<div dir="ltr"><div>I am trying to see if I can come over to Trieste in that period. If I manage, would you like to discuss about including a path integral (more in general, fancy MD) interface in q-Espresso: it is now in the official versions of CP2K, FHI-AIMS, LAMMPS, and the patch for Siesta is being reviewed by José Soler, so it would be nice if it also got into official QE. <br><br></div>Best,<br>Michele<br><br></div><div class="gmail_extra"><br><div class="gmail_quote">On 27 November 2014 at 09:28, Fabio Affinito <span dir="ltr"><<a href="mailto:f.affinito@cineca.it" target="_blank">f.affinito@cineca.it</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">If you like, I can present the activity done on quantum espresso within the intel parallel computing center activity.<br>
<br>
Ciao,<br>
<br>
Fabio<br>
<br>
----- Messaggio originale -----<br>
> Da: "Paolo Giannozzi" <<a href="mailto:paolo.giannozzi@uniud.it">paolo.giannozzi@uniud.it</a>><br>
> A: "Filippo Spiga" <<a href="mailto:spiga.filippo@gmail.com">spiga.filippo@gmail.com</a>><br>
> Cc: <a href="mailto:q-e-developers@qe-forge.org">q-e-developers@qe-forge.org</a>, "foundation" <<a href="mailto:foundation@quantum-espresso.org">foundation@quantum-espresso.org</a>><br>
> Inviato: Mercoledì, 26 novembre 2014 17:49:22<br>
> Oggetto: Re: [Q-e-developers] Developers' meeting<br>
<div class="HOEnZb"><div class="h5">><br>
> On Tue, 2014-11-25 at 18:46 +0000, Filippo Spiga wrote:<br>
><br>
> > shall we gather possible topics and contributions for the meeting?<br>
><br>
> sure. I'll do the usual introduction on what has been done and what<br>
> hasn't and what should be done ...<br>
><br>
> P.<br>
><br>
> > I do suggest this time to short the duration of the presentations<br>
> > (e.g. 20min max each) and focus on open discussion around two or<br>
> > three very specific topics. Speaking about myself, I am happy to<br>
> > present what I am doing for the GPU port plus another 20 minutes<br>
> > related to my git mirror, QE buildbot and a new test-suite (still<br>
> > in progress).<br>
> ><br>
> > Cheers,<br>
> > Filippo<br>
> ><br>
> > On Nov 17, 2014, at 5:49 PM, Paolo Giannozzi<br>
> > <<a href="mailto:paolo.giannozzi@uniud.it">paolo.giannozzi@uniud.it</a>> wrote:<br>
> > > After a first inquiry, it looks like the most suitable date<br>
> > > for the next developers' meeting is Wednesday Jan.14 2015,<br>
> > > just before the traditional "Total Energy" in Trieste<br>
> > > (unless there are many suggestions of different dates)<br>
> > ><br>
> > > Paolo<br>
> ><br>
> > --<br>
> > Mr. Filippo SPIGA, M.Sc.<br>
> > <a href="http://filippospiga.info" target="_blank">http://filippospiga.info</a> ~ skype: filippo.spiga<br>
> ><br>
> > «Nobody will drive us out of Cantor's paradise.» ~ David Hilbert<br>
> ><br>
> > *****<br>
> > Disclaimer: "Please note this message and any attachments are<br>
> > CONFIDENTIAL and may be privileged or otherwise protected from<br>
> > disclosure. The contents are not to be disclosed to anyone other<br>
> > than the addressee. Unauthorized recipients are requested to<br>
> > preserve this confidentiality and to advise the sender immediately<br>
> > of any error in transmission."<br>
> ><br>
> ><br>
><br>
> --<br>
> Paolo Giannozzi, Dept. Chemistry&Physics&Environment,<br>
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy<br>
> Phone <a href="tel:%2B39-0432-558216" value="+390432558216">+39-0432-558216</a>, fax <a href="tel:%2B39-0432-558222" value="+390432558222">+39-0432-558222</a><br>
><br>
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><br>
<br>
</div></div><span class="HOEnZb"><font color="#888888">--<br>
"When you are solving a problem, don’t worry. Now, after you have solved the problem, then that’s the time to worry." Richard Feynman<br>
<br>
Fabio Affinito, PhD<br>
SuperComputing Applications and Innovation Department<br>
CINECA - via Magnanelli, 6/3, 40033 Casalecchio di Reno (Bologna) - ITALY<br>
Tel: <a href="tel:%2B39%20051%206171794" value="+390516171794">+39 051 6171794</a> Fax: <a href="tel:%2B39%20051%206132198" value="+390516132198">+39 051 6132198</a><br>
</font></span><div class="HOEnZb"><div class="h5"><br>
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</div></div></blockquote></div><br><br clear="all"><br>-- <br><div class="gmail_signature">-------------------------------------------------------------------------------------------<br>Prof. Michele Ceriotti <br>Laboratory of Computational Science and Modelling (COSMO)<br>MXG 338 (Bâtiment MXG)<br>Station 12<br>CH-1015 Lausanne<br>--------------------------------------------------------------------------------------------</div>
</div>