[Pw_forum] converting pseudopotential
mohaddeseh abbasnejad
m.abbasnejad at gmail.com
Mon Feb 2 11:59:14 CET 2009
Dear all,
Although I attempted so much to compile and run casino2upf.x, I couldn't
find it.
Would you please help me?
Thanks in advance.
Yours,
Mohaddeseh
On Wed, Jan 28, 2009 at 4:24 PM, Lorenzo Paulatto <paulatto at sissa.it> wrote:
> On Wed, 28 Jan 2009 13:33:06 +0100, mohaddeseh abbasnejad <
> m.abbasnejad at gmail.com> wrote:
> > I have found that there is a utility in PWscf
> > [...]
> > But I couldn't find it.
>
> Well, have you found it or not? ;-)
> In either case it is in upftools/; just eneter the directory and type "make
> all".
>
> > Would you please tell me how I can use it?
>
> One you have compiled it you can run it from upftools/ like ./casino2upf.x
> it'll ask you to provide the name of casino file (for input) and of the UPF
> file (for output).
>
> cheers
>
> --
> Lorenzo Paulatto
> SISSA & DEMOCRITOS (Trieste)
> phone: +39 040 3787 511
> skype: paulatz
> www: http://people.sissa.it/~paulatto/<http://people.sissa.it/%7Epaulatto/>
>
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--
--------------------------------------------------------------------------------
Mohaddeseh Abbasnejad,
Room No. 323, Department of Physics,
University of Tehran, End of North Karegar Ave.,
Tehran, P.O. Box: 14395-547- IRAN
Tel. No.: +98 21 6111 8634 & Fax No.: +98 21 8800 4781
E-Mail: m.abbasnejad at gmail.com
Website: http://physics.ut.ac.ir
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