Hi Poonam, You can use XCrySDen to find the high symmetry k-points. http://www.xcrysden.org/
Regards, On Thu, May 20, 2021 at 5:18 PM Poonam Kaushik <poonamkaushi...@gmail.com> wrote: > Dear Sir, > This is true but how do I know like gamma point is at 000 but > rest coordinate how to find that is the question. > > Thanks and regards, > Poonam Sharma > > > > > > ------------------------------------------------------------------------------------------------- > Poonam Sharma > Research Scholar > Department of Physics > Indian Institute of Technology Bombay > Mumbai - 400076 > India. > > > > On Wed, May 19, 2021 at 7:14 PM Poonam Kaushik <poonamkaushi...@gmail.com> > wrote: > >> Dear all, >> I have one query about the high symmetry path for plotting the band >> structure. From the CIF file, I can calculate the high symmetry path of any >> material, but in previous research papers if saw the high symmetry path it >> is different from my one. So for the matching purpose that my band >> structure is also correct, how can I obtained the same path as mentioned in >> the literature. >> Also, I observed on ' Material Cloud' the band structure of the same >> material as I want, I downloaded the CIF file from there but the high >> symmetry path is coming different as they mention (on the Material Cloud). >> I'll be very thankful if someone suggests me something about this. >> >> Thanks and regards, >> Poonam Sharma >> >> >> >> >> >> ------------------------------------------------------------------------------------------------- >> Poonam Sharma >> Research Scholar >> Department of Physics >> Indian Institute of Technology Bombay >> Mumbai - 400076 >> India. >> >> _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu) > users mailing list users@lists.quantum-espresso.org > https://lists.quantum-espresso.org/mailman/listinfo/users -- Manoar Hossain Research Scholar School of Physical Sciences National Institute of Science Education and Research (NISER) Bhubaneswar, Jatni, Khurda, Odisha, 752050, INDIA
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