Dear all,
i was doing shg calculation for MoS2 monolayer , same as in the tutorial of hBN shg calculation tutorial , i'm getting this following error during polarization step *[ERROR] STOP signal received while in[04] Dipoles
[ERROR] LINEAR ALGEBRA driver [GETRF (SI)]WS%v_cmplxspace failed*
I'm new to yambo please guide me through it . i have attached DFT inputs and YAMBO input.
Thanking you
Sohan
algebra driver error
Moderators: Davide Sangalli, claudio, myrta gruning
-
- Posts: 27
- Joined: Thu Nov 14, 2024 1:10 pm
algebra driver error
You do not have the required permissions to view the files attached to this post.
Sohan
M.Sc. (Physics)
Central University of Punjab, India
M.Sc. (Physics)
Central University of Punjab, India
- claudio
- Posts: 526
- Joined: Tue Mar 31, 2009 11:33 pm
- Location: Marseille
- Contact:
Re: algebra driver error
Dear Sohan
I don´t know why you get this error, may you put in the forum also
the Yambo input file, and the report r_setup and r_nonlinear
so we can understand where is the problem
best
Claudio
I don´t know why you get this error, may you put in the forum also
the Yambo input file, and the report r_setup and r_nonlinear
so we can understand where is the problem
best
Claudio
Claudio Attaccalite
[CNRS/ Aix-Marseille Université/ CINaM laborarory / TSN department
Campus de Luminy – Case 913
13288 MARSEILLE Cedex 09
web site: http://www.attaccalite.com
[CNRS/ Aix-Marseille Université/ CINaM laborarory / TSN department
Campus de Luminy – Case 913
13288 MARSEILLE Cedex 09
web site: http://www.attaccalite.com
-
- Posts: 27
- Joined: Thu Nov 14, 2024 1:10 pm
Re: algebra driver error
sir,
these are the files u requested , please kindly look into it suggest where did i go wrong .
best regards,
Sohan
these are the files u requested , please kindly look into it suggest where did i go wrong .
best regards,
Sohan
You do not have the required permissions to view the files attached to this post.
Sohan
M.Sc. (Physics)
Central University of Punjab, India
M.Sc. (Physics)
Central University of Punjab, India
- claudio
- Posts: 526
- Joined: Tue Mar 31, 2009 11:33 pm
- Location: Marseille
- Contact:
Re: algebra driver error
Dear Sohan
there is problem between your input and your system.
You want to use bands between 3 and 6, but when I read the setup file
I see that you are simulation MoS2 with 13 filled band, and this make the system crach.
I think you are using Yambo input for hBN for MoS2, you have to change number of bands
incluse some valence and some conduction.
best
Claudio
there is problem between your input and your system.
You want to use bands between 3 and 6, but when I read the setup file
I see that you are simulation MoS2 with 13 filled band, and this make the system crach.
I think you are using Yambo input for hBN for MoS2, you have to change number of bands
incluse some valence and some conduction.
best
Claudio
Claudio Attaccalite
[CNRS/ Aix-Marseille Université/ CINaM laborarory / TSN department
Campus de Luminy – Case 913
13288 MARSEILLE Cedex 09
web site: http://www.attaccalite.com
[CNRS/ Aix-Marseille Université/ CINaM laborarory / TSN department
Campus de Luminy – Case 913
13288 MARSEILLE Cedex 09
web site: http://www.attaccalite.com
-
- Posts: 27
- Joined: Thu Nov 14, 2024 1:10 pm
Re: algebra driver error
Dear sir,
Thank you for the prompt reply, i'll let u know if the error still persists after varying the NLbands.
best
Sohan
Thank you for the prompt reply, i'll let u know if the error still persists after varying the NLbands.
best
Sohan
Sohan
M.Sc. (Physics)
Central University of Punjab, India
M.Sc. (Physics)
Central University of Punjab, India