[QE-users] phonon dos

[Ing. Martin Matas]

Dear Sohail,
I think the boolean value should not be '.true.' but only .true.
Best regards,
Martin Matas
University of West Bohemia
Czech Republic


On Sat, 5 Dec 2020, 12:59 Sohail Ahmad via users, <users at lists.quantum-espresso.org> wrote:
> 
> > Dear QEusers,
> >  I am using QE 6.5 and got dispersion curve but it gives error in
> > calculating phonon dos
> > pls check input, if there is any error
> >
> > &input
> >  asr = 'simple',
> >  dos = '.true.',
> >  amass(1) = 51.99,
> >  amass(2) = 28.08,
> >  amass(3) = 58.69,
> >  flfrc = 'NiCrSi.fc',
> >  fldos = 'NiCrSi.phdos',
> >  nk1 = 8, nk2 = 8, nk3 = 8,
> > /
> >
> > ---------------------------------------------------------------------
> >
> > Dr. Sohail Ahmad
> >
> > Department of Physics
> >
> > Faculty of Science, P. O. Box - 9004
> >
> > King Khalid University
> >
> > Abha, Saudi Arabia
> >
> >
> > --------------------------------------------------------------------
> > _______________________________________________
> > Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> > users mailing list users at lists.quantum-espresso.org
> > https://lists.quantum-espresso.org/mailman/listinfo/users
> >