Dear developers:
I am a new learner of yambo.
I find some examples about TDDFT(0D_H2 1D_Si_wire 2D_Si_surface 3D_LiF).
I want to perform band structure calculation based on GW, but I failed to get example in homepage of Yambo.
Is there examples about band structure calculation with GW?
Thank you very much;P
Is there examples about band structure?
Moderators: myrta gruning, andrea marini, Daniele Varsano, Conor Hogan
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- myrta gruning
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Re: Is there examples about band structure?
Dear Hui Wang
thank you for using Yambo.
You can refer to the general documentation about the plasmon-pole GW runlevel (invoked with yambo -p p -g n) to the relative online documentation and of course to the yambo paper. You can also download the auxiliary material relative to a converged GW/BSE calculation on bulk Si.
You may as well find some interesting posts on this forum, e.g. this and this, and in general under "running yambo=> self energy".
I hope this can help you,
m
thank you for using Yambo.
For the GW part, there is (still) no such a document as for the TDDFT part.Is there examples about band structure calculation with GW?
You can refer to the general documentation about the plasmon-pole GW runlevel (invoked with yambo -p p -g n) to the relative online documentation and of course to the yambo paper. You can also download the auxiliary material relative to a converged GW/BSE calculation on bulk Si.
You may as well find some interesting posts on this forum, e.g. this and this, and in general under "running yambo=> self energy".
I hope this can help you,
m
Dr Myrta Grüning
School of Mathematics and Physics
Queen's University Belfast - Northern Ireland
http://www.researcherid.com/rid/B-1515-2009
School of Mathematics and Physics
Queen's University Belfast - Northern Ireland
http://www.researcherid.com/rid/B-1515-2009
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- Posts: 11
- Joined: Wed Jul 22, 2009 6:12 am
Re: Is there examples about band structure?
Dear Dr Myrta Grüning:
Thank you very much for you instruction
I will follow you suggestion to get promote my calculaiton.
By the way, at the end of References [37] in the paper "yambo: An ab initio tool for excited state calculations", the wedsite[http://www.yambo-code.org/publications.html] is given.
However, I think the corect website should be [http://www.yambo-code.org/publications.php]
Once again, thank you for
Thank you very much for you instruction
I will follow you suggestion to get promote my calculaiton.
By the way, at the end of References [37] in the paper "yambo: An ab initio tool for excited state calculations", the wedsite[http://www.yambo-code.org/publications.html] is given.
However, I think the corect website should be [http://www.yambo-code.org/publications.php]
Once again, thank you for