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Polar Optical Phonon Calculation 
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Joined: Tue Sep 19, 2017 12:31 am
Posts: 1
University: Uni. at Buffalo
Post Polar Optical Phonon Calculation
Dear all,
Is there a way to obtain just the POP matrix elements from the code?
In the system that I am studying, the polar optical phonon scattering is the major contributor that inhibits electron mobility. So I just want to analyse the POP modes.

Thank You,
Ankit Sharma

Tue Sep 19, 2017 12:39 am
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Joined: Thu Jan 14, 2016 10:52 am
Posts: 108
University: University of Oxford
Post Re: Polar Optical Phonon Calculation
Dear Ankit,

If you set longrange=.true. you will only include in your calculation the generalized Frohlich matrix element from ... 115.176401
(bear in mind that this will only calculate the long range matrix element using the analytical formula for gL instead of doing the full interpolation of the matrix elements)


Carla Verdi
Department of Materials | University of Oxford
Parks Road | OX1 3PH Oxford

Tue Sep 19, 2017 8:31 am
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