[Pw_forum] Questions about pseudopotential generation.
Emine Kucukbenli
kucukben at sissa.it
Thu Sep 22 01:09:39 CEST 2011
Dear Daniel,
I think you can find the answers to your questions in the guide inside
the QE distribution (new address in svn version is atomic/Doc) plus
these:
http://people.sissa.it/~dalcorso/lectures/lecture_pseudo_sb_2009.pdf
http://www.impmc.upmc.fr/~paulatto/shanghai.pdf
I am linking the PAW one (the second) in case you want to do GIPAW
calculations. It is important to understand the PAW formalism before
doing so.
cheers,
emine kucukbenli, phd student, sissa, italy
----------------------------------------------------------------
SISSA Webmail https://webmail.sissa.it/
Powered by Horde http://www.horde.org/
More information about the users
mailing list