[Pw_forum] Phonon calculations for functionalized frequencies.

gangotri dey holyriver6 at gmail.com
Tue May 17 18:21:18 CEST 2016


I am trying to extract the IR and Raman frequencies  of my functionalized
frequencies. I have successfully done my geometry relaxation. However, when
I am doing the Phonon calculations it shows me this problem,

"Error in routine phq_readin (1):
     no elec. field with metals"

I do not understand the reason for this problem. If anyone has some idea,
it will be highly appreciated.

*Thank you*

*Gangotri Dey*
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