Processing of wave functions

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Folder 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:

$$\begin{pmatrix} u_n(x,y,z)\\\ v_n(x,y,z) \end{pmatrix}= \begin{pmatrix} u_{n,k_y,k_z}(x)\\\ v_{n,k_y,k_z}(x) \end{pmatrix}\dfrac{1}{\sqrt{L_y}}e^{ik_y y}\dfrac{1}{\sqrt{L_z}}e^{ik_z z}$$

Moreover, you need to normalize the wave-functions by yourself.

Explore these files to learn more:

• see: st-processwf-1d-template.c 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:

$$\begin{pmatrix} u_n(x,y,z)\\\ v_n(x,y,z) \end{pmatrix}= \begin{pmatrix} u_{n,k_z}(x,y)\\\ v_{n,k_z}(x,y) \end{pmatrix}\dfrac{1}{\sqrt{L_z}}e^{ik_z z}$$

Moreover, you need to normalize the wave-functions by yourself.

Explore these files to learn more:

• see: st-processwf-2d-template.c for the template.
• see: 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.