Thanks, indeed there are - for example pseudo-dojo. MK On Thu, 6 Sep 2018 at 10:48, Paolo Giannozzi <[email protected]> wrote:
> There are many norm-conserving PP's as well, including a few generated > with TPSS meta-GGA, in the various PP tables available on the web server > (and on other sites as well: see "More about pseudopotentials") > > The implementation of meta-GGA with USPP or PAW is not completely > straightforward: the kinetic energy density as it is computed now does not > include the contribution from the augmentation part > > Paolo > > On Thu, Sep 6, 2018 at 10:26 AM, Michal Krompiec < > [email protected]> wrote: > >> Dear All, >> I'm trying to use a meta-GGA functional and I got this error: Meta-GGA >> not implemented with USPP/PAW. Does it mean that ultra-soft >> pseudopotentials or PAW cannot be used in conjunction with meta-GGA in QE? >> It is a bit confusing as all pseudopotentials from the PS library are USPP >> or PAW. Am I missing something? >> Thanks in advance, >> Michal Krompiec >> >> _______________________________________________ >> users mailing list >> [email protected] >> https://lists.quantum-espresso.org/mailman/listinfo/users >> > > > > -- > Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, > Univ. Udine, via delle Scienze 208, 33100 Udine, Italy > Phone +39-0432-558216, fax +39-0432-558222 > > _______________________________________________ > users mailing list > [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users
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