Forum EPW
http://epwforum.uk/

Printing all the elements of mobility for metals
http://epwforum.uk/viewtopic.php?f=3&t=708
Page 1 of 1

Author:  hk66 [ Thu Sep 27, 2018 8:44 am ]
Post subject:  Printing all the elements of mobility for metals

Dear all,

I am using Si example for mobility calculation. I have two questions:
1- How can I print all the elements required for mobility calculation, including mode-dependent velocity, relaxation time and derivative of distribution function, as output? My goal is to recover the calculated mobility from a summation over all bands and k-points. In fact, I want to calculate electron thermal conductivity; so I need to have all the elements again.
2- Is it possible to do this simulation for metals? For example, I know QE have issues with the ph.x calculation of metals which is required for the phonon part of this calculation.

Thanks in advance for your kind responses.
Best regards,
Hamed

Page 1 of 1 All times are UTC
Powered by phpBB © 2000, 2002, 2005, 2007 phpBB Group
http://www.phpbb.com/