Dear Developers,
When I execute the "yambo" command after successfully creating the SAVE folder, I got the following warning:
"Set Gthresh>1.E-5 in input to avoid this"
What should I do about this?
Best regards,
Zafer
Warning "Set Gthresh>1.E-5 in input to avoid this"
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Warning "Set Gthresh>1.E-5 in input to avoid this"
Dr. Zafer Kandemir
Postdoctoral Researcher
Department of Mechatranics Engineering, Sabanci University
Istanbul, Turkey
Postdoctoral Researcher
Department of Mechatranics Engineering, Sabanci University
Istanbul, Turkey
- Daniele Varsano
- Posts: 3828
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Re: Warning "Set Gthresh>1.E-5 in input to avoid this"
Dear Zafer,
yambo orders the G vectors in shells, if open shells are found the max number of gvectors is reduced. You can define a threshold for the g vecotrs packing.
You can avoid this by defining the threshold in input using the variable Gthresh. In any case, this warning should be harmless.
Best,
Daniele
yambo orders the G vectors in shells, if open shells are found the max number of gvectors is reduced. You can define a threshold for the g vecotrs packing.
You can avoid this by defining the threshold in input using the variable Gthresh. In any case, this warning should be harmless.
Best,
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/