[Pw_forum] Reg: Plotting of phonon dispersion with inclusion of spin-orbit coupling

pachineela rambabu rams.hcu at gmail.com
Mon Dec 25 08:40:16 CET 2017


Dear Forum,
                 I have run a ph.x calculation for phonon dispersion
including spin-orbit coupling using 4x4x4 grid with qe5.4.0. version. At
the end of the calculation, I got dyn files in case.dyn.xml format instead
of case.dyn. Here I am unable to use this case.dyn.xml for further running
q2r.x and matdyn.x to obtain case.fc and case.freq. Please help me in this
regard.

thanks in advance,
-- 
*P. Rambabu*
PhD Scholor
Department of Physics, IIT Hyderabad,
Kandi, SangaReddy, Telangana, India.
Mobile: 9074508220.
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