<html><head><meta http-equiv="Content-Type" content="text/html; charset=utf-8"></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; line-break: after-white-space;" class="">Dear Leopold, <div class=""><br class=""></div><div class="">in Fig. 18 of our recent review paper, a mean value of 2.28 meV/atom is reported, which is in line with the </div><div class="">2.1 meV/atom as obtained using Abinit in conjunction with exactly the same GTH-type dual-space NCPPs. </div><div class=""><br class=""></div><div class="">Merry christmas, </div><div class="">Thomas </div><div class=""><div><br class=""><blockquote type="cite" class=""><div class="">Am 21.12.2020 um 21:23 schrieb Leopold Talirz <<a href="mailto:leopol...@gmail.com" class="">leopol...@gmail.com</a>>:</div><br class="Apple-interchange-newline"><div class="">Hi,<div class=""><br class=""></div><div class="">4 years later, is there an update on the status of the delta test for CP2K?</div><div class="">Is there still a technical problem blocking the reporting of the delta value for CP2K?</div><div class=""><br class=""></div><div class="">I regularly get questions about the accuracy of cp2k for solid-state calculations and while the devil is often in the details, having cp2k be represented on this list would seem like a step in the right direction.</div><div class=""><br class=""></div><div class="">Best,</div><div class="">Leopold</div><div class=""><br class=""></div><div class="gmail_quote"><div dir="auto" class="gmail_attr">On Wednesday, 24 August 2016 at 16:35:57 UTC+2 jgh wrote:<br class=""></div><blockquote class="gmail_quote" style="margin: 0 0 0 0.8ex; border-left: 1px solid rgb(204, 204, 204); padding-left: 1ex;">Hi <br class=""> <br class="">The Delta test requires a k-point code and CP2K was at that time not <br class="">(and in fact still isn't fully) able to perform such calculations. <br class="">We will in the future (hopefully) be able to provide this type of <br class="">tests. <br class=""> <br class="">regards <br class=""> <br class="">Juerg <br class="">-------------------------------------------------------------- <br class="">Juerg Hutter Phone : <a href="tel:+41%2044%20635%2044%2091" value="+41446354491" target="_blank" rel="nofollow" class="">++41 44 635 4491</a> <br class="">Institut für Chemie C FAX : <a href="tel:+41%2044%20635%2068%2038" value="+41446356838" target="_blank" rel="nofollow" class="">++41 44 635 6838</a> <br class="">Universität Zürich E-mail: <a href="" data-email-masked="" rel="nofollow" class="">h...@chem.uzh.ch</a> <br class="">Winterthurerstrasse 190 <br class="">CH-8057 Zürich, Switzerland <br class="">--------------------------------------------------------------- <br class=""> <br class="">-----<a href="" data-email-masked="" rel="nofollow" class="">c...@googlegroups.com</a> wrote: -----To: cp2k <<a href="" data-email-masked="" rel="nofollow" class="">c...@googlegroups.com</a>> <br class="">From: Simiam Ghan <br class="">Sent by: <a href="" data-email-masked="" rel="nofollow" class="">c...@googlegroups.com</a> <br class="">Date: 08/24/2016 12:23PM <br class="">Subject: [CP2K:8093] CP2K Δ-value in the recent international DFT Benchmark ? <br class=""> <br class="">Hello all,Out of interest are there any plans for CP2K to participate in this recent benchmark of DFT codes? I was just suprised not to see it on the list. <a href="https://molmod.ugent.be/deltacodesdft" target="_blank" rel="nofollow" data-saferedirecturl="https://www.google.com/url?hl=en-GB&q=https://molmod.ugent.be/deltacodesdft&source=gmail&ust=1608668293496000&usg=AFQjCNHqDN-bbxiE_GDX3hRE7r_SzjVHOA" class="">https://molmod.ugent.be/deltacodesdft</a> <br class="">Greetings,Simiam Ghan <br class=""> <br class=""> <br class=""> <br class="">-- <br class=""> <br class="">You received this message because you are subscribed to the Google Groups "cp2k" group. <br class=""> <br class="">To unsubscribe from this group and stop receiving emails from it, send an email to <a href="" data-email-masked="" rel="nofollow" class="">cp...@googlegroups.com</a>. <br class=""> <br class="">To post to this group, send email to <a href="" data-email-masked="" rel="nofollow" class="">c...@googlegroups.com</a>. <br class=""> <br class="">Visit this group at <a href="https://groups.google.com/group/cp2k" target="_blank" rel="nofollow" data-saferedirecturl="https://www.google.com/url?hl=en-GB&q=https://groups.google.com/group/cp2k&source=gmail&ust=1608668293496000&usg=AFQjCNF6LfnMNHm2cq7T3JFLk0IcqLUa6w" class="">https://groups.google.com/group/cp2k</a>. <br class=""> <br class="">For more options, visit <a href="https://groups.google.com/d/optout" target="_blank" rel="nofollow" data-saferedirecturl="https://www.google.com/url?hl=en-GB&q=https://groups.google.com/d/optout&source=gmail&ust=1608668293497000&usg=AFQjCNHw_HsYuAdNuWnn_-3cA5c87Ostmw" class="">https://groups.google.com/d/optout</a>. <br class=""> <br class=""> <br class=""></blockquote></div><div class=""><br class="webkit-block-placeholder"></div> -- <br class=""> You received this message because you are subscribed to the Google Groups "cp2k" group.<br class=""> To unsubscribe from this group and stop receiving emails from it, send an email to <a href="mailto:cp...@googlegroups.com" class="">cp...@googlegroups.com</a>.<br class=""> To view this discussion on the web visit <a href="https://groups.google.com/d/msgid/cp2k/ca306d84-b646-45e3-aa86-53e72ed8058an%40googlegroups.com?utm_medium=email&utm_source=footer" class="">https://groups.google.com/d/msgid/cp2k/ca306d84-b646-45e3-aa86-53e72ed8058an%40googlegroups.com</a>.<br class=""> </div></blockquote></div><br class=""></div></body></html>