[CP2K:10121] DFT calculation which is the better using Gaussian or CP2K?. Is it CP2K worth it?

hut... at chem.uzh.ch hut... at chem.uzh.ch
Fri Mar 23 08:49:10 UTC 2018


Tea or Coffee? Both!
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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
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-----cp... at googlegroups.com wrote: -----
To: cp2k <cp... at googlegroups.com>
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Date: 03/23/2018 12:12AM
Subject: [CP2K:10121] DFT calculation which is the better using Gaussian or CP2K?. Is it CP2K worth it?

For DFT calculation, which is the better using Gaussian or CP2K?. Is it CP2K worth it? 
  
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