[Pw_forum] electrochemical potential

Masoud Nahali masoudnahali at live.com
Tue Jun 29 08:06:43 CEST 2010


Dear QE users

How can one apply electrochemical potential to a metal  in quantum espresso? for example +0.2 or +1.0 that is proper for oxidation and also negative extents like -0.3 and -1.5.
I think that it may related to fermi level but I can not apply. 
I appreciate to your help.

very best wishes

Masoud Nahali
Sharif University of Technology
Ph. D student of physical chemistry

 		 	   		  
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