[Wien] IBM AIX error

2013-03-20 Thread Peter Blaha
Unfortunately I do not have access to an AIX system, so cannot do anything myself. I recently compiled 12.1 on AIX (v 6.1) pwr6. Like Luis, I also had to make some changes to SRC's in order to finish the compilation. These were mostly issues with xlf like syntax. 9.2 was the most recent

[Wien] OPTIC error

2013-03-20 Thread prasenjit roy
+31 (0) 24 36 52805 -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20130320/f64784ab/attachment.htm

[Wien] OPTIC error

2013-03-20 Thread Peter Blaha
I don't know where the problem is. I never ran anything else than the test example (bcc Fe). If you send me your struct file to my private email (if necessary with some magnetic information (FM,AFM) I'm willing to look into the problem. Regards On 03/20/2013 10:34 AM, prasenjit roy wrote:

[Wien] Tr : elastic

2013-03-20 Thread Mourad Karima
Respected Prof.PBalha sir and all wien2k users how to install the program genetempl to calculate the properties? elastic - thanks -- next part -- An HTML attachment was scrubbed... URL: http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20130320

[Wien] IBM AIX error

2013-03-20 Thread Oliver Albertini
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[Wien] IBM AIX error

2013-03-20 Thread Laurence Marks
Did you run from a fresh initialization or use the old files? It could be that something went wrong before so perhaps everything is OK. Is the file uplapw2.error empty? If it is then it is something after that in lapw2para. You can edit the first line to be #!/bin/csh -vf (assuming that your csh

[Wien] IBM AIX error

2013-03-20 Thread Oliver Albertini
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[Wien] IBM AIX error

2013-03-20 Thread Oliver Albertini
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[Wien] IBM AIX error

2013-03-20 Thread Laurence Marks
Peter may have seen this before, I wonder if you have a standard csh. Try csh --version. For instance I get tcsh 6.14.00 (Astron) 2005-03-25 (x86_64-unknown-linux) options wide,nls,dl,al,kan,sm,rh,color,filec Also, check the first line of case.in1 -- is it sensible or does it have something odd