[Pw_forum] Partial phonon DOS

GAO Zhe flux_ray12 at 163.com
Mon Oct 24 11:20:07 CEST 2011


You can just use QHA in QE after IFCs calculated, then ph-pdos will be obtained directly.


--
GAO Zhe
CMC Lab, MSE, SNU, Seoul, S.Korea


At 2011-10-24 14:23:18,"jayashree.pan at jncasr.ac.in" <jayashree.pan at jncasr.ac.in> wrote:

Hi,
I am a new Quantum Espresso user. I am doing phonon calculation and I also want to do partial phonon DOS using QE. 
There are some old posts from Prof.Eyvaz Isaev and Dr.Subhradip Ghosh, where they ware talking about it. 
Please help me if anyone know how to do it.
Thank you.
Jayashree 
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