GitHub - Johnson-Wang/molatics: Calculate the auto-correlation function and extract temperature-dependent force constants from MD simulations.

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Calculate the auto-correlation function and extract temperature-dependent force constants from MD simulations.

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Name		Name	Last commit message	Last commit date
Latest commit History 24 Commits
c		c
examples		examples
mdfc		mdfc
realmd		realmd
scripts		scripts
.gitignore		.gitignore
setup.py		setup.py

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Calculate the auto-correlation function and extract temperature-dependent force constants from MD simulations.

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