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Transport in 2D system 
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Joined: Mon Dec 26, 2016 10:49 am
Posts: 22
University: Inner Mongolian Univ
Post Transport in 2D system
Dear all,
I dig into the module of tranport_iter.f90 and find:
inv_cell = 1.0d0/omega
! for 2d system need to divide by area (vacuum in z-direction)
IF ( system_2d ) &
inv_cell = inv_cell * at(3,3) * alat

in the last line, what the at(3,3) doea mean? And, does this means the 2D system is considered automatically if
'system_2d' is activated?


Fri Oct 12, 2018 3:01 pm
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Joined: Wed Jan 13, 2016 7:25 pm
Posts: 573
University: Oxford
Post Re: Transport in 2D system
Dear Shudong,

2D system are not yet supported in EPW. This is just the start of an implementation but other things need to be fixed to make 2D materials works.

Best wishes,

Dr. Samuel Poncé
Department of Materials
University of Oxford
Parks Road
Oxford OX1 3PH, UK

Mon Oct 15, 2018 1:45 pm
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