Dear developers,
I am trying to run BSE calculation but it fails without error. You can find my files from link below.
https://drive.google.com/file/d/1v_TKlO ... sp=sharing
Regards,
BSE fail
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BSE fail
Burak Ozdemir
Post-doc,
University of Modena and Reggio Emilia, Italy
Post-doc,
University of Modena and Reggio Emilia, Italy
- Daniele Varsano
- Posts: 4209
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Re: BSE fail
Dear Burak,
you have a very small excitonic matrix (dim=288) and you are using 64cpu without specifying the parallel strategy.
Yambo turns out the default as reported in the LOG:
My suggestion is to use a fewer number of cpu and specify explicitly the parallel strategy, something like with 8 cpu:
Best,
Daniele
you have a very small excitonic matrix (dim=288) and you are using 64cpu without specifying the parallel strategy.
Yambo turns out the default as reported in the LOG:
Code: Select all
Response_T_space parallel ENVIRONMENT is incomplete. Switching to defaults
Code: Select all
BS_CPU= "8 1 1" # [PARALLEL] CPUs for each role
BS_ROLEs= "k eh t"
Daniele
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/