[CP2K:5488] DFTB

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

Hi

I am not aware of any project extending DFTB functionality.

regards

Juerg 
--------------------------------------------------------------
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: Riccardo Petraglia 
Sent by: cp... at googlegroups.com
Date: 07/01/2014 07:35PM
Subject: Re: [CP2K:5488] DFTB

Hello,
I would like to know if the situation about DFTB is changed in this last years or not...

Thank you
Riccardo


On Friday, March 25, 2011 10:16:19 AM UTC+1, jgh wrote:Hias far as I know there is no active development under way for
the DFTB part of CP2K.
regards
Juerg
--------------------------------------------------------------
Juerg Hutter                         Phone : ++41 44 635 4491
Physical Chemistry Institute   FAX   : ++41 44 635 6838
University of Zurich               E-mail:  hut... at pci.uzh.ch
Winterthurerstrasse 190
CH-8057 Zurich, Switzerland
---------------------------------------------------------------
-----cp... at googlegroups.com wrote: -----
To: cp2k <cp... at googlegroups.com>
From: "Ross, Sun" 
Sent by: cp... at googlegroups.com
Date: 03/24/2011 04:41PM
Subject: [CP2K:3159] DFTB
Hello cp2k developers,
I'm curious about the DFTB functionality in CP2K.  I know that there
are some great ideas recommanded by Cui's group (i.e. DFTB3),
recently.  And I am wondering what the current status is. Does anyone
of your  honors add some new features into DFTB?
Thanks, :)
Best regards.
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