Dear Mayuri Bora, There are some examples inside the PP directory of the QE package, for example, example04, example05, fermisurf_example, ForceTheorem_example, ForceTheorem_example, and MolDos_example. I believe the first two are sufficient.
Hope it helps. Best wishes, Marcelo Albuquerque Ph.D. Candidate Institute of Physics Fluminense Federal University NiterĂ³i/RJ - Brazil On Thu, Jun 24, 2021 at 7:01 AM Mayuri Bora wrote: > > Message: 1 > Date: Wed, 23 Jun 2021 15:59:27 +0530 > From: "Mayuri Bora" <mayu...@tezu.ernet.in> > To: users@lists.quantum-espresso.org > Subject: Re: [QE-users] Projected Band structure > Message-ID: > <46e2400b9459a4a3da9fc5e720bdc243.squir...@webmail.tezu.ernet.in> > Content-Type: text/plain;charset=utf-8 > > I am waiting for the reply. > > Thanks in advance. > > > > Dear QE Users > > > > Currently i am working on a heterostructure consisting of semimetal and > > ferromagnetic insulator. I am stuck in projecting the band structure > > exactly on which portion i have to project the band structure i am bit > > stuck in it. However, i have given nband=150 for k-points 6 6 1. > > > > I will be thankful for the help. > > > > regards > > Mayuri > > > > Mayuri Bora > > INSPIRE Fellow > > Advanced Functional Material Laboratory > > Tezpur University > > Napaam > > http://www.tezu.ernet.in/afml/ > > > > > > * * * D I S C L A I M E R * * * > > This e-mail may contain privileged information and is intended solely for > > the individual named. If you are not the named addressee you should not > > disseminate, distribute or copy this e-mail. Please notify the sender > > immediately by e-mail if you have received this e-mail in error and > > destroy it from your system. Though considerable effort has been made to > > deliver error free e-mail messages but it can not be guaranteed to be > > secure or error-free as information could be intercepted, corrupted, > lost, > > destroyed, delayed, or may contain viruses. The recipient must verify the > > integrity of this e-mail message. > > > > > Mayuri Bora > INSPIRE Fellow > Advanced Functional Material Laboratory > Tezpur University > Napaam > http://www.tezu.ernet.in/afml/ > > > * * * D I S C L A I M E R * * * > This e-mail may contain privileged information and is intended solely for > the individual named. If you are not the named addressee you should not > disseminate, distribute or copy this e-mail. Please notify the sender > immediately by e-mail if you have received this e-mail in error and destroy > it from your system. Though considerable effort has been made to deliver > error free e-mail messages but it can not be guaranteed to be secure or > error-free as information could be intercepted, corrupted, lost, destroyed, > delayed, or may contain viruses. The recipient must verify the integrity of > this e-mail message. > > > ------------------------------ > > >
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