[Pw_forum] a request

2011-09-23 Thread Mehrnoosh Hazrati
""""""""""""""""""""""""""""""* Mehrnoosh Kh. Hazrati Master Student of Computational Physical Chemistry,KNTU,Tehran *** Phone : +989123436300 *** *** Mail : mehrnooshhazrati at gmail.com *** *"""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""""* -- next part -- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110923/7c8de68c/attachment.htm

[Pw_forum] Xe pseudopotentials

2011-09-23 Thread lucking-pine
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[Pw_forum] Does VCA method give positive formation energy?

2011-09-23 Thread GAO Zhe
l, S.Korea -- next part -- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110923/b7d640da/attachment.htm

[Pw_forum] LDOS on parallel planes

2011-09-23 Thread pari shok
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[Pw_forum] LDA norm-conserving pseudopotential for Fe

2011-09-23 Thread he...@fh.huji.ac.il
Thanks so much for your help. I'll try some of these possibilities. > so YOU are from FHI, you should know what is inside those files... I'm from the Fritz-Haber Center for Molecular Research at the Hebrew Universitynot the same Fritz Haber Institute :) Helen -

[Pw_forum] band structure calculation

2011-09-23 Thread mike at.
al science group Chepkoilel university college, Department of Physics, Eldoret, Kenya, -- next part -- An HTML attachment was scrubbed... URL: http://www.democritos.it/pipermail/pw_forum/attachments/20110923/3d776daf/attachment.htm