[Pw_forum] q-point list in matdyn.in

Subhodip Chatterjee subhopcqc at gmail.com
Fri Aug 5 10:38:14 CEST 2016


Dear all,

I'm willing to perform phonon dispersion calculation. I was checking the
tutorial,
http://www.fisica.uniud.it/~giannozz/QE-Tutorial/tutorial_disp.html

In the file si.matdyn.in (please find it as attachment), there is a list of
q-points. How these points are generated? More precisely, how to generate
the q-points while doing this calculation for my system?

Best regards
Subhodip
-- 
*Subhodip Chatterjee*

*Junior Research Fellow*

*Department of Chemistry*
*University of Calcutta*
*Kolkata, India*
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