Dear sir,
How to get the electrical potential of each atom for the VBM correction of
defect study?
Using the postprocess PP, we can only get the total potential 1D 2D or 3D by
setting the "iflag".
But I want the get the electrical potential of each atom after relaxing the
supercell. Any advice will be appreciated.
Thanks a lot.
regards
Jianchun wu
Department of physics
Soochow university,China
215006
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