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Dear all,</div>
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As of Cineca we would be happy to provide you some updates on two topics we are working on:</div>
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<div class="elementToProof">data collection for training a NN-based performance model (by M. Safari)</div>
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<div class="elementToProof">integration of QM/MM with MIMIC in QE (by A. Acocella)</div>
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I don't think we will be able to attend the Total Energy in Trieste. Do you think it will be suitable to discuss these two topics on the next meeting (if time permits) or to postpone it to January?</div>
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Best,</div>
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Fabio </div>
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style="margin-top:0px;margin-bottom:0px;">+39 0516171794</p></td></tr></table></td></tr></table></td></tr><tr style="font-size:0;"><td align="left" style="vertical-align:top;"><table cellpadding="0" cellspacing="0" border="0" style="border-collapse:collapse;font-size:0;color:#000001;font-style:normal;font-weight:400;white-space:nowrap;"><tr style="font-size:14px;"><td align="left" style="vertical-align:top;font-size:0;"><table cellpadding="0" cellspacing="0" border="0" style="border-collapse:collapse;font-size:0;line-height:normal;"><tr style="font-size:0;"><td align="left" style="padding:0 10px 0 0;vertical-align:top;"><p style="margin-top:0px;margin-bottom:0px;"><img src="cid:image753718.png@401D47F5.36046795" width="16" height="16" border="0" alt="" style="width:16px;min-width:16px;max-width:16px;height:16px;min-height:16px;max-height:16px;font-size:0;" /></p></td></tr></table></td><td align="left" style="vertical-align:top;font-family:'Century Gothic';"><p style="margin-top:0px;margin-bottom:0px;"><a href="mailto:f.affinito@cineca.it" target="_blank" id="LPlnk689713" style="text-decoration:none;color:#337AB7;"><span style="text-decoration:underline;">f.affinito@cineca.it</span></a></p></td></tr></table></td></tr></table></td></tr></table></td></tr></table></td></tr></table></td></tr></table></div><div id="appendonsend"></div>
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<div id="divRplyFwdMsg" dir="ltr"><font face="Calibri, sans-serif" style="font-size:11pt" color="#000000"><b>Da:</b> Pietro Davide Delugas <pdelugas@sissa.it><br>
<b>Inviato:</b> martedì 19 novembre 2024 09:43<br>
<b>A:</b> developers@lists.quantum-espresso.org <developers@lists.quantum-espresso.org>; Paolo Giannozzi <paolo.giannozzi@uniud.it>; Stefano Baroni <baroni@sissa.it>; Davide Brunato <brunato@sissa.it>; Bainglass, Edan <Edan.Bainglass@unt.edu>; Fabio Affinito
<f.affinito@cineca.it>; Fabrizio Ferrari Ruffino <faferrar@sissa.it>; Andrea Ferretti <andrea.ferretti@nano.cnr.it>; Ivan Carnimeo <icarnimeo@sissa.it>; lorenzo.paulatto@upmc.fr <lorenzo.paulatto@upmc.fr>; Davide Ceresoli <davide.ceresoli@cnr.it>; Oscar Baseggio
<obaseggi@sissa.it>; Pietro Bonfa <pietro.bonfa@unipr.it>; matteo.cococcioni@unipv.it <matteo.cococcioni@unipv.it>; Nicola Marzari <nicola.marzari@epfl.ch>; Michele Pavanello <m.pavanello@rutgers.edu>; Stefano de Gironcoli <degironc@sissa.it>; Andrea Dal Corso
<dalcorso@sissa.it>; Layla Martin-Samos Colomer <marsamos@sissa.it>; Andreussi, Oliviero <Oliviero.Andreussi@unt.edu>; Sergio Orlandini <s.orlandini@cineca.it>; Laura Bellentani <l.bellentani@cineca.it>; giacomo.rossi@intel.com <giacomo.rossi@intel.com>; Samuel
Poncé <samuel.pon@gmail.com>; Feliciano Giustino <fgiustino@oden.utexas.edu>; Qiao Junfeng <junfeng.qiao@epfl.ch>; Bercx Marnik <marnik.bercx@epfl.ch>; yeluo@anl.gov <yeluo@anl.gov>; Daniele Cesarini <d.cesarini@cineca.it>; Sasha Fonari <alexandr.fonari@schrodinger.com>;
jacob.gavartin@schrodinger.com <jacob.gavartin@schrodinger.com>; jaemolim96@gmail.com <jaemolim96@gmail.com>; xs161@newark.rutgers.edu <xs161@newark.rutgers.edu>; Filippo Spiga <fspiga@nvidia.com>; Giovanni Pizzi <giovanni.pizzi@epfl.ch>; Marco.BuongiornoNardelli@unt.edu
<Marco.BuongiornoNardelli@unt.edu>; mandal.sagarmoy@fau.de <mandal.sagarmoy@fau.de>; Tobias Kloeffel <tobias.kloeffel@fau.de>; Riccardo Bertossa <rbertoss@sissa.it>; Federico Ficarelli <f.ficarelli@cineca.it>; hsin-yu.ko@cornell.edu <hsin-yu.ko@cornell.edu>;
distasio@cornell.edu <distasio@cornell.edu>; Nicola Spallanzani <nicola.spallanzani@nano.cnr.it>; sabyasachi.tiwari@austin.utexas.edu <sabyasachi.tiwari@austin.utexas.edu>; Falletta, Stefano <stefanofalletta@g.harvard.edu>; Neven Golenic <ngolenic@sissa.it>;
Eric Macke <emacke@uni-bremen.de>; iurii.timrov@psi.ch <iurii.timrov@psi.ch>; Andrea Urru <au168@physics.rutgers.edu>; Antimo Marrazzo <amarrazz@sissa.it>; Piero Altoe <paltoe@nvidia.com>; Colonna Nicola (PSI) <nicola.colonna@psi.ch>; arita@riken.jp <arita@riken.jp><br>
<b>Oggetto:</b> QE developers' meeting in presence January 7th in Trieste</font>
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Dear all</div>
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The Total Energy workshop in ICTP, Trieste, starting January 8th, could be a good occasion to meet those travelling for the event. For this, we would like to organize an in-person QE developers' meeting on the
<b>afternoon of January 7th.</b></div>
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Please let us know if you will be able to attend. </div>
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Sorry for those coming to Trieste who have already made incompatible travel arrangements. We can also set up small, separate meetings without interfering with the workshop activities.</div>
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In the meantime, we will also have an online QE developers' meeting in <b>December.</b> </div>
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Please fill out the poll at this link to choose a date:</div>
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<span style="color:rgb(74,110,224)"><a href="https://urldefense.com/v3/__https://www.when2meet.com/?27649033-cl4fO__;!!P1tgJ-3e!Be5cRqHLOFjj0vyvr9ECph3m1B5gVJiXNR9gTYeyzHphNgaiho897YIgJ0kjWFr85S0WIjXyC76_HV1KMovX$" target="_blank" id="OWA2100e726-cbbd-fd1c-3813-fc88adc7de83" class="x_editor-rtfLink x_OWAAutoLink" style="color:rgb(74,110,224); margin-top:0pt; margin-bottom:0pt">https://www.when2meet.com/?27649033-cl4fO</a></span></div>
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Thanks and best regards</div>
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Pietro</div>
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