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Xavier Andrade edited figures/mask_scheme1/caption.tex
over 9 years ago
Commit id: 093746a6c79fea7529f97b54fa098931877cde37
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\label{fig:pes_sheme}
Scheme illustrating the mask method for the calculation of electron photoemission.
A mask function (a) is used to effectively split each
Khon-Sham Kohn-Sham orbital into bounded and an unbounded
components localized in different spatial regions $A$ and $B$ according to the diagram in (b).
In $A$ the states are represented on a real-space grid while in $B$ they are described in momentum space.
A striped region indicates the volume where the two representations overlap.