<div dir="ltr">yes.. Thank you..<div><br></div><div style>--Sandeep</div></div><div class="gmail_extra"><br><br><div class="gmail_quote">On Mon, Jan 14, 2013 at 2:03 PM,  <span dir="ltr"><<a href="mailto:hut...@pci.uzh.ch" target="_blank">hut...@pci.uzh.ch</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">Hi<br>
<br>
I assume you are refering to the BJ damping function recently<br>
explored together with the DFT-D3 empirical method.<br>
This is not implemented in CP2K.<br>
<br>
regards<br>
<br>
Juerg Hutter<br>
<br>
--------------------------------------------------------------<br>
Juerg Hutter                         Phone : ++41 44 635 4491<br>
Physical Chemistry Institute   FAX   : ++41 44 635 6838<br>
University of Zurich               E-mail:  <a href="mailto:hut...@pci.uzh.ch">hut...@pci.uzh.ch</a><br>
Winterthurerstrasse 190<br>
CH-8057 Zurich, Switzerland<br>
---------------------------------------------------------------<br>
<br>
-----<a href="mailto:cp...@googlegroups.com">cp...@googlegroups.com</a> wrote: -----<br>
To: <a href="mailto:cp...@googlegroups.com">cp...@googlegroups.com</a><br>
From: Sandeep Kumar Reddy<br>
Sent by: <a href="mailto:cp...@googlegroups.com">cp...@googlegroups.com</a><br>
Date: 01/11/2013 02:03PM<br>
Subject: [CP2K:4244] Becke-Johnson damping function - DFT-D3<br>
<div><div class="h5"><br>
Dear all,<br>
              Is it possible to use Becke-Johnson function (DFT-D3) in cp2k ? (vanderWaals interaction)? If so, which keywords should i use?<br>
<br>
Thanks.<br>
<br>
Regards,<br>
Sandeep<br>
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