[molpro-user] issue with Molpro 2010.1 (patch 2): ABDATA missing
wangm9 at cardiff.ac.uk
Wed Sep 22 09:21:21 BST 2010
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
make -C lib veryclean
But ensure your mpd is running in the background before doing this.
Stefan Becuwe wrote:
> 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: *** 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!
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