modify switching script & small changes in neq.py

wiederm / endstate_correction

Endstate corrections from MM to QML potential

https://wiederm.github.io/endstate_correction/

MIT License

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Closed saratk1 closed 2 years ago

saratk1 commented 2 years ago

Provide a brief description of the PR's purpose here.

Notable points that this PR has either accomplished or will accomplish.