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Warning "Set Gthresh>1.E-5 in input to avoid this"

Posted: Fri Jun 17, 2022 4:42 pm
by Zafer Kandemir
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

Re: Warning "Set Gthresh>1.E-5 in input to avoid this"

Posted: Mon Jun 20, 2022 7:53 am
by Daniele Varsano
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