Dear Haichang Lu,
after you run ypp to remove the time reversal symmetry you need to enter the folder which contains the SAVE without time reversal (cd FixSymm)
Best,
D.
Bands interpolation does not work with T-rev symmetry
Moderators: Davide Sangalli, andrea marini, Daniele Varsano
- Davide Sangalli
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Re: Bands interpolation does not work with T-rev symmetry
Davide Sangalli, PhD
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/
- Daniele Varsano
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Re: Bands interpolation does not work with T-rev symmetry
Dear Haichang Lu,
please sign your post with yout complete affiliation. This is a rule of the forum. You can do it once for all by filling your signature in your profile.
The link you provided seems me to work.
Let me add to Davide comments, once in the FixSymm directory you need to perform the setup again (yambo -i) yambo.
Best,
Daniele
please sign your post with yout complete affiliation. This is a rule of the forum. You can do it once for all by filling your signature in your profile.
The link you provided seems me to work.
Let me add to Davide comments, once in the FixSymm directory you need to perform the setup again (yambo -i) yambo.
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/