[Pw_forum] plotting of the wfn with phases

Duy Le ttduyle at gmail.com
Fri Jun 28 15:43:41 CEST 2013

You can use lsign in pp.x

Duy Le
Postdoctoral Associate
Department of Physics
University of Central Florida.
Website: http://www.physics.ucf.edu/~dle

On Fri, Jun 28, 2013 at 6:28 AM, Davide Tiana <d.tiana at bath.ac.uk> wrote:
> Dear all,
> I would like to compare the crystalline orbitals of periodic calc made
> with pw.x with molecular made with gamess on a single molecule.
> using pw.x is it possible have the full information of the wfn (so
> including the phases) at the gamma point?
> Cheers,
> Davide
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum

More information about the users mailing list