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Predicting Frequency from the External Chemical Environment: OH Vibrations on Hydrated and Hydroxylated Surfaces
[Image: see text] Robust correlation curves are essential to decipher structural information from IR-vibrational spectra. However, for surface-adsorbed water and hydroxides, few such correlations have been presented in the literature. In this paper, OH vibrational frequencies are correlated against...
Autores principales: | Röckert, Andreas, Kullgren, Jolla, Hermansson, Kersti |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2022
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9753585/ https://www.ncbi.nlm.nih.gov/pubmed/36458913 http://dx.doi.org/10.1021/acs.jctc.2c00135 |
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