Hi It is ofcurse a mistake it is installed on Linux Victor 2012/8/12 Jameson Maibam <j.maibam_official at yahoo.com>
> Dear sir, using wien2k in windows xp might be reported earlier, but to me > this is the first time. How did you install? Would you please let me know > all the steps you have done? > Yours sincerely > Jameson Maibam > > *From:* Viktor Zano <zanov at post.bgu.ac.il> > *To:* Wien2k mailing list <wien at zeus.theochem.tuwien.ac.at> > *Sent:* Sunday, 12 August 2012 2:54 PM > *Subject:* [Wien] configure input file for TETRA > > Dear Wien2k users > I'm using Wien2k_10.1 on windows XP. > I trying to re-calculate DOS for a structure and it seems that the > "configure *.int" button doesn't work, meaning that I can't have a command > line to choose the right DOS-cases (orbitals). In fact I got a message > "configure_int needs input". > I tried to recalculate DOS of other structures and of a simple structure > (TiC) and got the same note. > Of course I can edit it manually (which works fine), but I do not know all > the codes (for example "1" "1" stand for "1st atom" " S orbital"). Where > can I get a full list of the orbitals (I mainly look for different f > orbitals in cubic system). I didn't find it in the useguide! > How can I fix that "configure *.int" button ? > Thanks > > > _______________________________________________ > 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 > > -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120812/84a6ba27/attachment.htm>