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    4 repositories

    • ML-GWBSE

      Public
      Python codes to develop ML models using GW-BSE database and applying it with Materials Project data
      Python
      •0•0•0•0•Updated Apr 29, 2024Apr 29, 2024

    • pyGWBSE

      Public
      python workflow for GW-BSE calculation
      Jupyter Notebook
      •
      GNU General Public License v3.0
      •10•25•3•0•Updated Jun 16, 2023Jun 16, 2023

    • Hetero2d

      Public
      Automate the discovery of stable 2D materials stacked on substrates (either another 2d or substrate surface)! Compute the properties of the interacting system!
      automationdensity-of-statesheterostructurecharge-transfer2d-materialsdft-calculations
      Python
      •
      GNU General Public License v3.0
      •2•11•1•0•Updated May 8, 2023May 8, 2023

    • SSMC

      Public
      Screening code for SSMC project
      Python
      •0•1•0•0•Updated Jun 13, 2020Jun 13, 2020