[Wien] WIEN2k bug report (SRC_lapwso/atpar.f)

2013-01-30 Thread Peter Blaha
Dear Dr. Koichi, Thank you very much for your report. I can confirm that your findings and suggestion is correct. So far, we used ALWAYS the APW/LAPW setting of the first atom and l=0. However, I guess in practically ALL cases, the default input case.in1 would have worked correctly. Problems

[Wien] wien2k hi

2013-01-30 Thread Hajar Nejati
check it out http://bit.ly/Vplaoz Hajar -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20130130/8e50be3b/attachment.htm

[Wien] hi

2013-01-30 Thread Saba Sabeti
check this page out http://msn.nbcnews.com-im7.net/finance/ Saba -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20130130/8ba082c4/attachment.htm