Description
Sample simulations input/output files used for the publication titled "Accurate Free Energies of Aqueous Electrolyte Solutions from Molecular Simulations with Non-polarizable Force Fields". Please read the README files for more details and refer to the main manuscript for more details: https://pubs.acs.org/doi/full/10.1021/acs.jpclett.4c00428
| Date made available | 25 Apr 2024 |
|---|---|
| Publisher | TU Delft - 4TU.ResearchData |
Research output
- 1 Article
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Accurate Free Energies of Aqueous Electrolyte Solutions from Molecular Simulations with Non-polarizable Force Fields
Habibi, P., Polat, H. M., Blazquez, S., Vega, C., Dey, P., Vlugt, T. J. H. & Moultos, O., 2024, In: The Journal of Physical Chemistry Letters. 15, 16, p. 4477-4485 9 p.Research output: Contribution to journal › Article › Scientific › peer-review
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