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README.md

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PdCuNiP_NEP.zip is a compressed package of files related to neuroevolution potential (NEP) of PdCuNiP alloy, including:

  1. nep.in: This file specifies hyperparameters used for training NEP models.
  2. nep.population160.generation1013200.txt: NEP potential parameters (file).
  3. nep.restart: restart file.
  4. test.xyz: testing dataset.
  5. train.xyz: training dataset.
  6. File description please refer to https://gpumd.org/nep/index.html .