[Wien] Re: lapw2-error with wien2k_03

[Kevin Jorissen]

I thought the problem happened while reading the help-files, or am I missing
something?
Also, he doesn't any sign on the screen output of lapw2 finishing.  Isn't
the writing to case.dayfile done when the program *starts*, while you
suggest it happens after the program has *finished*?  At least, that's how I
understand run_lapw.

Kevin.



----- Original Message -----
From: "Stefaan Cottenier" <Stefaan.Cottenier at fys.kuleuven.ac.be>
To: <wien at zeus.theochem.tuwien.ac.at>
Sent: Friday, June 20, 2003 9:44 AM
Subject: Re: [Wien] Re: lapw2-error with wien2k_03


>
> > I am using on Pentium.
>
> Then it is different from my problem.
>
> >All calculations fail in Lapw2.The *.dayfile file as followed :
> >
> >     start  (四  6月 12 10:43:26 CST 2003) with lapw0 (20/20 to go)
> > >   lapw0  (10:43:26) 9.900u 0.056s 0:10.67 93.2% 0+0k 0+0io 260pf+0w
> > >   lapw1    (10:43:37) 253.714u 1.673s 4:18.09 98.9% 0+0k 0+0io
312pf+0w
> > >   lapw2  (10:47:55) 9.240u 0.199s 0:09.57 98.5% 0+0k 0+0io 270pf+0w
> >
> > >   stop error
>
> This output shows that lapw2 has finished correctly. The error must come
> immediately after lapw2, that is either lcore or lapwso (if you are using
> spin-orbit). Assuming the first case, what is the screen output if you do
>
> x lcore
>
> Stefaan
>
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