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1. OCR_handwriting OCR_handwriting Public

   OCR processing of a handwritten file.

   Jupyter Notebook 2

2. dopingflow dopingflow Public

   Python

3. bader4vasp bader4vasp Public

   C++ implementation of Bader analysis charge extraction from VASP output

   C++ 7

4. Adsorption Adsorption Public

   This Python script facilitates the adsorption of complex molecules onto surfaces.

   Python

5. slab_creator slab_creator Public

   Python script facilitates the creation of slab structures with desired orientations.

   Python

6. Optical-properties Optical-properties Public

   Python code for calculating the optical properties based on density functional theory generated from quantum espresso software.

   Python 3