[molpro-user] issue with Molpro 2010.1 (patch 2): ABDATA missing

[Manhui Wang]

Dear Stefan,

The possible reason is that your Intel MPI mpd daemon happened not to
run in the background when you built the library data.
You can fix it by rebuilding the library data (not compiling the whole
code):

make -C lib veryclean
make

But ensure your mpd is running in the background before doing this.


Best wishes,
Manhui


Stefan Becuwe wrote:
> Hello,
> 
> I compiled/installed Molpro 2010.1 in the same way as 2009.1: GA 4.3.2, 
> TCGMSG-MPI, Intel compilers and Intel MPI.  Running the tests as follows
> 
>    make MOLPRO_OPTIONS=-n8 test
> 
> results in
> 
> openc: Error in opening file [...]/molpro2010.1/testjobs/../lib/ABDATA
> 
>   GLOBAL ERROR fehler on processor   0
> make[1]: *** Deleting file `Cs_DKH10.out'
> make: *** [test] Interrupt
> 
> It seems ABDATA is missing (is present in 2009.1).  Any idea how to fix 
> this problem?  Thanks in advance!
> 
> Regards,
> 
> 
> Stefan
> 
> 
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-- 
-----------
Manhui  Wang
School of Chemistry, Cardiff University,
Main Building, Park Place,
Cardiff CF10 3AT, UK
Telephone: +44 (0)29208 76637