Surface dipole correction in new version of CP2K 2.5
Andrei Buin
phqu... at gmail.com
Tue Jul 15 18:19:12 UTC 2014
I'm testing the Surface dipole correction option in the new release (2.5
and upwards) and i see no difference compared to the original case (no
Dipole correction). I dont even see the any sort of output related to the
Surface dipole correction. Energies are the same although i use very large
vacuum amount. I was wondering, does it have any sort of output or it just
silently does it job ?
With Best Regards, Andrei Buin.
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