Firefly and PC GAMESS-related discussion club


 
Learn how to ask questions correctly  
 
 
We are NATO-free zone
 



Re^9: Firefly-8.0.1 is not running on system with Intel MPI-4.1.X...

Pavlo Solntsev
pavlo.solntsev@gmail.com


Your script doesn't correspond to PBS script. I made some changes to qff2 script to make it more restrict and precise. What you need to do is to run:
$ qff2 -s # generate a new ~/.firefly.con file
$ qff2 -r yes inputfile.inp

Let me know how it works.

Pavlo.




On Mon Mar 24 '14 9:11am, Siddheshwar Chopra wrote
--------------------------------------------------
>Dear Sir,
>I made the i/p file and o/p file path changes as pointed out by you.. And got the .e file as o/p. Please find attached the "Inputscript.pbs" and "New Error.e" files for your reference. The exact command for running FF is mentioned in the Inputscript.pbs file.
>Now coming to your question about step by step process::
>1) Ran qff2 and obtained firefly.conf.
>2) Now ran "qff2 inputfile" to obtained "Inputscript.pbs".
>3) Ran "qsub Inputscript.pbs" from the PBS_O_WORKDIR path.
>4) This gave me the ".e" and ".o" files.
>However the program terminated very soon, without producing any .out file. I am unable to track these errors.

>Please help Sir.

>Regards,

>O

This message contains the 13 kb attachment
[ qff2_2 ] FF running script


[ Previous ] [ Next ] [ Index ]           Mon Mar 24 '14 6:34pm
[ Reply ] [ Edit ] [ Delete ]           This message read 656 times