|Source||United States Department of Energy Office of Scientific and Technical Information|
|Publisher||American Institute of Physics (AIP)|
|Subject Keyword||Chemistry-Inorganic, Organic, & Physical Chemistry-Isotopic Effects ♦ Chemistry-Inorganic & Physical Chemistry-Isotope Effects ♦ DEUTERIUM- ISOTOPE EFFECTS ♦ HYDRATION ♦ INFRARED SPECTRA ♦ VIBRATIONAL STATES ♦ WATER|
|Abstract||The separation between uncoupled $nu$sub 3$ and $nu$sub 1$ frequencies of water symmetrically bound in both nonaqueous solvents and hydrates has been shown to vary linearly with the HOD stretching frequency of water, for both H$sub 2$O and D$sub 2$O. This relation, the FS correlation, has been explored theoretically and it has been shown to be useful for estimating geometry changes of water in hydrates, upon deuteration. It is also useful in determining the effect of cation coordination on the stretching frequencies of water molecules. A method is also developed, using this relation, for systematically analyzing the origin of the stretching bands of water in condensed systems. (AIP)|
|Learning Resource Type||Article|
|Publisher Department||Department of Chemistry, Temple University of the Commonwealth System of Higher Education, Philadelphia, Pennsylvania 19122|
|Publisher Place||United States|
|Journal||Journal of Chemical Physics|
|Organization||Department of Chemistry, Temple University of the Commonwealth System of Higher Education, Philadelphia, Pennsylvania 19122|
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