Dear all,
I have performed the BSE calculation by using the GW band structure(set KfnQPdb).In this case, can I use different K points for BSE and GW calculation ?
Waiting for your replay. Thank you.
Perform the BSE calculation by using the GW band structure
Moderators: myrta gruning, andrea marini, Daniele Varsano, Conor Hogan
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Perform the BSE calculation by using the GW band structure
yifei liu
PhD student
Beijing Institute of Technology,China
PhD student
Beijing Institute of Technology,China
- myrta gruning
- Posts: 242
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Re: Perform the BSE calculation by using the GW band structure
Yes. Check:
http://www.yambo-code.org/wiki/index.ph ... n_eh-space
http://www.yambo-code.org/wiki/index.ph ... n_eh-space
Missing values will be calculated by interpolationKfnQPdb (Units: None, Format: String) Verbosity: -V qp
Meaning: Database for QP corrections.
Usage: From a previous GW calculation. An interpolation of the missing QP-values on the basis of the QP-database is available See also: KfnQP_E
Format: "<what> < <path>/ndb.QP" with <what> = E,W,Z for QP energy correction, QP width and renormalization factor. For example, from a previous GW calculation use KfnQPdb= "E < ./SAVE/ndb.QP"
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