[QE-users] Electric Field
Ubaid Mohd
onlymubaid at gmail.com
Fri Oct 12 16:50:07 CEST 2018
Dear experts,
I am doing electronic structure calculations of van der
Waal heterostructure devices. I have done all vc-relaxation and electronic
structure calculations. Now I want to introduce an external electric field
perpendicular to the 2D system. I have been work on the tutorial examples
related to the electric field given in the espresso.
How should I start the electric field calculations? Can I start scf
calculations with the relaxed parameters for electric field or I have to
relax the system for each value of the electric field?
I would appreciate any help on the subject.
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