[Pw_forum] too many test configurations

Hande Ustunel ustunel at sissa.it
Thu Nov 24 17:19:54 CET 2005


Dear list members,

I was wondering if there's anyone who could tell me why in the
pseudopotential generation code, if iswitch=3 -- that is to say when I want
to run an ae calculation, generate and test the pseudopotential all at the
same time -- only one test configuration is allowed for each run.

Here's the segment of code in .../atomic/ld1_readin.f90 that seems to do
it:

"
if (iswitch == 3 .and. nconf > 1) &
       call errore('ld1_readin','too many test configurations',1)
"

I appreciate your help.
Best wishes,
Hande



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