Hi, Definitely, a2Fdos! The first column is \omega, the second one is total a2Fdos, others are mode-projected a2Fdos.
Please, provide your affiliation when post a question to the forum. Bests, 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: HASAN SAH?N <[email protected]> To: pw_forum at pwscf.org Sent: Wed, October 27, 2010 10:16:15 PM Subject: [Pw_forum] a2F calculation Hi, I have ben trying to calculate spectral function a2F with respect to phonon frequency cm-1. At the end of my calculation I get the files: dyna2F, a2Fdos, a2Fq2r I see that they contain some column data. Which one of these files does contain the information of a2F-frequency ? Hasan Sahin -------------- next part -------------- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20101027/2d6c1b47/attachment-0001.htm
