[CP2K:3159] DFTB

[Riccardo Petraglia]

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:
>
> Hi
>
> as 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 
> <javascript:>
> Winterthurerstrasse 190
> CH-8057 Zurich, Switzerland
> ---------------------------------------------------------------
>
> -----cp... at googlegroups.com <javascript:> wrote: -----
> To: cp2k <cp... at googlegroups.com <javascript:>>
> From: "Ross, Sun" 
> Sent by: cp... at googlegroups.com <javascript:>
> 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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