have u got the solution On Sat, Dec 29, 2018 at 4:14 AM Aziz Fall <[email protected]> wrote:
> Dear Quantum Espresso team, > > does anyone still have any ideas? > > Sincerely Aziz Fall > > On Thu, Dec 6, 2018 at 4:18 PM Aziz Fall <[email protected]> wrote: > >> Dear Quantum espresso team, >> >> I have been trying to run a band structure calculation of CrI3, I was >> able to successfully run the scf file, but when I try to run by bands file >> it gives the error that "S matrix is not positive definite" I have attached >> a screenshot of my k-path selection along with the bands.in file any >> help will be greatlly appreciated. >> >> Thank You, >> Sincerely Aziz Fall >> > _______________________________________________ > users mailing list > [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users
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