[Wien] Minimization (pairhess) beta testers

[Laurence Marks]

No requirements, although it is for pairhess (not the PORT minimizer).
If you have already made a lot of progress with a given structure it
is probably not work using, but if you are starting from scratch if
probably would be.

On Wed, Sep 2, 2009 at 5:38 PM, Sergio Yanuen
Rodriguez<srodriguez at physics.tamu.edu> wrote:
> Dear Laurence
>
> I am doing some clathrates minimizations which takes some time, I can try
> your beta version. Is there any specific requirements like WIEN2k version?
>
> Sergio Y. Rodriguez
> Physics Department
> Texas A&M University
>
>> I am looking for some beta testers for a slightly different form of
>> pairhess; should be faster for minimization. Any volunteers?
>>
>> --
>> Laurence Marks
>> Department of Materials Science and Engineering
>> MSE Rm 2036 Cook Hall
>> 2220 N Campus Drive
>> Northwestern University
>> Evanston, IL 60208, USA
>> Tel: (847) 491-3996 Fax: (847) 491-7820
>> email: L-marks at northwestern dot edu
>> Web: www.numis.northwestern.edu
>> Chair, Commission on Electron Crystallography of IUCR
>> www.numis.northwestern.edu/
>> Electron crystallography is the branch of science that uses electron
>> scattering to study the structure of matter.
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>>
>>
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
>



-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
Web: www.numis.northwestern.edu
Chair, Commission on Electron Crystallography of IUCR
www.numis.northwestern.edu/
Electron crystallography is the branch of science that uses electron
scattering to study the structure of matter.