Unknown VASP Error before entering SCF loop

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burakgurlek
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Unknown VASP Error before entering SCF loop

#1 Post by burakgurlek » Mon Jun 30, 2025 3:55 pm

Hi,

I am simulating a rather small system with very demanding settings. I got 125 exit error from Slurm as you can see in the attachment. I tried to play with different parallelization schemas and reduced number of bands etc. but could not run more than 6min. It is likely that the memory is the issue but reducing the number of bands did not alleviate the problem.

Files.7z

I would appreciate the help

Regards,
Burak

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