Dear all,
Now, i am trying to calculate same properties sio2 for thin films. As a first step, we need to generate case.struct for the thin film. For this, i have searched in pwscf forum to do these kind of calculations, i didn't find any tutorial type input for thin film structure file. As a beginners,i need some basic guidelines to build the thin film structure file. So, i am requesting some one to provide the preliminary details to do so. What are all the changes in structure file from bulk to thin films ???* * Thanks in advance -- With Best Regards SAMAD ZARE, phD Student UTM university Nanotechnology Research Alliance APSI, UTM 81310, Skudai,Johor Bahru, Malaysia -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20130603/39977a26/attachment.html
