[molpro-user] molpro2010.1 installation in openSUSE 10.3

[Patricia Barreto]

Thanks for the reply, but the problem is I don´t have the intel fortran, 
ifort, installed in my machine, the only fortran compiler I have is the 
g95 that I installed before I installed the molpro. I can´t understand 
why molpro is looking for ifort instead of g95.

Patricia

Em 9/11/2010 05:51, Konstantin Tokarev escreveu:
>
> 09.11.2010, 00:40, "Patricia RP Barreto"<patricia at plasma.inpe.br>:
>> Dear all,
>>
>> 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
>> fortran compiler.
>>
>> 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?
> Why do you need g95 when you already have ifort? Just use it!
>