[Pw_forum] Phonon DOS per polarization

Bo Qiu 200210qb at gmail.com
Thu Oct 25 17:47:26 CEST 2012


Dear developers and users,

I learned that QHA can be used to compute partial phonon DOS, but it seems
from the output it only decomposes total DOS into per atom and
per Cartesian direction contributions. I wonder if there is an option to
decompose into per polarization contributions as LA1, LA2, TA, LO1, TO1,
TO2,  etc. Thanks a lot!

Bo
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20121025/ab221b3b/attachment.html>


More information about the users mailing list