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some difference in r_setup when I use the 5.0
Posted: Thu May 05, 2022 8:18 am
by Quxiao
Dear Daniele :
When I want to know the IBZ kpoints,I find there only have 50 kpoints,and print the "Remaining 224 points informations can be written running with -fatlog".
So what should I do to solve that?please give me some help!
Best wishes
QX
Re: some difference in r_setup when I use the 5.0
Posted: Thu May 05, 2022 8:47 am
by Daniele Varsano
Dear Quixao,
just append -fatlog when running yambo:
Best,
Daniele
Re: some difference in r_setup when I use the 5.0
Posted: Sun Jun 12, 2022 3:04 pm
by Quxiao
Dear Danieleļ¼
I did that with your help and got other hidden points
However,I have other question.In 5.0,I could not find the weight of the Transferred momenta grid.I need that value to analyse something.
Please give me some advice!
Thanks for your help!
Best wishes !
Quxiao
Re: some difference in r_setup when I use the 5.0
Posted: Mon Jun 13, 2022 7:49 am
by Daniele Varsano
Dear Quxiao,
you can use the ypp utility.
to generate ypp input file:
uncomment ListPts
and run ypp.
You will have in the standard output the q-point list with weights.
Best,
Daniele
Re: some difference in r_setup when I use the 5.0
Posted: Sun Jun 19, 2022 2:10 pm
by Quxiao
Dear Daniele:
Thanks for your reply!I have got it with your help.
Best wishes
Quxiao
BIT