Running Yambo
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Initialization
Concerns any physical issues arising during the setup step (-i option). This includes problems with symmetries, k/q-point sets, and so on. For technical problems (running in parallel, etc), refer to the Technical forum.
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, Daniele Varsano -
Topics: 103
Posts: 707 -
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Re: Not enough states to conv…
by Davide Sangalli View the latest post
Fri Feb 02, 2024 10:31 am
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Linear Response and Screening in reciprocal space
Deals with issues related to computation of optical spectra in reciprocal space: RPA, TDDFT, local field effects.
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano, Conor Hogan -
Topics: 424
Posts: 2547 -
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Re: Questions about TDDFT and…
by Daniele Varsano View the latest post
Fri Mar 15, 2024 4:36 pm
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GW calculations
Concerns issues with computing quasiparticle corrections to the DFT eigenvalues - i.e., the self-energy within the GW approximation (-g n), or considering the Hartree-Fock exchange only (-x)
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano -
Topics: 348
Posts: 2106 -
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Re: Solution for unsatisfacto…
by peiogargor View the latest post
Mon Mar 25, 2024 5:41 pm
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Bethe Salpeter
Deals with issues related to computation of optical spectra, solving the Bethe-Salpeter equation.
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano -
Topics: 46
Posts: 342 -
Last post
Re: too many communicators pa…
by Davide Sangalli View the latest post
Wed Mar 20, 2024 5:59 pm
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Electron-Phonon effects (yambo_ph)
Deals with issues related to electron-phonon coupling calculations
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano -
Topics: 7
Posts: 18 -
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Variable of ex-ph matrix elem…
by pangrt View the latest post
Tue Mar 12, 2024 4:20 am
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Non linear optics (yambo_nl)
Questions and doubts about features of non linear optic in Yambo (yamb_nl)
Moderators: Davide Sangalli, claudio, myrta gruning -
Topics: 38
Posts: 197 -
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Re: Question concerning the c…
by claudio View the latest post
Thu Mar 28, 2024 10:45 am
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Real time propagation (yambo_rt)
Questions and doubts about features of real-time Yambo (yamb_rt)
Moderators: Davide Sangalli, andrea.ferretti, myrta gruning, andrea marini, Daniele Varsano -
Topics: 0
Posts: 0 - No posts
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Other issues
Run-time issues concerning Yambo that are not covered in the above forums.
Moderators: myrta gruning, andrea marini, Daniele Varsano, Conor Hogan -
Topics: 263
Posts: 1338 -
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exciton wavefunction
by WEIW View the latest post
Thu Mar 28, 2024 11:31 am
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Post-Doc position in Milano: ab initio simulations within Many Body Perturbation Theory
by Davide Sangalli » Tue Feb 06, 2024 3:56 pm » in Announcements and Job offers -
Replies: 0
Views: 18431 -
Last post by Davide Sangalli
Tue Feb 06, 2024 3:56 pm
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4 PhD positions to work on the yambo code, as part of the TIMES doctoral network
by Davide Sangalli » Mon Jan 29, 2024 5:58 pm » in Announcements and Job offers -
Replies: 0
Views: 17782 -
Last post by Davide Sangalli
Mon Jan 29, 2024 5:58 pm
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Views: 131051 -
Last post by andrea marini
Wed Apr 08, 2009 9:05 am