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The Effects of Dissolved Halide Anions on Hydrogen Bonding in Liquid Water
Abstract
It is widely believed that the addition of salts to water engenders structural changes in the hydrogen-bond network well beyond the adjacent shell of solvating molecules. Classification of many ions as "structure makers" and "structure breakers" has been based in part on corresponding changes in the vibrational spectra (Raman and IR). Here we show that changes in O-H vibrational spectra induced by the alkali halides in liquid water result instead from the actions of ions' electric fields on adjacent water molecules. Computer simulations that accurately reproduce our experimental measurements suggest that the statistics of hydrogen-bond strengths are only weakly modified beyond this first solvation shell.
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Cites
Lee, C., Yang, W., & Parr, R. G. (1988) · Physical Review B · doi:10.1103/physrevb.37.785 · Cited by 100,874
A new mixing of Hartree–Fock and local density-functional theories
Becke, A. D. (1993) · The Journal of Chemical Physics · doi:10.1063/1.464304 · Cited by 16,515
Cited by
Materials for solar-powered water evaporation
Zhao, F., Guo, Y., Zhou, X., Shi, W., & Yu, G. (2020) · Nature Reviews Materials · doi:10.1038/s41578-020-0182-4 · Cited by 1,541
Structure, Dynamics, and Spectral Diffusion of Water from First-Principles Molecular Dynamics
Bankura, A., Karmakar, A., Carnevale, V., Chandra, A., & Klein, M. L. (2014) · The Journal of Physical Chemistry C · doi:10.1021/jp506120t · Cited by 166
Raman spectroscopy of alkali halide hydration: hydrogen bond relaxation and polarization
Gong, Y., Zhou, Y., Wu, H., Wu, D., Huang, Y., & Sun, C. Q. (2016) · Journal of Raman Spectroscopy · doi:10.1002/jrs.4963 · Cited by 40
Metadata
- Authors
- Smith, J. D., Saykally, R. J., & Geissler, P. L.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 2007-10-25
- Volume
- 129
- Issue
- 45
- Pages
- 13847-13856
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2095446120
- Cited by
- 464
- References
- 2
- FWCI
- 14.87
- Type
- journal article
- Language
- en
- Open access
- closed
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- Smith, J. D., Saykally, R. J., & Geissler, P. L. (2007). The Effects of Dissolved Halide Anions on Hydrogen Bonding in Liquid Water. Journal of the American Chemical Society. https://doi.org/10.1021/ja071933z
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