[Pw_forum] heat capacity
Nafise Rezaei
nafiserb at gmail.com
Tue Sep 6 07:59:29 CEST 2011
Dear Prof. Eyvaz Isaev,
I want to calculate heat capacity for the Rhombohedral lattice (ibrav= 5).
When I try to use QHA package, I have encountered with this message
"Trigonal R: not implemented yet".
I have seen similar question in mailing list and your reply. But yet I
don't know what should be done?
Thanks in advance,
Nafise
---
Nafise Rezaei
Dept of Physics, Isfahan University of Technology
Isfahan, Iran
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20110906/52b9181f/attachment.html>
More information about the users
mailing list