Hi, Use QHA ins your QE case. Any question, please contact me.
Bestst, Eyvaz. ------------------------------------------------------------------- Prof. Eyvaz Isaev, Department of Physics, Chemistry, and Biology (IFM), Linkoping University, Sweden Theoretical Physics Department, Moscow State Institute of Steel & Alloys, Russia, isaev at ifm.liu.se, eyvaz_isaev at yahoo.com ________________________________ From: jiaxu yan <[email protected]> To: pw_forum at pwscf.org Sent: Thu, August 26, 2010 8:36:29 AM Subject: [Pw_forum] Partial Phonon Density Of States Dear PWscf users, I performed a phonon calculation but I can't calculate the Partial Phonon Density Of States. Could you tell me how it can be calculated ? Thank you very much Yan Jiaxu School of Physical and Mathematical Sciences Nanyang Technological University, Singapore -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20100826/23083b41/attachment-0001.htm
