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Error and timing analysis of multiple time-step integration methods for molecular dynamics.

, , , and . Comput. Phys. Commun., 176 (4): 271-291 (2007)

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Samuel James Tovey University of Stuttgart

Replication Data for: Generating Minimal Training Sets for Machine Learned Potentials, , and . Dataset, (2024)Related to: Jan Finkbeiner, Samuel Tovey, Christian Holm: Generating Minimal Training Sets for Machine Learned Potentials (2023). arXiv: 2309.03840.
 

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