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1. NepTrainKit NepTrainKit Public

   NepTrainKit is a Python package for visualizing and manipulating training datasets for NEP.

   C++ 33 5

2. NepTrain NepTrain Public

   An automated toolkit for training neural network potentials (NEP), integrating tools like GPUMD, VASP, and NEP for streamlined workflows including perturbation, active learning, single-point energy…

   C++ 14 3

3. VaspTool VaspTool Public

   Python 9 1