[CP2K:8478] Spin polarized DFTB

[hut... at chem.uzh.ch]

Yes
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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>
From: Luiz Fernando Lopes Oliveira 
Sent by: cp... at googlegroups.com
Date: 12/13/2016 02:20AM
Subject: [CP2K:8478] Spin polarized DFTB

I was wondering if spin-polarized DFTB calculations can be done with CP2K.



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