Bhabyadarsan Sahoo (Lipun) Scientific Officer - D , Applied Physics Division, Bhabha Atomic Research Center, Mumbai - 400085, India.
---------- Forwarded message ---------- From: B D SAHOO <[email protected]> Date: Mon, Jul 21, 2014 at 7:01 PM Subject: ABOUT POINT GROUP OF (Pnma) STRUCTURE To: PWSCF Forum <pw_forum at pwscf.org> i have given all my files regarding the problem. why i am not finding the correct mode symmetry of pnma structure of Sb2Se3 compound by calculating the phonon at gamma point.as it is a orthorhombic structure so it should show D2h_(mmm) but it is showing as C2h(2/m) so whether i am doing anything wrong in my input...... B D Sahoo Mumbai - 400085, India. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140721/100b95de/attachment.html -------------- next part -------------- A non-text attachment was scrubbed... Name: phonon.out Type: application/octet-stream Size: 148006 bytes Desc: not available Url : http://pwscf.org/pipermail/pw_forum/attachments/20140721/100b95de/attachment.obj -------------- next part -------------- A non-text attachment was scrubbed... Name: sample.ph.in Type: application/octet-stream Size: 553 bytes Desc: not available Url : http://pwscf.org/pipermail/pw_forum/attachments/20140721/100b95de/attachment-0001.obj -------------- next part -------------- A non-text attachment was scrubbed... Name: sample_sb2s3.pw.in Type: application/octet-stream Size: 1921 bytes Desc: not available Url : http://pwscf.org/pipermail/pw_forum/attachments/20140721/100b95de/attachment-0002.obj
