dear all, i do surface calculation with pw.x, i want to estimate the C value in the tetragonal structure,? after scf calculation i find that many values of C have the same energy which you can see it in the figure. thanks ================
SakhraouiTaoufik LMCN Faculty of science Monastir, Tunisia ================ -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20130310/232a41a8/attachment.html
