[Pw_forum] Dynamical Matrix at the equivalent q-points in phonon dispersion calculations

xirainbow nkxirainbow at gmail.com
Thu Sep 24 13:26:11 CEST 2009


Dear Liu:
If you just want to perform q2r calculation, I do not think you have to get
daynamic matrix manually.
You can follow example 06 to fulfill your calculation :)

____________________________________
Hui Wang
School of physics, Nankai University, Tianjin, China
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