Questions tagged [job-scheduler]

Topic concerning job scheduling and queue management software on high-performance clusters.

Filter by
Sorted by
Tagged with
2 votes
0 answers
42 views

Error with running GROMACS with SLURM

I am running into errors while submitting a job for a basic MD Simulation with HPC on SLURM. My sbatch script reads as follows: ...
Pranoy Ray's user avatar
  • 1,631
5 votes
1 answer
612 views

Running multinode parallel Orca calculation without a work load manager (scheduler)

I wonder, if someone has run (runs) parallel Orca calculations on at least two nodes without a work load manager (scheduler)? I am asking because I have several interconnected servers (nodes) I'd like ...
EvGeniy's user avatar
  • 371
12 votes
3 answers
2k views

How can I submit jobs to an HPC scheduler?

It is my first time trying to use an HPC system and I am a bit overwhelmed. I have gone through a course on using HPC systems on Coursera and have a basic idea about using Linux. Could you guys tell ...
Parmeet Singh EP 066's user avatar
11 votes
1 answer
122 views

Which schedulers are compatible with a virtual machine?

I have an old TORQUE cluster (out of support) with 4 nodes running on Cent OS 6 and I am having trouble using the latest versions of Matter Modelling software. I recently came across Quantum Mobile ...
Thomas's user avatar
  • 9,072
16 votes
3 answers
1k views

Job scheduler alternatives

The power of computation required to perform a DFT calculation increases with the size of the system. Therefore, for some systems, is mandatory to use high-performance-computers, clusters, and grids. ...
Anibal Bezerra's user avatar