Bethe-Salpeter
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Header
In this tutorial
subheader
BSE Tutorials at present:
- SiH_4
- Fantastic dimension
- LiF
- you Hydrogen
- GaSb (SOC)
- hexagonal BN (on slides only)
The material
- [1]
- Cell :
- Plane waves cutoff 40 Ry
Calculate screening
A key ingredient in the construction of the BS kernel is the screened electron-electron interaction W which is commonly evaluated in the static approximation. yambo -b -F 05_W.in
Steps:
-Calculate screening
-Calculate matrix elements
-Diagonalize Matrix and calculate spectrum
-Visualize/Analyze excitons (with ypp)
-How to Converge
-How to work with SOC