[Pw_forum] fix volume

Sakhrawi Taoufek tsakhrawi at yahoo.com
Mon Nov 12 09:13:39 CET 2012


Dear all,

i want to fix the volume and each time calculate the total energy to optimize the lattice parameter, there is any idea how to proceed.
each suggestion will be appreciated.
--------------------------------
Sakhraoui
Taoufik
Ph.D student 
Faculty of Sciences of Monastir
Department of Physics
L.M.C.N
Monastir, Tunisia
--------------------------------
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20121112/74cc2a7d/attachment.html>


More information about the users mailing list