I do a phonon calculation for titanium (with the ph.x). For the beta phase
(bcc), I get negative frequencies in all pressures. It is known from the
literature that the beta phase in titanium is stable only in high
temperatures. What can I do to calculating the phonon spectrum in high
temperatures?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: 
http://pwscf.org/pipermail/pw_forum/attachments/20131031/c297c3bb/attachment.html
 

Reply via email to