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1. dftfe dftfe Public

   DFT-FE: Real-space DFT calculations using Finite Elements

   C++ 159 46

2. dftfe-benchmarks dftfe-benchmarks Public

   Gnuplot 5 3

3. dft-efe dft-efe Public

   Real-space DFT calculations using Enriched Finite Elements(EFE)

   C++ 8 3

4. install_DFTFE install_DFTFE Public

   Installation and run scripts for https://github.com/dftfeDevelopers/dftfe on various machines (OLCF Frontier, NERSC Perlmutter, ALCF Polaris, UMICH Greatlakes)

   Shell 2 6

5. mlxc mlxc Public

   A repository of machine-learning (ML) based exchange-correlation (XC) functionals

   4

6. invDFT invDFT Public

   A finite-element based CPU-GPU tool for accurate inverse DFT calculations

   C++ 7