Dressing a Nonpolarizable Force Field for OH<sup>–</sup> in TIP4P/2005 Aqueous Solutions with Corrected Hirshfeld Charges-Reference-Cited by-同舟云学术

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Dressing a Nonpolarizable Force Field for OH^– in TIP4P/2005 Aqueous Solutions with Corrected Hirshfeld Charges

Published:2024-09-09 Issue: Volume: Page:9411-9418
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

de Lucas Marcos¹,Blazquez Samuel¹^ORCID,Troncoso Jacobo²^ORCID,Vega Carlos¹^ORCID,Gámez Francisco¹^ORCID

Affiliation:

1. Departamento de Química Física I, Fac. Ciencias Químicas, Universidad Complutense de Madrid, 28040 Madrid, España

2. Departamento de Física Aplicada, Universidade de Vigo, Escola de Enxeñaría Aeronaútica e do Espazo, E 32004, Ourense, España

Funder

Ministerio de Ciencia, Innovaci?n y Universidades

Ayuntamiento de Madrid for a Residencia de Estudiantes

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.4c02261

Reference58 articles.

1. Subtle changes in pH affect the packing and robustness of fatty acid bilayers

2. Recent development of hydrogen and fuel cell technologies: A review

3. A general purpose model for the condensed phases of water: TIP4P/2005

4. The structure of aqueous sodium hydroxide solutions: A combined solution x-ray diffraction and simulation study

5. Collective vibrations of water-solvated hydroxide ions investigated with broadband 2DIR spectroscopy

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