[Pw_forum] How to download a QE snapshot from SVN repository
Nam Tran
mygroundstates at gmail.com
Mon Apr 3 03:47:19 CEST 2017
Thank you for you reply,
May I have one more question? Is this code the same as QMMMW wrapper
package from Quantum Espresso ?
http://www.sciencedirect.com/science/article/pii/S0010465515001678
Best Regards
Nam Tran
On Fri, Mar 31, 2017 at 7:03 PM, Paolo Giannozzi <p.giannozzi at gmail.com>
wrote:
> You may use this mirror: https://github.com/QEF/q-e.git. I think that
> recent versions of QE have the QMMM support built in, but no warranty
>
> Paolo
>
> On Thu, Mar 30, 2017 at 8:06 AM, Nam Tran <mygroundstates at gmail.com>
> wrote:
> > Dear QE Developers,
> >
> > I am trying to test an experimental code for QM/MM molecular dynamics
> > simulations in LAMMPS. But it requires to download a QE snapshot from SVN
> > repository.
> >
> > Could you please tell me how to download that ?
> >
> > https://github.com/lammps/lammps/tree/master/lib/qmmm
> >>
> >> At the time of this writing (July 2016) you have to download a
> >> QE snapshot (revision 12611) from the SVN repository, since no
> >> official release with the completed QM/MM support code has been
> >> made available yet. The current plan is to have a usable QM/MM
> >> interface released with the next Quantum ESPRESSO release version 6.0.
> >
> >
> > Best regards
> >
> > Tran
> >
> >
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
>
>
>
> --
> 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
>
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