Thank you very much Dear Lorenzo. I will do it. Regards Bhamu
On Mon, Nov 4, 2019 at 2:15 PM Lorenzo Paulatto <paul...@gmail.com> wrote: > you can just edit by hand the dyn1 file and remove the dielectric > constants and effective charges, then rerun q2r > > regards > > On 11/4/19 9:29 AM, Dr. K. C. Bhamu wrote: > > Dear Lorenzo, > > > > My motive is to plot phonon band structure with and without LO-TO > > splitting in a single plot and I would run (may be wrong but giving it > > a try)two separate gamma calculation one with epsil=.false. and other > > with .true.for this. > > > > If you have any previous experiencethen you can save my computational > time. > > > > regards > > Bhamu > > > > > > On Mon, Nov 4, 2019 at 1:46 PM Lorenzo Paulatto <paul...@gmail.com > > <mailto:paul...@gmail.com>> wrote: > > > > > Could someone please guide me how to plot phonon band structure > with the > > > LO-TO splitting? > > > > LO-TO splitting is automatically included if you do the phonon > > calculation for an insulator (i.e. no smearing in pw.x) > > > > kind regards > > > > -- > > Lorenzo Paulatto - Paris > > _______________________________________________ > > Quantum ESPRESSO is supported by MaX > > (www.max-centre.eu/quantum-espresso > > <http://www.max-centre.eu/quantum-espresso>) > > users mailing list users@lists.quantum-espresso.org > > <mailto:users@lists.quantum-espresso.org> > > https://lists.quantum-espresso.org/mailman/listinfo/users > > > > > > _______________________________________________ > > Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso > ) > > users mailing list users@lists.quantum-espresso.org > > https://lists.quantum-espresso.org/mailman/listinfo/users > > > > -- > Lorenzo Paulatto - Paris > _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso) > users mailing list users@lists.quantum-espresso.org > https://lists.quantum-espresso.org/mailman/listinfo/users
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