[Wien] Minimization (pairhess) beta testers

Sergio Yanuen Rodriguez srodriguez at physics.tamu.edu
Thu Sep 3 00:38:57 CEST 2009


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.
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> Wien at zeus.theochem.tuwien.ac.at
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>
>




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