Firefly and PC GAMESS-related discussion club


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



Re^3: Queuing SCript for Firefly on Linux

Alex Granovsky
gran@classic.chem.msu.su


Dear Peter,

with current versions of Firefly you need to use absolute paths.
There is a fix for this in current beta version of FF 8.0.0

You may find the list of command line options here:

http://classic.chem.msu.su/gran/gamess/comm_line.html

Best regards,
Alex


On Sat Nov 12 '11 10:55am, Peter Jarowski wrote
-----------------------------------------------
>Yes please, the PBS script would do.

>Also, I cant seem to run firefly outside of its directory where the executable is. Do you have path lists and ENVs to suggests to fix this.
>
>
>Best Regards,
>
>
>Peter
>
>
>On Sat Nov 12 '11 10:36am, Alex Granovsky wrote
>-----------------------------------------------
>>Hi Peter,

>>To avoid PUNCH file conflicts, use -p -stdext command line options.

>>If you need sample scripts for PBS or SLURM, I can attach some to this thread.

>>Regards,
>>Alex Granovsky

>>On Sat Nov 12 '11 0:04am, Peter Jarowski wrote
>>----------------------------------------------
>>>Dear Users:

>>>Anyone have a working queuing script for Firefly running on linux with parallelization. For instance for qsub of some equivalent. Right now I have the problem that the PUNCH file can not be shared between different simultaneous runs. Any work around for that?

>>>Thanks,

>>>Peter


[ Previous ] [ Next ] [ Index ]           Tue Nov 15 '11 2:15pm
[ Reply ] [ Edit ] [ Delete ]           This message read 571 times