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"The VENUS/NWChem software package. Tight coupling between chemical ..."

Upakarasamy Lourderaj et al. (2014)

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DOI: 10.1016/J.CPC.2013.11.011

access: closed

type: Journal Article

metadata version: 2022-12-07

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Upakarasamy Lourderaj, Rui Sun, Swapnil C. Kohale, George L. Barnes, Wibe A. de Jong, Theresa L. Windus, William L. Hase:
The VENUS/NWChem software package. Tight coupling between chemical dynamics simulations and electronic structure theory. Comput. Phys. Commun. 185(3): 1074-1080 (2014)

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