[Pw_forum] how can I create a supercell in PWSCF?

Pieremanuele Canepa pc229 at kent.ac.uk
Fri Apr 24 15:55:12 CEST 2009


Dear all,
does exist a script or a  small program  in Quantum espresso that allow me
to  create a suitable supercell (for instance 2x2x1) starting from a
primitive cell of PWSCF?
Best regards, Piero

-- 
Pieremanuele Canepa
Room 230
School of Physical Sciences, Ingram Building,
University of Kent, Canterbury, Kent,
CT2 7NH
United Kingdom
-----------------------------------------------------------
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20090424/b394bcac/attachment.html>


More information about the users mailing list