Re: [Pw_forum] keep getting negative frequencies in phonon calculation

2015-08-08 Thread Khalid Ibne Masood Khalid
> On Sat, 8/8/15, Khalid Ibne Masood Khalid <kimu...@gmail.com> wrote: > > Subject: [Pw_forum] keep getting negative frequencies in phonon > calculation > To: "PWSCF Forum" <pw_forum@pwscf.org> > Date: Saturday, August 8, 2015,

Re: [Pw_forum] keep getting negative frequencies in phonon calculation

2015-08-08 Thread David Foster
of Chemistry On Sat, 8/8/15, Khalid Ibne Masood Khalid <kimu...@gmail.com> wrote: Subject: [Pw_forum] keep getting negative frequencies in phonon calculation To: "PWSCF Forum" <pw_forum@pwscf.org> Date: Saturday, August 8, 2015, 12:02 A

[Pw_forum] keep getting negative frequencies in phonon calculation

2015-08-08 Thread Khalid Ibne Masood Khalid
Dear Researchers, I think this is an old problem, but I require your advice about how to solve this problem. I am trying to calculate the phonon dispersion curve of a 2D insulator material, and followed example 02 of phonon program. In the ph.x input file I have used: tr2_ph=1.0d-12,