[Wien] lapw2c problem

Stefaan Cottenier Stefaan.Cottenier at UGent.be
Tue Jan 20 10:30:53 CET 2009


>  Thanks a lot for your response. But As I am very much new to wien2k I 
> am unable to get the meaning of SCRATCH variable. Kindly tell me how to 
> check them.

On the command line: echo $SCRATCH

if needed, it can be changed in your ~/.cshrc or ~/.bashrc file

Stefaan



Mohit wrote:
 > Stefaan Cottenier wrote:
 >> Your file name /NBW.vector is at the top of your file system, which is
 >> probably not what you want. Check your SCRATCH variable, it might have
 >> been set to / rather than to ./
 >>
 >> Stefaan
 >>
 >>
 >>
 >>
 >>>  I am facing one problem while running x lapw2 -c, It gave the 
following error.
 >>>
 >>> error: command /home/mohit/WIEN2k82/lapw2c lapw2.def failed
 >>>
 >>>
 >>>
 >>> When I check lapw2.error file , It shows following error
 >>>
 >>>
 >>>
 >>> 'LAPW2'  - can't open unit: 10
 >>>
 >>> 'LAPW2' - file name :/NBW.vector
 >>>
 >>> 'LAPW2' - status : unknown  form;  unformatted
 >>>
 >>>
 >>>
 >>> and when I check NBW.vector file it seems full of strange 
characters like (
 >>> h@^@^<9a><99>..etc...) seems an formatted file open in wrong format.
 >>>
 >>> Kindly help me, what is causing this problem.......
 >>>
 >>> Others like x lapw1 or lapw2 are running well only problem in 
running x lapw2 -
 >>> c.
 >>> Looking forward for your valuable responses.
 >>>
 >>> Mohit Tyagi
 >>>
 >>> -------------------------------------------------
 >>>
 >>> _______________________________________________
 >>> Wien mailing list
 >>> Wien at zeus.theochem.tuwien.ac.at
 >>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
 >>>
 >>
 >>
 >>


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