Hi, I was looking through the 5.0.2/PHonon/Gamma directory and questions in the forum but i cannot find any mention of getting eigenvectors using phcg implementation. ?Is this possible? ?If not, is using ph.x the only other way? ?I have a large isolated molecule (>140 atoms) on which i am studying its vibrational modes and using ph.x will take a couple of months on the computational resources that i have.
Thanks, wee liat Carnegie Mellon University -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140128/4bb9cd16/attachment.html
