[DFTB-Plus-User] Calculation of I-V curve under lightirradiation

u3129004 at edu.gifu-u.ac.jp u3129004 at edu.gifu-u.ac.jp
Tue Jan 12 04:19:23 CET 2016


Dear Gabriele,

Thank you very much for your kindness and useful information.

Many thanks,
Kazuma

----- Original Message -----
> On 01/11/2016 02:09 PM, u3129004 at edu.gifu-u.ac.jp wrote:
> > Dear Gabriele,
> >
> > Thank you very much for your help.
> >
> > I would like to ask you one more question.I read the following URL 
page
> > and then went through the same process.
> >
> > http://www.dftb-plus.info/fileadmin/DFTB-Plus/public/recipes-negf/html/transport/example_sinw.html

> >
> >
> > But
> > *The file of tunneling_000001.dat was not found.
> > *plotting the date of detailed.dat, the result of transmission 
function
> > is different (please refer to an attached file).
> 
> The plots look quite close to me (the one on the website is visualized 
> in log scale).
> 
> We changed a bit the structure of input/output and did not updated the 
> online recipes yet; the tunneling_000001.dat is depecrated.
> I suggest you to use the latest MPI version you find on the website 
and 
> give a look to this tutorial 
> http://www.dftb-plus.info/fileadmin/DFTB-Plus/public/tutorials/cecamhp/html/
 
> for comparison.
> 
> Best
> Gabriele
> 
> 
> >
> > What are these causes?
> >
> > Sincerely yours,
> > Kazuma
> >
> > Sincerely yours,
> > Kazuma
> > ----- Original Message -----
> >> Hallo Kazuma,
> >>
> >> even though doable in principle and done by other authors,
> >> electron-photon interaction is not implemented in  dftb+negf.
> >>
> >> Best,
> >> Gabriele
> >>
> >>
> >> On 01/11/2016 12:51 PM, u3129004 at edu.gifu-u.ac.jp wrote:
> >>> Dear DFTB+ users,
> >>>
> >>> I am a biginner of DFTB+ and DFTB+NEGF. I would like to calculate 
I-
> > V
> >>> curve under light irradiation using DFTB+ or DFTB+NEGF.
> >>>
> >>> It would be very helpful if you could provide me any useful
> > information.
> >>> Thank you very much in advance,
> >>> Kazuma
> >>> ---------------------------------------------------
> >>> Kazuma KIHIRA
> >>> Environmental & Renewable Energy Systems Division
> >>> Graduate School of Engineering, Gifu University
> >>> E-mail:u3129004 at edu.gifu-u.ac.jp
> >>> ---------------------------------------------------
> >>>
> >>>
> >>>
> >>>
> >>> _______________________________________________
> >>> DFTB-Plus-User mailing list
> >>> DFTB-Plus-User at mailman.zfn.uni-bremen.de
> >>> https://mailman.zfn.uni-bremen.de/cgi-bin/mailman/listinfo/dftb-plus-user

> >> -- 
> >> Dr. Gabriele Penazzi
> >> BCCMS - University of Bremen
> >>
> >> http://www.bccms.uni-bremen.de/
> >> http://sites.google.com/site/gabrielepenazzi/
> >>
> >> phone: +49 (0) 421 218 9328
> >> fax: +49 (0) 421 218 4764
> >>
> >> _______________________________________________
> >> DFTB-Plus-User mailing list
> >> DFTB-Plus-User at mailman.zfn.uni-bremen.de
> >> https://mailman.zfn.uni-bremen.de/cgi-bin/mailman/listinfo/dftb-plus-user

> >>
> >>
> >> _______________________________________________
> >> DFTB-Plus-User mailing list
> >> DFTB-Plus-User at mailman.zfn.uni-bremen.de
> >> https://mailman.zfn.uni-bremen.de/cgi-bin/mailman/listinfo/dftb-plus-user

> 
> -- 
> Dr. Gabriele Penazzi
> BCCMS - University of Bremen
> 
> http://www.bccms.uni-bremen.de/
> http://sites.google.com/site/gabrielepenazzi/
> 
> phone: +49 (0) 421 218 9328
> fax: +49 (0) 421 218 4764
> 
>  
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