Masoud Nahali wrote: > 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.
what you can do is to change the charge state of the (super-)cell, using variable "tot_charge" P. -- Paolo Giannozzi, Democritos and University of Udine, Italy
