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- From: nabil_messabihi@voila.fr
- To: forum@abinit.org, forum@abinit.org
- Subject: Re: [abinit-forum] Re: Vanderbuilt uspp error message
- Date: Tue, 13 Sep 2005 12:35:15 +0200 (CEST)
I need somme documents for (binary collision approximation "BCA" and application) pleas!
> Message du 13/09/05 à 02h45
> De : "David Vanderbilt"
> A : forum@abinit.org
> Copie à :
> Objet : Re: [abinit-forum] Re: Vanderbuilt uspp error message
>
> Nuno,
>
> I think it's best to move this off the forum. I'll respond directly.
> If anybody else out there is interested in following the story, let
> me or Nuno know, and we'll cc to you.
>
> David V.
>
> On Mon, 12 Sep 2005, Nuno A. G. Bandeira wrote:
>
> > David Vanderbilt wrote:
> >
> >> But it is strange if
> >> an improper combination was contributed in
> >> Work/079-Au/079-Au-ca--ts/, as these are normally tested before
> >> they are contributed. Did you use what was there without any
> >> modification? If so, you may wish to check with the author (see
> >> the README in that directory) to see if there is a known problem
> >> with it.
> >
> > The file was used without any changes and it's attached to this email. It's
> > also what comes packed with 4.6.3. Could you check in your records to see if
> > it's identical and/or if you have a full-length output ?
> >
> > Thanks for your help.
> >
> > --
> > Nuno A. G. Bandeira, AMRSC
> > Graduate researcher and molecular sculptor
> > Inorganic and Theoretical Chemistry Group,
> > Faculty of Science
> > University of Lisbon - C8 building, Campo Grande,
> > 1749-016 Lisbon,Portugal
> > http://cqb.fc.ul.pt/intheochem/nuno.html
> > Doctoral student @ IST,Lisbon
> > --
> >
>
>
- Re: Re: [abinit-forum] Re: Vanderbuilt uspp error message, marc . torrent, 09/09/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, Nuno A. G. Bandeira, 09/09/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, David Vanderbilt, 09/10/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, Nuno A. G. Bandeira, 09/12/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, David Vanderbilt, 09/13/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, Nuno A. G. Bandeira, 09/12/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, David Vanderbilt, 09/10/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, Nuno A. G. Bandeira, 09/09/2005
- <Possible follow-up(s)>
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, nabil_messabihi, 09/13/2005
- Re: [abinit-forum] Re: Vanderbuilt uspp error message, Nuno A. G. Bandeira, 09/09/2005
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