[CP2K:5648] Phonon Calculations

hut... at chem.uzh.ch hut... at chem.uzh.ch
Tue Sep 16 16:35:16 UTC 2014

Juerg Hutter                         Phone : ++41 44 635 4491
Institut für Chemie C                FAX   : ++41 44 635 6838
Universität Zürich                   E-mail: hut... at chem.uzh.ch
Winterthurerstrasse 190
CH-8057 Zürich, Switzerland

-----cp... at googlegroups.com wrote: -----
To: cp... at googlegroups.com
From: Sam J 
Sent by: cp... at googlegroups.com
Date: 09/16/2014 06:05PM
Subject: Re: [CP2K:5648] Phonon Calculations

Hi Jeurg,

Thanks for your prompt reponse. So I'm correct in saying it's possible to run vibrational analysis at the Gamma point, but it's not possible to produce phonon spectra?

All the best,
 You received this message because you are subscribed to the Google Groups "cp2k" group.
 To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+uns... at googlegroups.com.
 To post to this group, send email to cp... at googlegroups.com.
 Visit this group at http://groups.google.com/group/cp2k.
 For more options, visit https://groups.google.com/d/optout.

More information about the CP2K-user mailing list