[Pw_forum] Hartree-Fock calculation
Stefano de Gironcoli
degironc at sissa.it
Tue May 12 22:11:51 CEST 2009
mohaddeseh abbasnejad wrote:
> Dear Axel,
>
> Honestly I heard it from one of my colleagues. In order to him, it's
> under test. He just knew about it and nothing more.
indeed ... read example/EXX_example/README
Stefano de Gironcoli - SISSA and DEMOCRITOS
> Yours,
> Mohaddeseh
>
>
>
> On Tue, May 12, 2009 at 10:25 PM, Axel Kohlmeyer
> <akohlmey at cmm.chem.upenn.edu <mailto:akohlmey at cmm.chem.upenn.edu>> wrote:
>
> On Tue, 2009-05-12 at 09:29 -0700, mohaddeseh abbasnejad wrote:
> > Dear all,
> >
> > I think that it's possible to do Hartree-Fock calculation using
> PWSCF
> > but it needs some utilities which should be installed before using.
>
> dear mohaddeseh,
>
> please explain where you get this impression from.
>
> > I was wondering if you could help me.
>
> no.
>
> > Thanks in advance.
>
> cheers,
> axel.
>
> > Yours,
> > Mohaddeseh
> >
> >
> >
> >
> > --
> > ---------------------------------------------------------
> >
> > Mohaddeseh Abbasnejad,
> > Room No. 323, Department of Physics,
> > University of Tehran, North Karegar Ave.,
> > Tehran, P.O. Box: 14395-547- IRAN
> > Tel. No.: +98 21 6111 8634 & Fax No.: +98 21 8800 4781
> > Cellphone: +989177317514
> > E-Mail: m.abbasnejad at gmail.com <mailto:m.abbasnejad at gmail.com>
> > Website: http://physics.ut.ac.ir <http://physics.ut.ac.ir/>
> >
> > ---------------------------------------------------------
> >
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> --
> =======================================================================
> Axel Kohlmeyer akohlmey at cmm.chem.upenn.edu
> <mailto:akohlmey at cmm.chem.upenn.edu> http://www.cmm.upenn.edu
> <http://www.cmm.upenn.edu/>
> Center for Molecular Modeling -- University of Pennsylvania
> Department of Chemistry, 231 S.34th Street, Philadelphia, PA
> 19104-6323
> tel: 1-215-898-1582, fax: 1-215-573-6233, office-tel: 1-215-898-5425
> =======================================================================
> If you make something idiot-proof, the universe creates a better
> idiot.
>
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>
> --
> ---------------------------------------------------------
>
> Mohaddeseh Abbasnejad,
> Room No. 323, Department of Physics,
> University of Tehran, North Karegar Ave.,
> Tehran, P.O. Box: 14395-547- IRAN
> Tel. No.: +98 21 6111 8634 & Fax No.: +98 21 8800 4781
> Cellphone: +989177317514
> E-Mail: m.abbasnejad at gmail.com <mailto:m.abbasnejad at gmail.com>
> Website: http://physics.ut.ac.ir
>
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