[Wien] photoluminiscence spectra

[tarun maurya]

Respected Sir,

Could you please tell me how we can calculate the photoluminiscence spectra from WIEn2k.

Tarun Maurya
IET, MJP Rohilkhand University,
Bareilly-234 006 INDIA

On Sun, 18 Nov 2007 Peter Blaha wrote :
>Check the faq pages on www.wien2k.at.
>
>There is such a script for the load leveler, but the way to create the
>"dual" .machines file is more or less identical.
>
>Che Seabourne schrieb:
> >
> >   I am running wien version 7.3 (latest update) on 64 bit architecture,
> > using intel fortran and libraries. Has anyone discovered a way of
> > launching WIEN2K through sun grid engine (SGE) with both kpoint and MPI
> > parallel? - we've got k-point sorted, but it is the MPI/mixed that we
> > could do with. Any help would be greatly appreciated. Regards, Che
> >
> >
> > --
> > -------------------------------------------------------------------
> > Che Seabourne
> > Institute for Materials Research
> > University of Leeds
> >
> >
> > ------------------------------------------------------------------------
> >
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