[molpro-user] molpro2010.1 installation in openSUSE 10.3
Patricia RP Barreto
patricia at plasma.inpe.br
Mon Nov 8 21:40:22 GMT 2010
I am new at molpro, just got my license, and not so good with the
operation system, sorry about that.
I am trying to install the molpro for few days by now without success. I
have a 64bit machine with openSUSE 10.3, I have installed the g95,
without problem, but I can´t configure the molpro´s directories and
1. I opened the script, for serial installation, tried to define the
directories, then opened the script generated after installation, but
when I try to run molpro it doesn´t work, why?
When I try to run I got
Primary working directories : /tmp/patricia
Secondary working directories : /tmp/patricia
Wavefunction directory : /home/patricia/wfu/
Main file repository : /tmp/patricia/
but I want:
Primary working directories : /home/scratch/smolpro1
Secondary working directories : /home/scratch/smolpro2
Wavefunction directory : /home/scratch/wfu/
Main file repository : /home
The /home/scratch directory is a 500gb hard disk only for scratch files
and all the others files and directories are in another smaller hard
disk, that is why I want the working directories at /home/scratch, so
where do I set theses directories?
2. I installed the g95, set it in my .profile, but molpro is looking for
another fortran compiler, that I don´t have, instead of g95
FC : /opt/intel/Compiler/11.1/073/bin/intel64/ifort
Can somebody help me?
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