[Wien] Problem in Gap value??(semiconductor not mettalic)

[Martin Kroeker]

@Gerhard: I must say I have seen much worse here on this mailing list, and I
suspect Sunday may be a perfectly regular workday for her.

That said, there is something strange with this calculation, as people
more knowledgeable than me already noted. Did you change something
fundamental between calculations, or might two different jobs have
run in the same work directory ? It might help to see your case.in1
and/or case.struct as well.
-- 
Dr. Martin Kroeker            martin at ruby.chemie.uni-freiburg.de
c/o Prof.Dr. Caroline Roehr
Institut fuer Anorganische und Analytische Chemie der Universitaet Freiburg