[Wien] Question on internal parameter optimization

[Bo Qiu]

Oh, I see! Thanks for your info!

Yours,
Jaccob


On 10/30/07, David Holec <dh331 at cam.ac.uk> wrote:
>
>  Dear Jaccob,
>
> putting the attached file into SRC_dstart directory and recompiling only
> this program (using siteconfig -> recompile option) should do it for you.
> You don't need to reinstall the whole Wien2k.
>
> All the best,
> David
>
>
> ------------------------------
> *From:* wien-bounces at zeus.theochem.tuwien.ac.at [mailto:
> wien-bounces at zeus.theochem.tuwien.ac.at] *On Behalf Of *Jaccob Smith
> *Sent:* Tuesday, October 30, 2007 5:14 PM
> *To:* A Mailing list for WIEN2k users
> *Subject:* Re: [Wien] Question on internal parameter optimization
>
>  Thanks a lot for your reply and I got your attached file. But there is a
> question, do I need to remove the compiled wien2k version completely then
> replace that init.f in the uncompiled package with this one then redo the
> compilation? Thanks!
>
> Yours,
> Jaccob
>
> On 10/30/07, Peter Blaha <pblaha at theochem.tuwien.ac.at> wrote:
> >
> > Sorry, forget to attach the file.
> >
> >                                        P.Blaha
> >
> > --------------------------------------------------------------------------
> > 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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>
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-- 
Thanks and Best Wishes.

Sincerely yours,
Bo Qiu
http://web.ics.purdue.edu/~qiub/
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