[Molpro-user] How I should run the new 2008.1 version

[Kirk Peterson]

Dear Attila,

can you ssh to your compute nodes without a password?

regards,

Kirk

On Oct 1, 2008, at 2:03 AM, Attila Bende wrote:

> Dear Molpro users!
>
> Can anyone help me, why I got the following message when I try to run
> Molpro 200.1 version.
> I simply installed the sh script and everything was fine, the program
> found my token file. Wonderful
> But when I try to run, I got this message:
> _______
> aragon07 > molpro -d /scratch -I /scratch -n 2 <PTZ-norm-3-SH_01a.com
> tmp = /home/abende/pdir//usr/local/bin/ 
> molprop_2008_1_Linux_x86_64_i8.exe.p
> Creating: host=aragon07.itim-cj.ro, user=abende,
>           file=/usr/local/bin/molprop_2008_1_Linux_x86_64_i8.exe,  
> port=55464
> aragon07.itim-cj.ro: Connection refused
>  2: interrupt(1)
> aragon07 >
> _________________
>
> I also tried with mpiexec but the same error:
> _____
> /home/abende> mpiexec -n 2 /usr/local/bin/molpro -d /scratch -I
> /scratch < PTZ-norm-3-SH_01a.com
> aragon01.ls3119.itim-cj.ro: Connection refused
> tmp = /home/abende/pdir//usr/local/bin/ 
> molprop_2008_1_Linux_x86_64_i8.exe.p
> Creating: host=ls3119.itim-cj.ro, user=abende,
>           file=/usr/local/bin/molprop_2008_1_Linux_x86_64_i8.exe,  
> port=57000
>  1: interrupt(1)
> aragon01.ls3119.itim-cj.ro: Connection refused
>  1: interrupt(1)
> tmp = /home/abende/pdir//usr/local/bin/ 
> molprop_2008_1_Linux_x86_64_i8.exe.p
> Creating: host=ls3119.itim-cj.ro, user=abende,
>           file=/usr/local/bin/molprop_2008_1_Linux_x86_64_i8.exe,  
> port=51631
> /home/abende>
> __________________________
>
> I try to check the tmp link but I couldn't find any
> molprop_2008_1_Linux_x86_64_i8.exe.p file, only the file without ".p"
> is present.
> I would appreciate if somebody could indicate what I'm wrong with the
> program running
>
> Many thanks
> Attila
>
> -- 
> Dr. Bende Attila (PhD)
> Senior Researcher III
>
> ***********************************************************************
> National Institute of R&D of Isotopic and Molecular Technology
> Str. Donath nr.71-103, C.P.700
> Cluj-Napoca, R-400293, Romania
> Phone:+40-264-584037, ext. 216, Fax: +40-264-420042
> e-mail: bende at itim-cj.ro, attlbende at yahoo.co.uk
> Web: http://www.itim-cj.ro/~bende/index.html
>         http://www.researcherid.com/rid/A-6539-2008
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