[Wien] case.vectorso (up/dn)

Konstantin Nefedev nefedev at gate.sinica.edu.tw
Wed Jun 20 16:32:30 CEST 2007


Dear Stefaan,

thank you for reply,

$SCRATCH has not been defined in my system and

in *lapw1.def I can see such information:

10,'./case.vectorup', 'unknown','unformatted',9000

What does it mean?

Konstantin.



>* I have finished scf cycle  spinpolarazed complex (without inversion)
Pnma
*>* structure with spinorbit calculation, and have been surprized  by
absence
*>* both of case.vectorsoup (dn) and case.vectorup (dn). SCF finished
without
*>* any erors.
*>*
*>* What is possible reason of this absence?
*
>Do :

>ls -l $SCRATCH/*vector*
>
>and you should see them -- vector files are put in your scratch
>directory, not in your working directory where you probably looked. If
>$SCRATCH would not be defined on your system, look in *lapw1.def for
>the explicit path to file nr. 10.

>Stefaan
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