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- W2011050261 abstract "A study of hydrogen (H) bonding in the bihalide ions HCl2−, HBr2−, HI2−, and BrHCl− is reported. Using a semiempirical method reported earlier for HF2− and H5O2+ ions, this study extends the calculations to a series of H bonded species for which comparatively limited amounts of data are available. This procedure has enabled us to quantitatively discuss the shape of the potential energy surface governing the vibrational motion of the complex, to predict properties not yet observed in the laboratory, and to suggest a means by which the vibrational states of the complex (X–H⋯Y) may be correlated with those of its component parts (X–H and H–Y)." @default.
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- W2011050261 date "1974-04-15" @default.
- W2011050261 modified "2023-10-10" @default.
- W2011050261 title "Hydrogen bonding in the bihalide ions" @default.
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