Hello Shamim,
Thanks for pointing out the issue. I'll check with HPC admins to fix the Intel-17 or install a better version. Could you please help me with the issue regarding running BNSM on more than 1 node? The issue is explained in my previous email in reply to your suggestions on problems divided into Part A, B and C.
That is unfortunately quite tricky to do. Each cluster handles this a bit differently. My best suggestion is to first look for an example of a hybrid job (MPI+OpenMP) that the cluster admins hopefully provide.
Next you must construct a submitscript (template) that matches their example (more or less).
You can try these out by submitting test jobs and looking at the file:
<basedir>/<jobname>/output-0000/SIMFACTORY/SubmitScript
which has all the replacements done.
For testing you may want to set the "submit" option in the machine ini file to just "echo 42" or so so that no actual job is submitted.
I will be, unfortunately, quite busy until after the ET release (this week) and most likely also next week, so cannot really promise to be able look into this very deeply.
My best suggestion is to track down an OpenMP+MPI example in the cluster documentation and then tweak your SubmitScript (foo.sub) file until you have something that, when provided the correct options, matches their example.
The error that you received basically says that your submitscript asked for more resources than available, but this can be triggered by a number of things including configuration options set by the admins.
Yours, Roland