Dear Developers,
Is that necessary to consider the g0w0 database
along with the scissor operator in
the input file of "yambo -o b -k sex -y h"??
or I can use it without any g0w0 database?
Thanks
scissor operator
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scissor operator
S. Ataei, PhD student at University of Tehran, Iran.
- Daniele Varsano
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Re: scissor operator
Dear S. Ataei,
the scissor operator it is used to mimic the effect of quasiparticle correction if applies. So the QP database is not needed, otherwise you will apply QP corrections twice.
Best,
Daniele
the scissor operator it is used to mimic the effect of quasiparticle correction if applies. So the QP database is not needed, otherwise you will apply QP corrections twice.
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/
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- Posts: 165
- Joined: Tue Jan 21, 2014 9:03 am
Re: scissor operator
Dear Daniele,
Thank you
so you mean that I can run yambo -o b -k sex -y h (put the scissor value) & yambo
without doing g0w0 calculations to have a database???
Best regards
Thank you
so you mean that I can run yambo -o b -k sex -y h (put the scissor value) & yambo
without doing g0w0 calculations to have a database???
Best regards
S. Ataei, PhD student at University of Tehran, Iran.
- Daniele Varsano
- Posts: 4198
- Joined: Tue Mar 17, 2009 2:23 pm
- Contact:
Re: scissor operator
Dear Samaneh,
Yes, but usually g0w0 is used to evaluate the scissor value and verify the scissor approximation is reasonable.
Best,
Daniele
Yes, the problem the value to use as scissor.so you mean that I can run yambo -o b -k sex -y h (put the scissor value) & yambo
Code: Select all
without doing g0w0 calculations to have a database???
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/