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並前往https://compphysvienna.github.io/n2p2/tools/nnp-prune.html

nnp-prune — n2p2 - A neural network potential package ...

The first step is to calculate all symmetry functions with nnp-scaling: mpirun -np 4 nnp-scaling 500. This will produce the file scaling.data where minimum, ...

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