<html><head><meta http-equiv="Content-Type" content="text/html; charset=us-ascii"></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; line-break: after-white-space;" class="">Hi,I think that dynamical matrix calculations are currently compatible with vdW functionals, both non local and DFT-D2.<div class=""><br class=""></div><div class="">There is a quite explanatory and detailed list of what ph.x can and cannot do in the header of PHonon/PH/phonon.f90</div><div class=""><br class=""></div><div class="">Giovanni</div><div class=""><br class=""></div><div class=""><div><blockquote type="cite" class=""><div class="">On 12 Dec 2017, at 22:37, Gautam Gaddemane <<a href="mailto:gautamg88@gmail.com" class="">gautamg88@gmail.com</a>> wrote:</div><br class="Apple-interchange-newline"><div class=""><div dir="ltr" class="">Hello everyone,<div class="">I am new to Quantum Espresso and I am trying to calculate the phonons for bilayer phosphorene.</div><div class="">Currently I am using Quantum Espresso 6.1 and I would like to know if I can implement vdW corrections int his calculations.</div><div class=""><br class=""></div><div class="">Thank you</div><div class="">Gautam</div><div class=""><br clear="all" class=""><div class=""><div class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr" class="">GAUTAM GADDEMANE<div class="">DEPARTMENT OF MATERIALS SCIENCE AND ENGINEERING</div><div class="">UNIVERSITY OF TEXAS AT DALLAS</div></div></div></div>
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<div style="color: rgb(0, 0, 0); letter-spacing: normal; text-align: start; text-indent: 0px; text-transform: none; white-space: normal; word-spacing: 0px; -webkit-text-stroke-width: 0px; word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space;" class="">-- <br class=""><br class="">Giovanni Cantele, PhD<br class="">CNR-SPIN<br class="">c/o Dipartimento di Fisica<br class="">Universita' di Napoli "Federico II"<br class="">Complesso Universitario M. S. Angelo - Ed. 6<br class="">Via Cintia, I-80126, Napoli, Italy<br class=""><a href="mailto:giovanni.cantele@spin.cnr.it" class="">e-mail: giovanni.cantele@spin.cnr.it</a><br class="">Phone: +39 081 676910<br class="">Skype contact: giocan74<br class=""><br class="">ResearcherID: http://www.researcherid.com/rid/A-1951-2009<br class="">Web page: http://people.fisica.unina.it/~cantele<br class=""></div>
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