[Wien] SCF stops here, for why?

Jorissen Kevin Kevin.Jorissen at ua.ac.be
Thu Feb 24 08:28:38 CET 2005


you don't have write permission to your scratch directory?
set $SCRATCH to a directory you have full access to, or change the permission for the current SCRATCH directory.
 
good luck,
 
 
Kevin Jorissen
 
EMAT - Electron Microscopy for Materials Science   (http://webhost.ua.ac.be/emat/)
Dept. of Physics
 
UA - Universiteit Antwerpen
Groenenborgerlaan 171
B-2020 Antwerpen
Belgium
 
tel  +32 3 2653249
fax + 32 3 2653257
e-mail kevin.jorissen at ua.ac.be
 

________________________________

Van: wien-admin at zeus.theochem.tuwien.ac.at namens Yushan Wang
Verzonden: do 24-2-2005 2:53
Aan: wien at zeus.theochem.tuwien.ac.at
Onderwerp: [Wien] SCF stops here, for why?



Dear user,
I just installed the wien2k-05, initializion is so good.
but after lapw0, scf stops for such error:

'INILPW' - can't open unit: 10
  'INILPW' -        filename: tmp/tic.vector
  'INILPW' -          status: unknown      form: unformatted
  'LAPW1' - INILPW aborted unsuccessfully.


please tell me why? thanks

yushan

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