[Wien] scfmonitor / analyse not found
Peter Blaha
pblaha at zeus.theochem.tuwien.ac.at
Wed May 19 12:27:38 CEST 2004
> > I am trying to use the scfmonitor script to examine my calculations but I
> > get the following error message:
>
> scfmonitor does not exist any more in WIEN2k. It has been replaced by
> the analysis functionality of W2WEB.
>
> Best
> Joachim
I'm working on a modification of scfmonitor, so that it works with
WIEN2k_03 and later and is also integrated into W2web.
I'll rewrite analyse.f by a simple shell script.
P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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