[DFTB-Plus-User] Plumed interface for DFTB+ v 19.1

[Benjamin Hourahine]

There is now also an example in the latest version (not the 'stable' version) of the online recipes:

https://dftbplus-recipes.readthedocs.io/en/latest/moleculardynamics/plumed2.html

Regards

Ben

On 17/01/2020 16:17, Jerry Tanoury wrote:
Thank you!

Jerry

On Fri, Jan 17, 2020 at 10:21 AM Bálint Aradi <aradi at uni-bremen.de<mailto:aradi at uni-bremen.de>> wrote:
Dear Jerry,

the code with the PLUMED interface is on the master branch

https://github.com/dftbplus/dftbplus/commits/master

already (and will be also part of the next official release).


  Best regards,

  Bálint

--
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/cms/people/b-aradi/


_______________________________________________
DFTB-Plus-User mailing list
DFTB-Plus-User at mailman.zfn.uni-bremen.de<mailto:DFTB-Plus-User at mailman.zfn.uni-bremen.de>
https://mailman.zfn.uni-bremen.de/cgi-bin/mailman/listinfo/dftb-plus-user



_______________________________________________
DFTB-Plus-User mailing list
DFTB-Plus-User at mailman.zfn.uni-bremen.de<mailto:DFTB-Plus-User at mailman.zfn.uni-bremen.de>
https://mailman.zfn.uni-bremen.de/cgi-bin/mailman/listinfo/dftb-plus-user


--
        Dr.  B.  Hourahine,  Senior  lecturer
            SUPA, Department  of  Physics,
             University  of  Strathclyde,
              John  Anderson  Building,
          107 Rottenrow, Glasgow G4 0NG, UK.
  +44 141 548 2325, benjamin.hourahine at strath.ac.uk<mailto:benjamin.hourahine at strath.ac.uk>

The  Department is  a partner  in SUPA,  the Scottish
            Universities Physics Alliance

The University  of Strathclyde  is a  charitable body,
       registered in Scotland, number SC015263
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://mailman.zfn.uni-bremen.de/pipermail/dftb-plus-user/attachments/20200117/10c03a29/attachment-0001.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: pEpkey.asc
Type: application/pgp-keys
Size: 2513 bytes
Desc: pEpkey.asc
URL: <http://mailman.zfn.uni-bremen.de/pipermail/dftb-plus-user/attachments/20200117/10c03a29/attachment-0001.key>