"RPMDrate: Bimolecular chemical reaction rates from ring polymer molecular ..."

Yury V. Suleimanov, Joshua W. Allen, W. H. Green (2013)

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DOI: 10.1016/J.CPC.2012.10.017

access: closed

type: Journal Article

metadata version: 2023-10-08

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Yury V. Suleimanov, Joshua W. Allen, W. H. Green:
RPMDrate: Bimolecular chemical reaction rates from ring polymer molecular dynamics. Comput. Phys. Commun. 184(3): 833-840 (2013)

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