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  1. YAIV YAIV Public

    Python toolkit for analyzing and visualizing first-principles condensed-matter calculations. It reads outputs from Quantum ESPRESSO, VASP, and related tools to explore structures, electronic bands,…

    Jupyter Notebook 5 1

  2. dftCaddie dftCaddie Public

    A configurable terminal tool for preparing reproducible DFT calculation workflows from your own templates, defaults, and cluster settings.

    Python 2