[molpro-user] Problem in compilation of molpro2010 with GA

Evgeniy Gromov Evgeniy.Gromov at pci.uni-heidelberg.de
Mon Apr 4 13:30:27 BST 2011

Dear Molpro Community,

I am trying to compile molpro2010.1 with GA, the latest version
ga-5.0.2. During the molpro compilationI get the error:

make[3]: Entering directory 
compiling ppidd_c.c
ppidd_c.c(48): catastrophic error: could not open source file "tcgmsg.h"
         #include <tcgmsg.h>

Either molpro needs this tcgmsg.h in any case and then I should
recompile GA with MPI+tcgmsg (by default GA is compiled only with
MPI) or there is an option (which I don't know) for molpro
configure to switch tcgmsg off and use only MPI. The question is
what of the above variants the right one. Could somebody help, please.

Best regards,

Dr. Evgeniy Gromov
Theoretische Chemie
Physikalisch-Chemisches Institut
Im Neuenheimer Feld 229
D-69120 Heidelberg

Telefon: +49/(0)6221/545263
Fax: +49/(0)6221/545221
E-mail: evgeniy at pci.uni-heidelberg.de

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