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Research data supporting Quadrupole-mediated dielectric response and the charge-asymmetric solvation of ions in water


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Description

Contains the charging free energies for the solutes investigated, and a python script that applies finite size corrections and produces data derived from the charging free energies. See the README file for more information.

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Software / Usage instructions

Python, Matplotlib, SciPy

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Rights and licensing

Except where otherwised noted, this item's license is described as Attribution 4.0 International (CC BY 4.0)
Sponsorship
Royal Commission for the Exhibition of 1851 US Department of Energy, Office of Basic Energy Science