[Pw_forum] Hartree-Fock calculation
Axel Kohlmeyer
akohlmey at cmm.chem.upenn.edu
Tue May 12 19:55:01 CEST 2009
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
>
>
>
>
> --
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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
> Website: http://physics.ut.ac.ir
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--
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Axel Kohlmeyer akohlmey at cmm.chem.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
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