Dear PWSCF user,
I can calculate the total phonon DOS and now I want to calculate
projected phonon DOS with tetrahedra (associated with specific atom or
vibrational mode in the unit cell). I searched the pw_forum archive but did
not find anything useful. The projwfc.x program can be used to calculate only
electronic projected DOS. I wonder if someone have written a code for
calculating it , or how should I make a subroutine to do it ?
thanks!
Li Niu
Harbin institute of
technology, China
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Mp3???-???????
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