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The Paraquinone + H2 → Hydroquinone Reaction: A Challenge for Diffusion Monte Carlo Calculations
https://doi.org/10.18126/13xf-0nxn
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This data set contains input and outfiles for the simulations associated with the paper: "The Paraquinone + H2 → Hydroquinone Reaction: A Challenge for Diffusion Monte Carlo Calculations." N, Mauger A. Benali and K. D. Jordan
Nastasia Mauger
Kenneth D. Jordan
Anouar Benali
Benali Anouar (benali@anl.gov)
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January 19, 2024
via DataCite
Dataset published 2024 in
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