[CP2K:5222] DFT-D3 with HSE06 functional

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

Yes 
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Juerg Hutter                         Phone : ++41 44 635 4491
Institut für Chemie                  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: cp... at googlegroups.com
From: YE-FEI LI 
Sent by: cp... at googlegroups.com
Date: 04/30/2014 03:36PM
Subject: [CP2K:5222] DFT-D3 with HSE06 functional

Dear CP2K users and developers:
    These days I am trying to perform HSE06-D3 calculations in CP2K. However, I found that HSE06-D3 is not listed in reference_functional in VDW_POTENTIAL section yet. I have the parameters of S6, Sr6 and S8 for HSE06. Can I just define this parameters using D3_SCALING, then it is HSE06-D3? Is it correct? Thanks!
Best,
Yefei  
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