[Pw_forum] IR_RAMAN Spectra

Mofrad, Amir Mehdi (MU-Student) amzf5 at mail.missouri.edu
Thu Oct 22 18:46:00 CEST 2015


Dear all,


I would like to get the IR and Raman spectra of silicon using Quantum Espresso. So far I have realized that the prerequisites for such a purpose is to do scf calculation, phonon calculation, and diagonalization. However, I am not sure if I have followed the procedure properly. I would really appreciate it if someone would tell me a step by step instruction to reach that goal.


Best regards,


Amir M. Mofrad

University of Missouri
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