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Data associated with the publication 'Stochastic density functional theory for ions in a polar solvent'

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Recherche Data Gouv France2024-01-01 更新2026-04-09 收录
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These files contain the data that were generated to produced the plots shown on Figures 1 and 2 in our manuscript 'Stochastic density functional theory for ions in a polar solvent'. Each folder corresponds to one subfigure (1, 2a, 2b, 2c, 2d). The data was produced using the explicit formulae obtained from the stochastic density functional theory that is described in the associated manuscript. The numerical parameters are given in the Supplemental Material. We used the software Maple for the numerical evaluations of the formulae.
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2024-01-01
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