[Q-e-developers] plumed question

Layla Martin-Samos lmartinsamos at gmail.com
Tue Dec 20 21:41:28 CET 2011


Dear Stepan, PLUMED supports also the Car-Parrinello of espresso! you can
dowload the files at http://qe-forge.org/frs/?group_id=10

bests

Layla

2011/12/19 stepan <stepanko at gmail.com>

> Dear QE Developers,
>
> I am currently considering using QE together with PLUMED to study
> dissolution of quartz, and it seems to me that QE when coupled with
> PLUMED supports only Born-Oppenheimer molecular dynamics, but not
> Car-Parrinello.
>
> Is that right? Or I am missing something?
>
> Thanks,
>
> Stepan Hlushak
> _______________________________________________
> Q-e-developers mailing list
> Q-e-developers at qe-forge.org
> http://qe-forge.org/mailman/listinfo/q-e-developers
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/developers/attachments/20111220/a68a00a6/attachment.html>


More information about the developers mailing list