K-user] PME Methods with Multipole Polarization
Jacob Tellez
jte... at mymail.mines.edu
Tue Jul 6 15:42:15 UTC 2021
Greetings all,
I have been setting up a classical MD simulation using the dipole
polarization routines. It seems to me that I can only use the standard
Ewald sum with the multipole polarization methods. Is this true, or is
there some way to employ the PME or SPME summations in combination with the
dipole routine.
Thank you in advance.
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