If you have problems during the execution of MRCC, please attach the output with an adequate description of your case as well as the followings:
  • the way mrcc was invoked
  • the way build.mrcc was invoked
  • the output of build.mrcc
  • compiler version (for example: ifort -V, gfortran -v)
  • blas/lapack versions
  • as well as gcc and glibc versions

This information really helps us during troubleshooting :)

binary 25.1.3 MPI fails executing xmrcc

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1 month 2 weeks ago - 1 month 2 weeks ago #1611 by koput
Dear developers,

I am trying to run the binary 25.1.3 MPI version of MRCC under SLURM. It runs smoothly till the xmrcc step and dies at its very beginning:
Memory requirements /Mbyte/:
              Minimal        Optimal
Real*8:         17.7763        28.6292
Integer:         6.4582
Total:          24.2344        35.0873

The log file says:
+ mpirun -np 1 /mnt/storage_3/home/koput//pl0487-01/project_data/mrcc_b/dmrcc_mpi
[LOG_CAT_MCAST] Failed to setup rcache
[LOG_CAT_MCAST] MCAST: Error initializing vmc context
[LOG_CAT_ML] Failure in hcoll_mcast_base_select
[LOG_CAT_MCAST] Failed to setup rcache
[LOG_CAT_MCAST] MCAST: Error initializing vmc context
[LOG_CAT_ML] Failure in hcoll_mcast_base_select
[LOG_CAT_MCAST] Failed to setup rcache
[LOG_CAT_MCAST] MCAST: Error initializing vmc context
[LOG_CAT_ML] Failure in hcoll_mcast_base_select
[LOG_CAT_MCAST] Failed to setup rcache
[LOG_CAT_MCAST] MCAST: Error initializing vmc context
[LOG_CAT_ML] Failure in hcoll_mcast_base_select
[LOG_CAT_MCAST] Failed to setup rcache
[LOG_CAT_MCAST] MCAST: Error initializing vmc context
[LOG_CAT_ML] Failure in hcoll_mcast_base_select

The output and log files are attached. I would greatly appreciate any hint.

Kind regards,
Jacek

You are not authorised to see this attachment.

PS. Attached please find new output and log files.

File Attachment:

File Name: iqmpib2_ed.sys.txt
File Size:23 KB

File Attachment:

File Name: iqmpib2_ed.out.txt
File Size:35 KB

 
Last edit: 1 month 2 weeks ago by koput. Reason: new out and log files

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  • nagypeter
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1 month 1 week ago #1616 by nagypeter
Replied by nagypeter on topic binary 25.1.3 MPI fails executing xmrcc
Dear Jacek,

could you please check using the Intel MPI 2021.10 library version? At least assuming you are using the precompiled binary version, which is linked to Intel MPI 2021.10. We notice that you have an older version in your environment.

I hope it helps.
Best regards,
Peter and Laszlo

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1 month 1 week ago - 1 month 1 week ago #1617 by koput
Replied by koput on topic binary 25.1.3 MPI fails executing xmrcc
Dear Peter and Laszlo,

yes, it helped. Thanks!
I have loaded the newer Intel MPI version 2021.14, and the job (int/scf/mrcc) ran smoothly.

Kind regards,
Jacek
Last edit: 1 month 1 week ago by koput.

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