|
|
[[_TOC_]]
|
|
|
|
|
|
Folder [extensions/post-processing-wf](https://gitlab.fizyka.pw.edu.pl/wtools/wslda/-/tree/public/extensions/post-processing-wf) contains templates of scripts for processing of the results
|
|
|
|
|
|
# Processing of wave-functions generate by st-wslda-1d code
|
|
|
When processing wave-functions you need to remember that full form of the quasi-particle orbital is:
|
|
|
```math
|
|
|
\begin{pmatrix}
|
|
|
u_n(x,y,z)\\
|
|
|
v_n(x,y,z)
|
|
|
\end{pmatrix}=
|
|
|
\begin{pmatrix}
|
|
|
u_{n,k_y,k_z}(x)\\
|
|
|
v_{n,k_y,k_z}(x)
|
|
|
\end{pmatrix}\dfrac{1}{\sqrt{L_y}}e^{ik_y y}\dfrac{1}{\sqrt{L_z}}e^{ik_z z}
|
|
|
```
|
|
|
Moreover, you need to normalize the wave-functions by yourself.
|
|
|
|
|
|
Explore these files to learn more:
|
|
|
* see: [st-processwf-1d-template.c](https://gitlab.fizyka.pw.edu.pl/wtools/wslda/-/blob/public/extensions/post-processing-wf/st-processwf-1d-template.c) for the template.
|
|
|
|
|
|
# Processing of wave-functions generate by st-wslda-2d code
|
|
|
When processing wave-functions you need to remember that full form of the quasi-particle orbital is:
|
|
|
```math
|
... | ... | @@ -14,5 +34,5 @@ v_{n,k_z}(x,y) |
|
|
Moreover, you need to normalize the wave-functions by yourself.
|
|
|
|
|
|
Explore these files to learn more:
|
|
|
* see: [st-processwf-2d-template.c](https://gitlab.fizyka.pw.edu.pl/wtools/wslda/-/blob/public/extensions/post-processing-wf/st-processwf-2d-template.c) for the template
|
|
|
* see: [st-processwf-2d-template.c](https://gitlab.fizyka.pw.edu.pl/wtools/wslda/-/blob/public/extensions/post-processing-wf/st-processwf-2d-template.c) for the template.
|
|
|
* see: [st-Lz-quantum-numbers-2d.c](https://gitlab.fizyka.pw.edu.pl/wtools/wslda/-/blob/public/extensions/post-processing-wf/st-Lz-quantum-numbers-2d.c) for an example demonstrating of extraction of an expectation value of the angular momentum operator for each quasi-particle state. |