[Pw_forum] GW for large systems
Gianluca Giovannetti
gianluca.giovannetti at gmail.com
Sat Jul 17 07:27:16 CEST 2010
Dear All,
i want to do GW calculations on a large system containing 120 ions.
i would say i can try to run it with the scheme proposed by P. Umari, G.
Stenuit and S. Baroni, *Optimal representation of the polarization
propagator for large-scale GW calculations*, Phys. Rev. B *79* (2009)
201104(R).
do you have some experience about it?
i hope a such calculation can be dealt with this scheme.
is it available the GW scheme mentioned above in some version of Quantum
Espresso?
i have found at the website:
http://gww.qe-forge.org/index.php?page=intro
a good description about how to use it.
is it available with 4.2.1 version?
i thank you in advance.
cheers,
Gianluca Giovannetti
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20100717/20301fad/attachment.html>
More information about the users
mailing list