Nicola, I don't do this myself. But I am aware of people at Sandia and LLNL who use DFT to study the equation of state for warm dense matter with some connection to fusion. I think folks are using a bunch of DFT codes: Qbox, VASP, QE, and also using QE as input into QMC.
QMCPACK and CASINO use QE as their input wave function (you probably know this). On Tue, Jan 28, 2014 at 8:46 AM, Nicola Marzari <nicola.marzari at epfl.ch>wrote: > > > Dear All, > > > I've been asked by some colleagues working on a FP7 HPC project if > there are any QE users that do materials modelling for fusion > applications. > > Apparently in ITER meetings it has often been mentioned that QE > is being used for these, but it's not clear who are the interested > parties - if the case drop me a line. Worse case scenario is that > there might be a bit of software support coming in. > > Thanks a lot, > > nicola > > > ---------------------------------------------------------------------- > Prof Nicola Marzari, Chair of Theory and Simulation of Materials, EPFL > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -- Nichols A. Romero, Ph.D. -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140129/4f458923/attachment.html
