[molpro-user] molpro licence for serial version fails

Reuti reuti at staff.uni-marburg.de
Tue Dec 18 15:50:05 GMT 2007


Am 18.12.2007 um 16:05 schrieb SLIM H.A.:

> We have both a serial and mpp licence for molpro here.
> When I try to build the serial version it fails because the licence  
> key
> for the mpp version is downloaded?Although the mpp switch is not  
> set in
> the CONFIG file (MPP="0") it seems the configure command assumes it
> actual should build something non-serial because it cannot resolve  
> calls
> to the GA library:
> /data/hamilton/dcl0hpc/molpro/molpro2002.6/lib/libmolpro.a(mpputil.o):
> In function `mpp_open_':
> mpputil.f:(.text+0x47): undefined reference to `pbeginf_'
> mpputil.f:(.text+0x4c): undefined reference to `ga_initialize_'

did you compile GA with mpi or tcgmsg-mpi? It must be the latter one  
to compile Molpro (with pure MPI the calls to GA are different).

-- Reuti

> and so on.
> Do the authours or anyone else have any idea what should be done to
> solve this problem?
> Thanks for any help
> Henk
> Dr. H.A. Slim
> IT Consultant, Scientific and High Performance Computing
> IT Service, Durham University, UK
> e-mail: h.a.slim at durham.ac.uk
> Tel.: 0191 - 334 2724
> FAX: 0191 - 3342701

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