> How to calculate elastic constant? You should start with this question.
Please have a look at papers Mehl MJ. Phys Rev B 1993;47:2493, and our just published paper on Pt-Sc alloys: Intermetallics 16 (2008) 982?986. Actually, there are tonns of papers devoted to calculation of elastic constants. Bests, Eyvaz. ------------------------------------------------------------------- Prof. Eyvaz Isaev, Theoretical Physics Department, Moscow State Institute of Steel & Alloys, Russia, Department of Physics, Chemistry, and Biology (IFM), Linkoping University, Sweden Condensed Matter Theory Group, Uppsala University, Sweden Eyvaz.Isaev at fysik.uu.se, isaev at ifm.liu.se, eyvaz_isaev at yahoo.com --- On Fri, 8/8/08, premlata pandit <lataprem29 at gmail.com> wrote: > From: premlata pandit <lataprem29 at gmail.com> > Subject: [Pw_forum] elastic constant calculation > To: pw_forum at pwscf.org > Date: Friday, August 8, 2008, 2:55 PM > hello > How to calculate elastic constant? > -- > Premlata Pandit > Ph.d. student > Barkatullah university > Bhopal (MP) > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum
