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1. PyFockPyFockPublic

   An efficient and fully parallelized pure python DFT and electronic structure code with GPU acceleration through just-in-time compilation

   Python 69 11

2. PyFock-GUIPyFock-GUIPublic

   A streamlit web application for running PyFock interactively on the web or your own PC.

   Python 13 3

3. crysx_nncrysx_nnPublic

   A simplistic and efficient pure-python neural network library from Phys Whiz.

   Python 23 3

4. RIPER-Tools-for-TURBOMOLERIPER-Tools-for-TURBOMOLEPublic

   A streamlit web app to help you with setting up DFT calculations for the RIPER module of TURBOMOLE and to analyze the results

   Python 5 2

5. VASP-GUIVASP-GUIPublic

   A web app to help create POSCAR and INCAR files for VASP

   Python 11 3